product_smiles,product_name,score,fp,InChI_Key
C1(=C(C(=C(C=C1)Cl)C#N)F)NC[C@@H]2CNCC(O2)(C)C,9C0E392D0175DD7A_8FA1F63E49C35E0A_7022_DP,8.8478365,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101001000110001001000011000000100111110110001011000111110111101111110,IOFIGMRPUUFLBS-VIFPVBQESA-N
C1(=C(C=C(C(=C1)F)C#N)F)NC[C@@H]2CNCC(O2)(C)C,84DD18893D218403_96E71D0F9437E895_7022_DP,8.788951,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110001011000111110111101111110,JZEJLBFHMQTVGO-JTQLQIEISA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCCC3SCCC3,8AB9CCCE144826C5_FDF90507750AB285_6041_UN,8.305332,00000000000000000000000000000000000010100000000000000000000000000100000000000100011100001001000010101100110010010000001011000100110001010110011011010111010110101111010,KTXQTPDHEBYVSB-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)C#N)NC[C@@H]2CNCC(O2)(C)C)F,FBFE29E315096F65_C4549B7BFB97AC3A_6041_DP,8.63909,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110001011000111110111101111110,FDVQZNYLVGRABM-JTQLQIEISA-N
CC1=C(C=C(C(=C1)NCCC3C2CC2CC3)Cl)C4CC4,1307F3F823C71D1D_0BCA7E7E0225DD42_7022_UN,8.287154,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010001000010001001110110010000001000000000110001110000000011010011010110101111010,ZGXPPCAJZHPUPN-UHFFFAOYSA-N
CC1=C(C3=C(C=C1)N=C2CCCCC2=C3NCC4CCCN(C)C4C5=CC=CS5)F,3C7BFF0DBF18BA60_B9D0A6B4C81AE987_6041_UN,8.162491,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011111010110101111010,DDCRFZBDRRNJBQ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@H]2[C@@H](OCC2)C3=CN=CC=C3)F)CC4,FEF1795338B81FE0_578AFA3BAEC81E19_6041_UN,8.404539,00000000000000000001000000000000000000000010000000000000010000100100000000010001100101110011010111101000100111010001101011100100110011110110001011011011110111101111110,HBBYOXMYOMAMOB-YADHBBJMSA-N
CC1=C(C=CC(=C1F)C#N)NCC2C3(CCNC2)CCOCC3,13895C8DDC325EAA_7B26E51CD6A1D478_6041_DP,8.256519,00000000000000000000000000000000000000000110000000000100010000000010000000000000101000110011000000101000110111011000001011000000110111110110001011010011010111101111110,AYHJVNPUKSXYOM-UHFFFAOYSA-N
C2(=C1[NH]C3=C(C1=CC=C2)CCC3)NC4=CN=C([Si](C)(C)C)C=C4,D10E52F09DECDC2B_508BF96BF6798239_6041_UN,7.8502893,00000000000000000000100000000010000000000000000000000010000000000100000000100001000100100011010010100100110000011000001011000100010101010100011011011101000010101111010,ZXDVOAQONLKZCX-UHFFFAOYSA-N
CC1=C(C3=C(C=C1)N=C2CCCCC2=C3NCC4CCN(C)C4C5=CC=CS5)F,82DEE18685E47B88_8718CD9DA74A70DE_6041_UN,8.236188,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011111010110101111010,XFVJLDNVGZPGEB-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,EA2A69871448B4EC_1F1AEC550924B496_6038_UN,8.9417515,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010011100001111100010100110010011001000100110000100100001011010011011110101111110,LQSZOOZVUQIATH-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[NH]C3=C2CCCCCC3)NC4=C[N](C[Si](C)(C)C)N=C4,ECC811B18BE3D5FF_498C9284899BB12F_6041_UN,7.7970796,00000000000000000000100000001010000000000000000000001000000000000100000000110001100100100011011010001100110000011001001011101100110101010100011010011101010110101111010,NRFAEXWVIPIWOB-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2=CC=CC3=C2CCCN3,D4E42F287E917810_3E098BD62555F961_6041_DP,8.244959,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100011010000101100110000011000001011000100110101010110011011011111010110101111010,GPDXJLKIVXYFLS-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NC[C@H]2CNCC(O2)(C)C,BD421B31A3B6157A_0E606E5FBACC53F5_7022_DP,8.691633,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101001000110001001000011000000100111110110001011000111110111101111110,IOFIGMRPUUFLBS-SECBINFHSA-N
CCC5CCC1=C(C4=C(N1CC3(CC2=CC=C(C=C2)F)CCNC3)C=CC(=C4)C)C5,9F396DC3CD40BDC9_8E5A03FD8FE56480_6034_UN,8.7058735,00000000000000000000000000000000000000000010000000000000000000000110000000010000101101110011000010001100110110011010101011100100110000100110001011011101010110101111010,UTVMUZCOGVRJFT-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NCC3CCCN(C)C3C4=CC=CS4,EF45A7EF8D4B2972_0C12466CBC040AC7_6041_UN,8.956986,00000000000000000000000000000000000010000010000000000000000000100100000000010001111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,CRGKEMGETOPHTO-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)C#N)F)NCC2CNCC(O2)(C)C,33EF1A7D1C375CD9_3582A8C6047ED229_7022_DP,8.510167,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110001011000111110111101111110,JZEJLBFHMQTVGO-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NCC2CCNC(C2)(C)C,D58CE8BCEE47518F_89E40E17D5F4E982_7022_DP,8.878247,00000000000000000000000000000000000000000110000000000000000000000010000000100000001000010011000000101001100110011001101001000000110101110110001011010111010110101111010,KSMVAGIWAFZIBX-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCCC2N3CCOCC3)F)CC4,ED11AD6EC7245275_C6E2545ADAC88BAB_6041_UN,7.9390564,00000000000000000001000000000000000000000010000000000000010000100000000000010001101001110011010110101000000111010001101011100000110011110110001011011011010111101111110,UZVLYPDNZYYWRK-UHFFFAOYSA-N
CC1=C(C(=NC(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C)C#N,E6514992C28F7F42_66C1E26AB225E9F5_6041_DP,7.7597694,00000000000000000000000000000000000000100110000000000100000000100100000000000100101000110011000000101000100100010000001011000100110101110110001011010111010110101111010,XYPFAKNRIOWNCO-FUHWJXTLSA-N
FC1=C(C=CC2=C1CCC2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,B68E2928A83F0A89_88811F2FF1159B85_6041_UN,8.151257,00000000000000000000000000000000000000000010000000000000010000100000000000010000101001110001010110101100010111010001101011100100110011110110001011011011110111101111110,KUJBBYBVNFPWJH-FPOVZHCZSA-N
C1(=CC2=C(C=C1)[NH]C=C2C3CC3)NC4=CN=C([Si](C)(C)C)C=C4,6ADEB983C6EADFE5_67AD3714B9F91CC5_6041_UN,8.137732,00000000000000000000101000000010000000000000000000000000000000100100000000100001000100100001010010100100010000001000000011000100000101010100011001011101000010101111010,LWRVQRHYCBULKW-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CCOCC3)C4=CC=C(C=C4)F,3E66E593BFFA99B2_FD751D2C91350469_6041_UN,7.7765746,00000000000000000000001000000000000000000010000000001000010000100110000000010001101100110011011010101000000101001000001011101100110011110110001011011011010111101111110,YIIIKSYLOKEWEH-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCCC3CC(C)OCC3,019848552FE37AE4_378EDAC82FE4AC6C_6041_UN,8.255814,00000000000000000000000000000000000000100000000000000000010000000100000000000100001000000001000000101100110011010001101011000100110011010110011011010111110111101111110,JYTCPQGCQSREKN-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NCC2CNCC(O2)(C)C,E057A4D68BAC9DF4_2CC443F7D98A64B6_7022_DP,8.52526,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101001000110001001000011000000100111110110001011000111110111101111110,IOFIGMRPUUFLBS-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)C2OCCO2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C#N,B30AF2A8A25439B3_9F1267E59DFEBDF0_6041_DP,7.8035502,00000000000000000000000000000000000000000110000000000100010000100000000010000000101100110011000011101000100101010000001011010100110111110110001011010011010111110111110,QFKABZVGMNULHL-DOTOQJQBSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)C[C@H]3NCC[C@@H](CC)C3)Cl,D93B91A53F1FD337_09A4E959006B5CF8_6034_UN,8.77375,00000000000000000000000000000000000010000000000100000000000000000100000000010111011101011011000010101001101110010010101111100100110101110110001011011111010110101111010,RXCUZMIRAXVWKL-ZBFHGGJFSA-N
CC1=CC2=C(C=C1)C(=CN2C[C@H]3[C@@H](CCNC3)C4=CC=C(C=C4)F)C5CCNCC5,AE49A8F2678521AF_9D6874024E0A08AB_6034_UN,9.032467,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010101100110100010000001011100100110100100110001001011011010110101111010,NHMUIOPSMSXDLD-GMAHTHKFSA-N
CC1=C(C=CC(=C1F)C#N)NCC3OCC2(CCNCC2)C3,795A1877DB047B49_AE585EE9EA7DD9D6_6041_DP,8.133131,00000000000000000000000000000000000000000110000000000000010000000010000000000000001100110011000110101000110111011000001011000000110111110110001011010011110111101111110,DIADEYJCOMLZSB-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC3(C)CC4CCC3C4)F,8D1F165C28CBB6F3_1CD76703B5D9D9D9_6041_DP,7.6205435,00000000000000000000000000000000000000000010000000000000000000000010000000000000001000010011000010101100110110011001101001000000110101110110001011010011010110101111010,OFMFYXQODIWYAA-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC4CCOC(C3=CN=C[N]3C)C4)F,10847CBE58F18509_DFB0C4EF7CB10551_6041_DP,7.37722,00000000000000000000000000000000000000000010000000000000010000100100000000010101001101010011010111101100110111010000001011100100110111110110001011011011110011101111110,BSWVCMKUNDNIJX-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)F)NCCN(C)CC2COCCC2)F,EE1DB8180B2C582E_DC7AFDC362B43549_7022_UN,7.7371087,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001011011111010111101111110,WYOYTDCJRRWQEB-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)C#N)F)NC[C@H]2CNCC(O2)(C)C,AEAE9FCCF012BDA7_1726856E6738E56A_7022_DP,8.574929,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110001011000111110111101111110,JZEJLBFHMQTVGO-SNVBAGLBSA-N
N(CC1C2CCC(C1)C2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,D3F4FC7CE78465E1_E1B586F58CF6DA18_6038_UN,8.858992,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010011100011101100010100110010011001000100110000100100001011010011011110101111110,ZAQTVDXBPLULCD-UHFFFAOYSA-N
CC1=C(C=NC=C1NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,4CC063F61B99C064_7678875AFC9A73FE_6041_DP,7.6668463,00000000000000000000000000000000000000000110000000000100000000100100000000000001101000110011000000101000100110010000001011000100110101110110001011010011010110101111010,CIJUDRUKRPFMII-FUHWJXTLSA-N
CC2=CC1=C(C(=CC=C1)Cl)N2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,9E55536F09B94087_F5A607AA07A2D1BC_6034_UN,8.226614,00000000000000000000001000000000000000000000000000000000000000100100000000010101100101010000010010101101010100010000101011100100110001100110001011011110010110101111010,PCCHXLZOCZCORL-VGSWGCGISA-N
CC2=CC1=C(C(=CC=C1)F)N2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,02150A50E05CD57A_02D135B0CAC52B64_6034_UN,8.226601,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101100010100010000101011100100110001100110001011011110010110101111010,HEVMAENDGBTUFB-VGSWGCGISA-N
FC2=C1CCCC1=CC(=C2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,21ACBA161AD614BE_2857A5BE514809D7_6041_UN,8.1115465,00000000000000000000000000000000000000000010000000000000010000100000000000010000101001110001010110101100010111010001101011100100110011110110001011011011110111101111110,JLAAKIOFPDKSQO-SFTDATJTSA-N
CC1=C(C(=C(C=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)F)C#N,7A17E16A8974F014_4377397B0BDBE2DD_6041_DP,8.380981,00000000000000000000000000000000000000000110000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001111010110101111010,GHAZCDCHPGAKRK-GXTWGEPZSA-N
FC1=CC5=C(C(=C1)C=CC3=CC(=C2OCCCOC2=C3)C4=CC=N[N]4C)OCOC5,C1402CC8D1FE6D2C_0DF91E6D2C8DDF6F_7019_UN,8.689465,00000000000000000001000000001000000000000010000000001000010000100100000010010000100100110100011011110100010101000100001011111100100010100110101011111010110011111111110,DHODSCGSTAWIJK-UHFFFAOYSA-N
N1CCOC(C1)C2=CC=C(C=C2)NCC[C@@H]3CC[C@H]4C[C@@H]3C4(C)C,2CE325741873AE90_C4E766BB21673182_6041_DP,7.7824073,00000000000100000000000000000000000000000000000000000000010000100010000000100000001000100001000100101000110011011000101011000000110111010110001001010101110111101111110,WAYPVZQKJTYLOK-BWVFJHAPSA-N
FC1=C(C=CC(=C1)C2CC2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,8C5971FA1C013186_70370A5A37788FFD_6041_UN,8.739028,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,KJJHEWGRCNYKCY-VGSWGCGISA-N
C[Si](C)(C)C1=C(C=CC=N1)NC3=C2CCCCC2=NC4=C(C)C=CC=C34,D04ED8EF6DF805B0_118F731F154C39F8_6041_UN,8.498519,00000000000000000000100000000010000000000000000000000000000000000100000000100001100000100011010000100100010000011000001011000100110001010100011011011111000010101111010,QASSJBMYLQMYSF-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(C)CCCOC2)F)CC3,756F3742E7C258D0_8EFCB4D8D08C5B04_6041_UN,7.547664,00000000000000000001000000000000000000000010000000000000010000000010000000010001101001110011010001101000000111011001101011100000110011110110001011011111010111101111110,RVMKCDKNUZJZTK-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)F,3D9D2732CB6F671D_D7EBECFFC2ADE2E1_6041_UN,8.895222,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011111010110101111010,SJYHKYDDEVPVIS-VLIAUNLRSA-N
CC1=C(C=C(C(=C1)C2OCCO2)C)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,34ADBEAEA82336BE_FB131CD4C2DB1BE9_6041_UN,8.3925705,00000000000000000000000000000000000000000010000000000000010000100000000010010001100101110011010010001000100111010001101011110100000011110110011011011111010011111111110,MXGZXLBLWDKGJN-CTNGQTDRSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(CC3)CC4CC4,17F89A7E1484FA89_8B485B25E333563C_6041_UN,8.266457,00000000000000000000001000000000000000100000000000000000000000000110000000000100001000000011000000101100010010001000001001000100110001010100011011010111010110101111010,SLSOGFSPDKZRSB-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,E1B3BE69DA1FA1FD_8452A415536EA96A_6041_DP,7.666735,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101010011010011101000100111010000001011100100110111110110001011011011110111101111110,ADEGLRVRNIDXSZ-ZRHIXDKOSA-N
N5CC1=C(C=C(C=C1)NC2=CC(=C(C=C2)N3CCCCCCC3)F)C4(CC4)C5,34EA134DC49C83DD_BF94FC8666A1E660_6041_DP,8.303036,00000000000000000000001000000000000000000010000000000000000000100010000000010000001001110011000000101100010100011000001011100100110101110110001011011011010010100111010,SAQLZGRSVZGRLO-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@H]2[C@@H](OCC2)C3=CC=C(C=C3)F)Cl)C4CC4,2BDD59421D69F602_808D0F18317BEC33_7022_UN,8.600014,00000000000000000000001000000000000000000010000000000000010000100000000000000000001100010011000011001001000111000000001000000100110011110110000011010011110111101111110,XGDLLOKJLASRJF-KKSFZXQISA-N
FC2=C1CCCC1=C(C=C2)NCC3C(N(C)CC3)C4=CC=CC=C4,E5A91B18BE04EA58_881743A7BC118598_6041_UN,8.309866,00000000000000000000000000000000000000000010000000000000000000100000000000010000101101110011010010001100010110010001101001100100110001110110001011011011010110101111010,IXCIPANAJLRFLA-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1)F)N2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,2E863FAD899103BB_AB50E47B89AD4ACE_6034_UN,8.245172,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101100010100010000101011100100110001100110001011011110010110101111010,YEMUOQURZJWDDU-VGSWGCGISA-N
FC2=C1CCCC1=CC(=C2)NCC3C(N(C)CC3)C4=CC=CC=C4,EC6C430CA3951C9F_727ED2CAAF6E5B00_6041_UN,8.2485285,00000000000000000000000000000000000000000010000000000000000000100000000000010000101101110011010010001100010110010001101001100100110001110110001011011011010110101111010,GKFOBWBEEUTUHN-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@@H]3CC[C@@H](O3)C4CC4,23F6A38BFED795E8_6370EC5B772D34E9_6041_UN,8.004803,00000000000000000000001000000000000000100010000000000000010000100100000000000100001100010011000110101100010110000000001011000100110011110100001011010111110111101111110,KDOIBADHOLGFRU-WMLDXEAASA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC[C@@H]4CCCN(C)[C@H]4C5=CC=CC=C5,D91B182F9BD868F3_B4B1C50AF7C3D213_6041_UN,8.13272,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101110011010010101100010111010001101011100100110011110110001001011011010111101111110,KIKPFWQLXILOIY-RDPSFJRHSA-N
CC1=C(C=CC=C1Cl)NCC2=NC=CN2CC3CNCCC34CCN(C)CC4,41680079E75C21EA_6F10A2C5C8125A35_6034_UN,8.143576,00000000000000000000000000000000000000100000000000000000000000000110000000010101101101110011010010101001110110011001101011100100110101110110001011011111010110101111010,IROPYVZHECNITN-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)F,B77713DAF877573D_7AAC984F610C095C_7022_UN,8.817265,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011111010110101111010,QMQJSHFNVUDVHS-VLIAUNLRSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3C(C)(SCC3)C,DFBB90D29571E15B_885EC40BA45A8002_6041_UN,8.865156,00000000000000000000000000000000000010100010000000000000000000000110000000100100011100011011000010101100010110001000101011000100110001110110011011010111010110101111010,BBTPNXZOLOUXQQ-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC2C3(CCNC2)CCOC3,47DF1A85F3B85E9B_D882B5DE8694342F_6041_DP,8.302465,00000000000000000000000000000000000000000110000000000100010000000010000000000000101100110011000010101000110111011000001011000000110111110110001011010011010111101111110,QYVFRRGJRPUFTG-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)NC4CCOC(C3=CN=C[N]3C)C4,45753DDFE2DB34DD_2AAAD458579AD31D_6041_UN,7.6208,00000000000000000000000000000000000000000010000000000000010000100100000000010101000101010011010111100100110111010000001011100100110011110100001011011011110011101111110,LWDCRFHVOFFPJE-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC2=NC=CN2CC3CNCCC34CN(C)C4,027B6BDD5599E391_E866155495F1905D_6034_UN,8.311856,00000000100100000000000000000000000000100000000000000000000000000110000000010101101101110011010010101001110110011001001011100100110101110110001011011111010110101111010,KFKNOKUQARPDGE-UHFFFAOYSA-N
C1(=C2C(=NC=C1)[NH]C=C2C3CC3)NCCC4=CC=C([Si](C)(C)C)C=C4,B9CE05903F94B078_E7B8A1190176347D_6041_UN,8.066668,00000000000000000000101000000010000000100000000000000100000000100100000000100100101100100001010010101100110000011000001011000100000101010100011001011101010110101111010,ONOQEJSYDYWUMW-UHFFFAOYSA-N
CC2=C1N=CC(=CC1=CC=C2)NCC3CCN(C)C3C4=CC(=C(C=C4)Cl)F,B90706B944D70000_D2452D82FD8BAE99_7022_UN,8.707634,00000000000000000000000000000000000000000010000000000000000000100100000000010001101101110011010010101101010110010001101011100100110001110110001011011111010110101111010,NGFYZVXQYIQAPK-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC2CCCC3=C2C=N[N]3CC)C4CC4,596248CF4B69FD9A_92CCFB79ECBC13C7_6041_UN,8.458295,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010011001010001100110110010010001011101100110001110100001011011011010110101111010,FINJMBCAJXGNAE-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NC[C@H]3[C@@H](C3)C4CCOCC4)C,36D96DBAC35E5BD6_108A9ED8024CFEE3_6041_UN,8.436796,00000000000000000000001000000000000000000010000000000000010000100100000000000000101000110011000000101100010111000000001011000100110011110110001011010111010111101111110,FPIXHVPDPJCXGS-RDJZCZTQSA-N
C1(=CC2=C(N=C1)[NH]C=C2C3CCC3)NC4=CN=C([Si](C)(C)C)C=C4,4771D1D4E0A0D303_FF945D5A6CB50C90_6041_UN,8.084334,00000000000100000000100000000010000000100000000000000000000000100100000000100101000100100001010010100100010000001000001011000100000101010100011001011101000010101111010,BAIJZHGIFKJAIL-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,41575FDC991B1F02_FD31CF589425CCDA_7022_UN,8.614996,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101010011010010101101010100010000001011100100110001110110001011011011010110101111010,AWHMQWSJGNABDR-JPYJTQIMSA-N
C1(=CC=C(C=C1)C2OCCCO2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,F2F5040C6175981C_444EF2EE2204D1FB_6041_UN,7.7911496,00000000000000000000000000000000000000000010000000000000010000100000000000010001000001110100010000101000000101010001101011110100110011110110001011011011010111111111110,VJCRSBZQTNEIRP-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,30FE6E9D5C03DE49_D6F59F36907A9B45_6041_UN,8.176863,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011010010101000100111010001101011100100110011110110001001011011010011101111110,QKVUORWBPIZNMR-YADHBBJMSA-N
CC1=C(C(=CC(=C1)F)F)NCCN(C)CC2COCCC2,E60A2C6ACC5EE83F_8FF8DEB1833F6836_6041_UN,7.59958,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001011011111010111101111110,WZSNGEQMRMZXQG-UHFFFAOYSA-N
CC1=C(C=CC(=N1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,634DAB3CFF594131_229291E7B7D95C3C_6041_DP,7.5625305,00000000000000000000000000000000000000100110000000000100000000100100000000000100101000110011000000101000100100010000001011000100110101110110001011010011010110101111010,SXNAKYPNKADGJO-FUHWJXTLSA-N
CC1=CC2=C(C=C1)C(=CN2C[C@H]3[C@@H](CNC3)C4=CC(=CC=C4)F)C5=CCNCC5,32E0EF794C8F5292_A95551701A4F1C1A_6034_UN,8.826556,00000000000000000000000000000000000000000010000000100000000000100100000000011000101101110011000010111100110100010000001011100100110100100110001001011011010110101111010,YXFFZDOUCPJVBT-REWPJTCUSA-N
FC1=C(C(=CC=C1)C2CC2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,F1BFBBA035C2ECEB_20C72E365B3A8E82_6041_UN,8.614896,00000000000000000000001000000000000000000010000000000000010000100000000000010000101001110001010100101000000111010001101011100100110011110110001011011011110111101111110,SQTMKDISZUNWOU-FPOVZHCZSA-N
N(CC1C2CCC(C1)C2)C(=O)CC3=C[NH]C4=C3C=C(C=C4)F,E6BE767ED194B849_950DEDC3C5092576_6038_UN,8.457012,00000000000000000000000000000000000000000010000000000000000000000100000000000000001100010011100010001100110100110000011001000100110110100100001001010001011110100111110,RRBKLHCNBTUMGJ-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,3A2AAD49B62FCD3A_15A03E327E358130_6041_UN,8.73222,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,AHTSPPSOHDIXPM-ZHRRBRCNSA-N
N1CCCC2=C1C=C(C(=C2)NCC3(C)C4CCC(C3)O4)F,6259CC48EC8B8934_273962EB1AE344C0_6041_DP,7.937639,00000000000000000000000000000000000000000010000000000000010000000010000000000000001100010011000011101100110110011001101011000000110111110110001011010011110111101111110,MCQBAWAPVMHHLP-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3(CCCO3)C4CC4,DEECDA337554F7BD_95B1E9EE2AFEC342_6041_UN,7.9454885,00000000000000000000001000000000000000100010000000000000010000100110000000000100001100010011000110101100010111001000001011000100110011110110001011010111110111101111110,FHYLWCFSLFEKIS-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[NH]C3=C2CCCCCC3)NC4=CN=C([Si](C)(C)C)C=C4,C593D019B9D6264D_D0E5B9B1678D6DD1_6041_UN,7.5961285,00000000000000000000100000000010000000000000000000000000000000000100000000100001000100100011010010100100110000011000001011000100110101010100011011011101000010101111010,RHPCORMAGBOUPO-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)CCC2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,6AB73BE53E7E2838_2F649B9AB48BACAB_6041_UN,8.271607,00000000000000000000000000000000000000000010000000000000010000100000000000010000101001110011010110101100010111010001101011100100110011110110001011011011110111101111110,AWKCHALLOWADTO-FPOVZHCZSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3CNCCC34CN(C)C4)Cl,837DCF35C601E6BA_737C024A72B1161F_6034_UN,8.189172,00000000100100000000000000000000000010000000000100000000000000000110000000010110111101111011010010101001111110011001001111100100110101110110001011011111010110101111010,DUMMNJUAQPEMPV-UHFFFAOYSA-N
N(CC2=NC1=C(C=CC=C1F)O2)C(C3CC4CNC3C=C4)=O,F506C91A4B7FC657_E5797D4C592E3326_6038_DP,8.305774,00000000000000000000000000000000000000000010000000000100010000000100000000000001101100010010100111111100010100110000010011000100100110100110001001000001111110110111110,IQFXFNOZGSWSEI-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)C#N)NCC2CNCC(O2)(C)C)F,2AA78724576B2DDB_67312EB26BDE9686_6041_DP,8.223507,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110001011000111110111101111110,FDVQZNYLVGRABM-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CCOCC3)C4=CC(=CC=C4)F,9A0BF54B5B54440D_0AE16255F416CB57_6041_UN,7.624672,00000000000000000000001000000000000000000010000000001000010000100110000000010001101100110011011010101000000101001000001011101100110011110110001011011011010111101111110,MMIOLHCFDDYLGQ-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)F)F,063415DF4EF61A0E_BEC2DD38F288FB9A_7022_UN,8.8111315,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011111010110101111010,UDFCQSUUCTTXDP-VLIAUNLRSA-N
N1CCCC2=C1C=C(C(=C2)N[C@H]4[C@H](C3=CC=N[N]3C)OCC4)F,6DE71A0A46DE56EB_616C4E79D27CA35C_6041_DP,7.953535,00000000000000000000000000000000000000000010000000001000010000100100000000010000101100010011011111101100110101010000001011101100100111110110001011011011110011101111110,UUHDTNHKXYYDHY-CXAGYDPISA-N
CC1=C(C=C(C(=C1)C2OCCO2)C)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,DD04BA7F2139EED5_1DF4A8F18F3420A1_6041_UN,8.894703,00000000000000000000000000000000000000000010000000000000010000100000000010010001100101110011010010001000100111010001101011110100000011110110011011011111010011111111110,IEAWAHQMSSTZLW-CTNGQTDRSA-N
FC1=C(C=CC(=C1)C2OCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,D143DFCDE6737CA2_0D7AFAD1E6753D1A_6041_UN,8.452387,00000000000000000000000000000000000000000010000000000000010000100000000010010001100101110011010010001000100111010001101011110100000011110110001011011011010011111111110,CGHRCHDTUHFXSM-MOPGFXCFSA-N
N(CC1CC2CCC(C1)O2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,7D2A374F70E54CA7_E53B746BDEDEB337_6038_UN,8.568116,00000000000000000001000000000000000000000010000000000000010000000100000000000000101100010011100011101100010100110010011011000100110010100100001011010011111111111111110,VIQJNYMGRFCDAJ-UHFFFAOYSA-N
CC1=C(C=NC(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,FC9DE9F60B18E8E6_6922A47EE80D1C2F_6041_DP,7.584094,00000000000000000000000000000000000000100110000000000100000000100100000000000100101000110011000000101000100100010000001011000100110101110110001011010011010110101111010,VCXFHOZKEREGDF-FUHWJXTLSA-N
CC1=C(C=CC=C1Br)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,3B7A9547A19FBEF6_B9FFDDF024226326_7022_UN,8.260073,00000000000000000000001000000000000000000000001000001000000000100100000000010001101101010011011010101000000110010000001011101100110001110110001011011111010110101111010,YBZJOHONRJRDMS-QRWLVFNGSA-N
CC1=C(C=CC=C1Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,2E70D916C34E3DCC_65FC8FEC8D6CF714_7022_UN,8.260062,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101001000110010000001011101100110001110110001011011111010110101111010,UVGCSYJHVAJDIW-QRWLVFNGSA-N
CC1=C(C=CC=C1F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,5A3B9159ECC785A9_B45784479BB00936_6041_UN,8.260061,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000110010000001011101100110001110110001011011111010110101111010,DBAUDPMWLKELRX-QRWLVFNGSA-N
N(CCC1CC2CCC1C2)C(C3=C[N](C)C4=C3C=C(C=C4)F)=O,438FA1FC06F3790D_507B97EDF29F0710_6038_UN,8.396587,00000000000000000000000000000000000000000010000000000000000000000100000000010000101101010001110011001100110100110000011001100100110000100100001001011001011110101111110,ZXPMPTWISBOZSH-UHFFFAOYSA-N
C1(=C(C=CC(=C1)Cl)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,4B7F4CB470024F0D_20F3A32B39BCC597_7022_UN,8.617199,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,ROIVZSBNDGNYPN-HOTGVXAUSA-N
C1(=C(C=CC(=C1)F)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,3D36A97715261B7A_DCA4AAEC18FE8496_7022_UN,8.617179,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,GSTDRRKFKMWQLE-HOTGVXAUSA-N
C1(=C(C=CC(=C1)Br)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,76D6EFA9BF5FFDA5_B9701B6163E202B3_7022_UN,8.617175,00000000000000000000000000000000000000000010001000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,SNRPPJJBZVDFGI-HOTGVXAUSA-N
CC1=C(C(=CC(=C1)Br)C)NCC2=NC=C[N]2C[C@@H]3C[C@H]3C4CCNC4,FBBFF5265371D307_863337C5B6A03645_6034_DP,8.772182,00000000000000000000001000000000000000100000001000000000000000100100000000010101001101110011000010001000100110010000001011100100110101110110001010011111010110101111010,RSIFSKGPPWFRKL-YLGOGADGSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC(CC)C3CCOCC3,4A9171AAF991BF8C_A98B6896918EE87E_6041_UN,8.297186,00000000000000000000000000000000000000100010000000000000010000000100000000000100001000110011000000101100010111000010101011000100110011110110011011010111010111101111110,HSKYGGTYHBASAO-UHFFFAOYSA-N
CC2=CC1=C(C=CC(=C1)F)N2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,80329233DC0C4441_EB7FAD65A5B5294F_6034_UN,8.188188,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101100010100010000101011100100110001100110001011011110010110101111010,PYCZUBOWHDAORK-ZHRRBRCNSA-N
CC2=CC1=C(C=CC(=C1)Br)N2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,7B77EA17381D2768_20B6004F3D043B53_6034_UN,8.188189,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000101011100100110001100110001011011110010110101111010,IHDGESPVHBTWHF-ZHRRBRCNSA-N
CC2=CC1=C(C=CC(=C1)Cl)N2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,6A99F995557AE2BC_7AE2012FF3649223_6034_UN,8.188177,00000000000000000000001000000000000000000000000000000000000000100100000000010101100101010000010010101101010100010000101011100100110001100110001011011110010110101111010,BHVIYKBQNMGPBK-ZHRRBRCNSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@@H]2CCO[C@@H](C2)C3=CC=NC=C3)F)CC4,EE8961180BAF2469_3F6B94E13E64F5FB_6041_UN,8.1719675,00000000000000000001000000000000000000000010000000000000010000100100000000010001100001110010010001101000100111010001101011100100110011110110001011011011110111101111110,SYDHXUMLGCDSJQ-GGAORHGYSA-N
C1(=CC(=CC=C1)C2OCCCO2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,FECC43A03CECE03C_B065AA059D979FE6_6041_UN,7.767248,00000000000000000000000000000000000000000010000000000000010000100000000000010001000001110100010000101000000101010001101011110100110011110110001011011011010111111111110,DGZMLXHFDGEQES-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2OCC3(C2)CCOCC3)F)CC4,3D641656A3AAF338_0BE64C85F7EC9933_6041_UN,7.181327,00000000000000000001000000000000000000000010000000000000010000000010000000010001101101110011010110101000010111011001101011100000110011110110001011011011110111111111110,MTNZXJLRTSIVSW-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CC=N2)NCC3(CCOCC3)C4=CC=C(C=C4)F,DD303014C6845C80_67CD3187BC81408D_6041_UN,7.7683005,00000000000000000000000000000000000000000010000000000000010000100110000000010001101101110011010010101100010101001000001011100100110011110110001001011001010111101111110,UCQOMDYZRUDEFG-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)C2OCCO2)C)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,7158C125AA319194_81380C6E4EA62F11_6041_DP,8.664055,00000000000000000000000000000000000000000010000000000100010000100000000010000000101100110011000010101000100111010000001011010100110111110110001011010111010111111111110,ODESQLKVUXZSDW-AZUAARDMSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2C3CCOCC23)F)CC4,ED1A1D5A23834F9E_8D29055A43723E40_6041_UN,7.686533,00000000000000000001001000000000000000000010000000000000010000000000000000010001101001110001010000101000010111010001101011100000110011110110001011011011010111101111110,BTBXKTXLYFHPKU-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3OCC2(CNC2)C3)F)CC4,7C626F0CD6B83861_F1A1CAA3D7AD04B5_6041_DP,7.484995,00000000100100000001000000000000000000000010000000000000010000000010000000010001101101110011010111001000010111011001101011100000110111110110001010011011110111101111110,AUOICZJTNDQMTP-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)C#N)F)NCC3(CC2(CNC2)C3)C4=CC=CC=C4,CD49093CE3EC66CA_0B6F7CCFBB9363B8_7022_DP,8.130128,00000000100100000000000000000000000000000110000000000000000000100010000000000000001000110010000000001000010100001000000001000100100101110110001011000011010110100111010,FTGIVLVHBLGBFP-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NC[C@@H]3CCCO[C@H]3C4=CC=N[N]4C,6EDB86DA2F97EF01_9DA06DC12B405892_7022_UN,7.892956,00000000000000000000001000000000000000000010000000001000010000100100000000010000101100010011011111101000000101000000001011101100110011110110001011011011110111101111110,CYQDIYYSNAVDGJ-HNAYVOBHSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NC[C@@H]3CCCO[C@H]3C4=CC=N[N]4C,3DF9413C9A8FF94E_69609FCC6303F92D_7022_UN,7.892951,00000000000000000000001000000000000000000000000000001000010000100100000000010000101100010011011111101001000101000000001011101100110011110110001011011011110111101111110,KLIXGJFQBXNEOE-HNAYVOBHSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2CCN(C)[C@H]2C3=CN=CC=C3)Cl)C4CC4,A00E8997C7C3B809_9221F7F4F3C8A663_7022_UN,8.960902,00000000000000000000001000000000000000000000000000000000000000100100000000010000101101110011010010101001000110010001101011100100110001110110001011011111010110101111010,GVQAYPGXMNFSIC-UWJYYQICSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCCC23CCOCC3)F)CC4,81E7CABB044611C5_6430505D40F601B8_6041_UN,7.3909883,00000000000000000001000000000000000000000010000000000000010000000010000000010001101001110011010010101000010111011001101011100000110011110110001011011011010111101111110,PJMJELSHNXGBLH-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC(CC)NCC3=C(C=C(C=C3)Cl)Cl)C4CCNCC4,732FDFCC5BBE59F2_B0F3F5809AD7218F_6034_UN,8.622399,00000000000000000000000000000000000000000000000000000000000000100100000000010001001101110001000010101101110110010010101011100100110100100110001011011111010110101111010,CDAZXMRKBTWLOB-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CC3=C(CCC2)C=CC=C3,A6589FB1C2252635_056D959380869008_6041_UN,7.95957,00000000000000000001100000000010000000000000000000000000000000000100000000100001001000100011010000101100010000001000001001000100110001010100011011011111010110101111010,DTSRUCXRFRMNCY-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC2=CC=CC(=C2)CC3CCCN(C)C3)C4OCCO4,CAA2EB43864F44F2_AD16E4A822C30AB9_6041_UN,7.4857717,00000000000000000000000000000000000000000010000000000000010000100000000010010000000101110001010010101000000111010001101011110100110011110110001011011011010111111111110,BNSKLOLWFDFYJK-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2C[C@H]3[C@@H](CNC3)C4=CC=C(C=C4)Cl)C5=CCNCC5,127C0FD9CA9CB801_80F47CE5B5F7AB53_6034_UN,8.834349,00000000000000000000000000000000000000000000000000100000000000100100000000011000101101110011000010111101110100010000001011100100110100100110001001011011010110101111010,IDMSJRPIEFICQI-REWPJTCUSA-N
C1(=CC(=CC=C1)COC2CCOC2)NC3=CN=C([Si](C)(C)C)C=C3,7A51C0AC005C2C93_D082EA2644045CF5_6041_UN,8.125929,00000000000000000000100000000010000000000000000000000000010000000100000010100001000100100101010010100000000001001000001011000111110011010110011101011101110111111111110,TYZGEUGJLOHEQB-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@H]3NCC[C@@H](CC)C3)Cl,C14A3A7F6341684D_EC8548F792C4CE53_6034_UN,8.626768,00000000000000000000000000000000000010000000000100000000000000000100000000010111011101011011000010101001101110010010101111100100110101110110001011011111010110101111010,ASJRNTZWHSEGFO-ZBFHGGJFSA-N
CC1=C(C2=C(C=C1)N=CC=C2)NCC3CCN(C)C3C4=CC(=C(C=C4)Cl)F,4AB4641113C34E71_266C919A7DB897D1_7022_UN,8.712141,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101101010110010001101011100100110001110110001011011111010110101111010,UCOBFRRANZQPRC-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CCN(C)C23CCCNC3)Cl)C4CC4,6E8EBCAADD945652_FA1A06F93AD376F7_7022_DP,8.03739,00000000000000000000001000000000000000000000000000000100000000100010000000010001101101110011010010101001110110011001101011100000110101110110001011011111010010101111010,QUWAWXJGETWRDO-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC2CC3(CN2)CCOCC3,5A9614411AFE2E8F_BBB943B9E862FED0_6041_DP,7.949841,00000000000000000000000000000000000000000110000000000010010000000010000000000001001100110011000010101000110111011000001011000000110111110110001011010011010111101111110,YTTPRZBBCLEHPI-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)C#N)F)NCC2CCNC(C2)(C)C,F278E9A6657CBF4D_90A2E52608005F1D_7022_DP,8.695892,00000000000000000000000000000000000000000110000000000000000000000010000000100000001000010011000000101000100110011001101001000000110101110110001011010111010110101111010,AMOBMNKKLUCEHZ-UHFFFAOYSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C5,DBBA351D643167FE_03E590B72D020749_6041_DP,7.7281723,00000000000000000000000000000000000000000010000000000100000000100100000000010000101101110011010010101100110100010001101011100100110101110110001011011011010110101111010,XRAXRLUXGUTHKB-FXAWDEMLSA-N
N1CCCC2=C1C=C(C(=C2)NC3=CC=CC(=C3)CC4CCCN(C)C4)F,BEECB149B61441C6_F4C292B951C62D2D_6041_DP,7.2651367,00000000000000000000000000000000000000000010000000000000000000000000000000010000001001110011010000101100110110010001101011100100110101110110001011011011010110101111010,LCOWPBCBNRNIID-UHFFFAOYSA-N
C2(=C1CCOC1=CC=C2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,D0D3E8785883E680_D7162717EC30471E_7022_UN,8.684442,00000000000000000000000000000000000000000000000000000000010000100000000000010000101101110011010011101101010111010101101011100100110011110110001011011011110111101111110,VNXPCQOYHWJWKA-UHFFFAOYSA-N
CC2=C1N=CC=C(C1=C(C=C2)NCC3CCCN(C)C3C4=CC=CS4)F,8EDD89CDA177444A_FD5EF807205B8AF1_6041_UN,8.225621,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001001011111010110101111010,DEZNMNLMZHVTMW-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(C)CCOC2)F)CC3,9FE802320F14303C_AF5EF94A75D80C13_6041_UN,7.485343,00000000000000000001000000000000000000000010000000000000010000000010000000010001101101110011010011001000000111011001101011100000110011110110001010011111010111101111110,LKLVURASNNHOKR-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(C3=C[N](C)C4=C3C=C(C=C4)F)=O,2570E0A0F604CEC4_C37B1929128D3CCD_6038_UN,8.402796,00000000000000000000000000000000000000000010000000000000000000000100000000010000101101010011110011001100010100100000011001100100110000100100001001011001011110101111110,JVQWHHORUVAULB-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)C#N)NC[C@H]2CNCC(O2)(C)C)F,584E4532856A36A6_4595031A0898A1C5_6041_DP,8.397373,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110001011000111110111101111110,FDVQZNYLVGRABM-SNVBAGLBSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCCC(O2)C3CC3)F)CC4,1EF1F2279D244510_FCBDFA91D3CFCF62_6041_UN,7.7566123,00000000000000000001001000000000000000000010000000000000010000100000000000010001101001110011010100101000000110010001101011100000110011110110001011011011110111101111110,USFITFKKTWRMTC-UHFFFAOYSA-N
C2(=C1OC=CC1=CC=C2F)NC[C@@H]3CNC[C@H]3C4=CN=C[N]4C,7C4EF9E116EFBE90_48D0F93327007706_7022_DP,8.500788,00000000000000000000000000000000000000000010000000000100010000100100000000010101101101110011010110001100010110000000000011100100110101110110001010001011110110101111110,STRGVISEGRWRDJ-QWHCGFSZSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NC3CCN(C)C34CCCNC4,B7210C7B177242FC_5027294E53D7101A_6041_DP,8.851523,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001011011011010010101111010,HHEJVPQZXHJOPH-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,B4E4FC750F482B6B_BDE60F2BD41A9437_6041_UN,8.423979,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,MACGXOYYKAKCPW-ZHRRBRCNSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,F9C5FE8C0999098A_8A32807CD4EDEA73_6041_UN,7.7215114,00000000000000000000000000000000000000100010000000000000010000100100000000010100101101110011010011101000000111010001101011100100110011110110001001011011110111101111110,YNHGTUVSKQNGOX-CUWPLCDZSA-N
CC4=CC1=C(C=C(C=C1C)NC3CCN(CC2CCCO2)CC3)[NH]4,80326629288918D1_E52769BF9A6C7F7C_6041_UN,8.334867,00000000000000000000000000000000000000000000000000000100010000000100000000010000100101100010000110101100110001010000001011100100110111010110001001011101110111101111110,LZXHWQIHBOIOPD-UHFFFAOYSA-N
N1CCC4(CC1)CCC2=C(C=CC(=C2)NC3=CC(=C(N(C)C)C(=C3)F)F)O4,46516C4C3FE5157B_5D3828A217821815_6041_DP,7.7103906,00000000000000000000000000000000000000000010000000000000010000000010000000100000001001110001010001101100110100011100001011100100110111110110001011011111110011101111110,YEIRHNWSDXMZFD-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)F)C#N,74A444A2BAF69DB6_7F8F0CED1F601D39_6041_DP,8.193214,00000000000000000000000000000000000000000110000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001111010110101111010,HDLAROZDOGRJCM-SWLSCSKDSA-N
FC2=C1[NH]C=CC1=CC=C2NCC3CCCN(C)C3C4=CC=CS4,1BDC8F8763DFD8FD_6EF99EF03FA16AB1_6041_UN,8.739741,00000000000000000000000000000000000010000010000000000100000000100100000000010000111101111011010010101100010110010001101011100100110101110110001011011011010110101111010,RZXLOHKLQXEXOB-UHFFFAOYSA-N
C1(=CC2=C(N=C1)[NH]C=C2C3CC3)NC4=CN=C([Si](C)(C)C)C=C4,B3FAC39031E0D663_A787B656D9134681_6041_UN,8.172979,00000000000000000000101000000010000000100000000000000000000000100100000000100101000100100001010010100100010000001000000011000100000101010100011001011101000010101111010,DXRDKNYYOMUJGC-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@@H]2CCCO[C@H]2C3=CC=NC=C3)F)CC4,2624B7495FE0605F_4D5D09DF7C1F3834_6041_UN,8.255737,00000000000000000001000000000000000000000010000000000000010000100100000000010001100001110011010100101000100111010001101011100100110011110110001011011011110111101111110,CWWAONZVZNIVLI-PKTZIBPZSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2C(C)(COCC2)C)F)CC3,C2FBF421D4DB5752_89AC9C4C42103E22_6041_UN,7.929926,00000000000000000001000000000000000000000010000000000000010000000010000000110001101001110011010000101000000111011001101011100000110011110110011011011111010111101111110,TXOGSTDBDZCZEC-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,855E535649A1DA12_220F5B1537E001D5_6041_UN,8.537425,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,NCUABAHGLZPCFZ-ZHRRBRCNSA-N
CC1=C(C=CC=C1F)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,F2D5AC72C7EE7A76_9109CBE624B4B840_6041_DP,8.621192,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001111010110101111010,DQKQXDUJBCRSMT-QWHCGFSZSA-N
CC1=C(C=CC=C1Cl)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,0750C17A8FBF745A_7F281CD47865DC58_7022_DP,8.621188,00000000000000000000000000000000000000000000000000000100000000100100000000010101101101110011010010001001000110000000000011100100110101110110001010001111010110101111010,HCKXBYSQRBDYPZ-QWHCGFSZSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(C)CCC3(CC2)OCCO3)F)CC4,8BE40DFA0A30928C_B3230CD57B551D1E_6041_UN,7.593008,00000000000000000001000000000000000000000010000000000000010000000010000010010001101101110011010010001000010111011001101011110000110011110110001011011111110111111111110,NXASZVCURTZTCF-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC3OCC2(CNC2)C3,B2A0A42620DB6E85_DCB159BD42ABB5A5_6041_DP,7.82444,00000000100100000000000000000000000000000110000000000000010000000010000000000000001100110011000111001000010111001000000011000000110111110110001010000011110111101111110,IHSLVFCWTDIPPJ-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C([N]1CC2CNCC(C2)(C)C)C=CC(=C3)Cl)C4,3602F38AC37FAAA9_163C4F4C659C4034_6034_DP,8.1665535,00000000000000000000000000000000000000000000000000000000000000000110000000110000101101110010000010101101110110011011001011100100110101100110011011011101010110101111010,VQOSVFNTXQOOPP-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=C(C=NC(=C2)Br)F)C3,96D9C32842489B37_7738EB1591F14AE2_6035_UN,8.601036,00000000000000000000000000000000000000000010001000000000000000000100000000100000000001110000010011101000010100000101001001100011110000100100001111011110110111101111110,HUFZFIKZKSSSFD-BQVMBELUSA-N
CN(C)CC1=C(C=C(C=C1)NCC2C3(C2)CCOCC3)F,B36C26E4477AD5FB_A3AA78F544F29A4C_7022_UN,7.696618,00000000000000000000001000000000000000000010000000000000010000000010000000100000001001110011010000101000010101001001001000100000110011110110001011011111010111101111110,YKDNVAPCNCGQJP-UHFFFAOYSA-N
C1(=CC(=CC(=C1)F)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,E26CEBD75EAE0413_9F4789D78E1802E0_7022_UN,8.711634,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001001011111110111101111110,UICZWHASFYNVDB-HOTGVXAUSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3(C2CCNCC2)CCOCC3)F)CC4,EBD8A9820B26CB4D_F31CB90AE98BBE49_6041_DP,8.214373,00000000000000000001000000000000000000000010000000000000010000100010000000010001101001110011010000101000100111011001101011100000110111110110001011011011010111101111110,NIOCPWNNPORREA-UHFFFAOYSA-N
CC1=CC(=C(C=C1)Cl)NCC2=NC=CN2CC3CNCCC34CCN(C)CC4,5BD9666E2283D370_A68A2AD79E65FD88_6034_UN,8.227078,00000000000000000000000000000000000000100000000000000000000000000110000000010101101101110011010010101001110100011001101011100100110101110110001011011111010110101111010,QPHFNXRSBREUNL-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@]24C[C@H]2[C@@H]3CC[C@@H](N3)C4)F)[N]5C=CC=C5,5B326ECE56AA9DD9_7672F5627980F4E9_6041_DP,8.49237,00000000000000000001001000000000000000000010000000000100000000100110000000010000100101010011000010100100110100011000001011100100110101110100001011011011000010101111010,HNZPOVXTQZJDSR-PGSNGQOISA-N
CCN4CCC1=C(C(=CC(=C1)NC[C@H]2[C@@H](OCC2)C3=CC=C(C=C3)F)F)C4,D35A044F2B43B91A_154AC89C01671B23_6041_UN,7.7703304,00000000000000000000000000000000000000000010000000000000010000100000000000010000001101110011000011101100010111010010101011100100110011110110001011011011110111101111110,KJQPKGVQQQNDRA-JTSKRJEESA-N
CC1=C(C=C(C=C1)C2=N[NH]C=C2NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C,4A8997D766880C0E_A2BE791F6E2E4DF1_6041_DP,8.567871,00000000000000000000000000000000000000000010000000001110000000100100010000000001101100110011001010101000100100010000001011001100110101110110001011010111010110101111010,MMRRZAIAFBFBPK-PZJWPPBQSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CC2(CCNCC2)OCC3)F)CC4,1233C695F7038823_3615E9C139D8EDB0_6041_DP,7.6350555,00000000000000000001000000000000000000000010000000000000010000000010000000010001101001110011010001101000110111011001101011100000110111110110001011011011110111101111110,FYWGUHRFDSNNDM-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CC3(C2)CCOCC3)F)CC4,B564DF5AF772519F_E8FB29F5BC069083_6041_UN,7.3246765,00000000000100000001000000000000000000000010000000000000010000000010000000010001101001110010010000101000010111011001101011100000110011110110001011011011010111101111110,SGRZFZJLBAXQLE-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)F)NCCN(C)CC2COCCC2)F,47F01BAD6B1AB1D4_3496F707C0C6A5B3_7022_UN,7.759013,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001011011111010111101111110,QZJBEYXWLAZHSM-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,9192C33CEDE8D5F7_15F3E648391539DE_6041_UN,7.724531,00000000000000000000000000000000000000100010000000000000010000100100000000010100101101110011010011101000000111010001101011100100110011110110001011011011110111101111110,GZYTXEWXPMZNSV-VDGAXYAQSA-N
FC1=C2C(=CC=C1)C4=C([N]2CCC3CNC(C3)(C)C)CCNC4,7B90E33AEE783794_21498D717EAB5EA9_6034_DP,8.912364,00000000000000000000000000000000000000000010000000000000000000000110000000110000101101110011000010101100110110011001101011100100110100100110001011011101010110101111010,BGZCXPUVFFYUKP-UHFFFAOYSA-N
BrC1=C2C(=CC=C1)C4=C([N]2CCC3CNC(C3)(C)C)CCNC4,2410E8AAF47BE5EF_5550F5E13432E5AF_6034_DP,8.912359,00000000000000000000000000000000000000000000001000000000000000000110000000110000101101110011000010101100110110011001101011100100110100100110001011011101010110101111010,WZFSFZXDANFWRK-UHFFFAOYSA-N
C1(=CC=C(C=C1)C[N]2C=NC3=C2CCCC3)NC4=C[N](C[Si](C)(C)C)N=C4,4F771B25C8437BB5_9BE6DB57DA350486_6041_UN,7.9389844,00000000000000000000100000001010000000000000000000001000000000000100000000110101100101100001011010001100010000011001001011101100110001010110011011011101010110101111010,BMWHVEUZWIWJQK-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2CC3(CC2)CCOCC3)F,4D11A24E2E99E149_07CBE1B592DCE7E6_7022_UN,7.9460297,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110011010010101000110101011001001000100000110011110110001011011111010111101111110,WEDIXEOFYQCJIF-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CC3(C2)OCCO3)F)CC4,6E150060DFA07483_5F02F0E9FC78BC0C_6041_UN,7.327194,00000000000100000001000000000000000000000010000000000000010000000000000010010001101101110010010010001000010111011001101011110000110011110110001010011011110111111111110,MLRHHPLRWYOLFN-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,F510C5ECFA2071A8_CB0D73C81A56693F_7022_DP,7.8992214,00000000000000000000001000000000000000000110000000000100000000100010000000000000101000110011000000101000100100011000001001000100110101110110001011010011010110100111010,VHMRZCUKBYHNIS-QFBILLFUSA-N
CC1=C(C(=C(C=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)F)C#N,850542438E698AED_95C30A62E4C6F384_6041_DP,8.0505495,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110101111010,URYXRBLGUGJGCJ-DOTOQJQBSA-N
CC1=C(C=C(C(=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)F)F,839FE068BD3CC4FF_8E7CE5D019B8B247_7022_UN,9.08794,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011111010110101111010,RYVNDZULKZUILP-VLIAUNLRSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC[C@@]23[C@@H](CCC2)OCC3)F)CC4,FAB6F8C5CECAA2A3_D7EFDDCF6B8E5748_6041_UN,7.5152464,00000000000000000001000000000000000000000010000000000000010000000010000000010001101101110011010011001100010111011001101011100000110011110110001010011011110111101111110,KKSOURDGWMOVSS-NHCUHLMSSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCCNC2)F)CC3,058DB7975664448C_0824B26386159E36_6041_DP,8.01206,00000000000000000001000000000000000000000010000000000100000000000000000000010001101001110011010000101000100110010001101011100000110101110110001011011011010110101111010,AZKDWYHHONCRDV-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=CC(=NC(=C2)Cl)Cl)C3,9ADF0937E8AD8BA4_CAB6736A90180298_6035_UN,8.665895,00000000000000000000000000000000000000000000000000000000000000000100000000100000000001110000010011101001010100000101001001100011110000100100001101011110110111101111110,SCWHGZBHEPUGTK-NPZRNVLXSA-N
C1(=CC2=C(C=C1)CCCC2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,579BF6E258E040BF_8847A8F0CAFFD427_7022_UN,8.421505,00000000000000000000000000000000000000000000000000000000000000100000000000010000101001110011010000101101010110010001101001100100110001110110001011011011010110101111010,VTZFZFUJRNKNMY-UHFFFAOYSA-N
S(C1=CC2=C(C=C1)OCC2)C(C4=CC3=C(C=C[N]3C)[NH]4)=O,8902755D5F0623E5_0B4CDB3E4F9A8220_6038_UN,9.061539,00000000000000000000000000000000000000000000000000000000010100001100000000010001110101001000010110000100010001000100001011100100000010000100001010011001111011111111110,GRSWBSSDRDRYSM-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2=CC=CC=C2)F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,E404A55EE7605ECD_97B3A446730A4127_7022_UN,8.705576,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,YKVNHKZYVBCMEI-NLFFAJNJSA-N
N(C1C2CCC(CC1)CO2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,F82CDA277F388BBF_CC51D2EEB79B94BB_6038_UN,8.514132,00000000000000000001000000000000000000000010000000000000010000000100000000000000100000010011100101100100110101110010011011000100110011100100001011010011111111111111110,HZVKEBKORPFKDB-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCCN(C)C3C4=CC=CS4,EF0ACA24FFC91740_BFEC25B919D4DF3F_6041_UN,8.427882,00000000000000000000000000000000000010100010000000000000000000100100000000010100111101111011010010101100010110010001101011100100110001110110011011011111010110101111010,NYLYWENZCULGHC-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,96FAF0667429E12D_04CE590A3B70BCCD_6041_DP,8.208325,00000000000000000000000000000000000000100010000000000100000000100100000000000100101000110011000000101100110110010000001011000100110101110110011011010111010110101111010,WINZORRZESVPMU-PZJWPPBQSA-N
C(CCC1CCOC1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,A0CA10856BADA957_297E3334C1D3F271_7019_UN,8.281426,00000000000000000000000000000000000000000010000000000000010000000000000000000000000101110000010010010000000111010000101000100000110011110110000010011010010111101111110,DTHLDVMIMICCRV-UHFFFAOYSA-N
[NH]1C=CC2=C1C(N(C=C2)CC3(N)CCOC4=C3C=CC=C4)=O,6A566F39FA9D1E1B_B7EFE7823216AB87_6034_DP,9.086783,00000000000000000000000000000000000000000000000000000000010000000110000000010001000111000011100111101100110001111100011011100101010111000110001111011011111111110111110,YMZWCNPZNKFQRY-UHFFFAOYSA-N
N5CC1=C(C=C(C=C1)NC2=CC(=C(C=C2)N3CCCCC3)F)C4(CC4)C5,0D241B33B064F806_3D8451DCE1FF15FF_6041_DP,8.321177,00000000000000000000001000000000000000000010000000000000000000100010000000010000001001110011000000101100010100011000001011100100110101110110001011011011010010100111010,ZBRAXZQDELYNLO-UHFFFAOYSA-N
C2(=C1[NH]C3=C(C1=CC=N2)CCCC3)NC4=CN=C([Si](C)(C)C)C=C4,330EE844C28CF6CC_90C85A6F7DAE7D33_6041_UN,7.3742294,00000000000000000000100000000010000000100000000000000010000000000100000000100101000100100011010010100100110000011000001011000100110101010100011011011101000010101111010,GOHQFOGIWKVQES-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NC3=CC=CC(=C3)CC4CCCN(C)C4,D6D356ED57F7C461_5B67A9F2C9CFB7AB_6041_UN,7.516243,00000000000000000000000000000000000000000010000000000000000000000000000000010000000001110011010010101100010110010001101001100100110001110110001011011001010110101111010,SUFVJYFPPYUHSO-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NC[C@@H]2CNCC(O2)(C)C)F)C#N,615D9BB6A91B5E9E_A5BA401DAEEDCFAD_6041_DP,8.3046255,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110011011000111110111101111110,FEGLTXWCBCKLPO-NSHDSACASA-N
CC1=C(C=C(C=C1)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,8D57A4DA35210808_25F187FA78D9268D_6041_UN,8.184933,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000110010000001011101100110001110110001011011111010110101111010,YVMCCQNOOVKGPJ-QRWLVFNGSA-N
CC1=C(C=C(C=C1)Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,0EDAAFFA77DF10C4_3E79F912024E62FA_7022_UN,8.184923,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101001000110010000001011101100110001110110001011011111010110101111010,UWLARMPHJVIKNV-QRWLVFNGSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NCC2CNCC(C2)(C)C,286B3EDBA48780DB_80CAE2025218FD08_7022_DP,8.480982,00000000000000000000000000000000000000000110000000000100000000000010000000100000101000110010000000101001000110001001000001000000100101110110001011000111010110101111010,YNECYRNAOYQTFU-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CC2(CNC2)OC3)F)CC4,D41B9D1636FC5F0D_5200EC636036C144_6041_DP,7.4094906,00000000100100000001000000000000000000000010000000000000010000000010000000010001101101110011010111001000110111011001101011100000110111110110001010011011110111101111110,YSSRCIZPDAJDPN-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NC[C@@H]3CNC[C@H]3C4=CN=C[N]4C,654F35409545592D_CED2D11D4C0250E3_7022_DP,8.352496,00000000000000000000001000000000000000000010000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010011011010110101111010,KQNIGDRPOGGWDD-LSDHHAIUSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NC[C@@H]3CNC[C@H]3C4=CN=C[N]4C,4E6D33BBA26A3546_3A1223100441F15C_7022_DP,8.352481,00000000000000000000001000000000000000000000000000000100000000100100000000010101101101110011010010001001000110000000000011100100110101110110001010011011010110101111010,ZCECGQBRUUGHMR-LSDHHAIUSA-N
FC1=CC(=C(C=C1)NC[C@@H]2CCN(C)[C@H]2C3=CN=CC=C3)C4CC4,5214B1B78A36E7CE_CC8EC077D90F3B80_6041_UN,8.803556,00000000000000000000001000000000000000000010000000000000000000100100000000010000101101110011010010101000000110010001101011100100110001110110001011011011010110101111010,JCRBXSIRBSOMBY-JXFKEZNVSA-N
CCN4CCC1=C(C(=CC(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)F)C4,BCC69691108F4B3B_AAC1A034E66867E0_6041_DP,8.0638,00000000000000000000000000000000000000000010000000000100000000100000000000010000101001110011000000101100110110010010101011100100110101110110001011011011010110101111010,SEMQDZGGXZSODK-GHTZIAJQSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)N[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F)C5,7B22D4AFDEA4A1E7_1F8DD5BC44486B42_6041_UN,8.346133,00000000000000000000000000000000000000000010000000000000010000100100000000010000100101110011010111101100110101010001101011100100110111110110001011011011110011101111110,DSDSKPNALRFXAK-YADHBBJMSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC4=CC(=C(N(C)C)C(=C4)F)F,D8ECEC6A4B5FFA3B_0745FD384C085C9F_6041_DP,8.927212,00000000000000000000000000000000000000100010000000000000000000100100000000100101100101110011010010100000110100010000001011100100010101110100001011011111000010101111010,WTQLVRMLNBDBLE-USBNGQNGSA-N
FC1=C(C=C(C=C1)NCC4=CC2=C([N](C)C(=N2)C3CC3)C=C4)C5OCCO5,A7615F815F55BC96_2720B28B13633D39_6041_UN,8.257104,00000000000000000000001000000000000000100010000000000000010000100100000010010101001101010000010010001100010111000000001011110100000011110110001011011011010111111111110,FVRIYGGFLKYHQD-UHFFFAOYSA-N
FC1=C(C=CC(=C1)N2CCCC2=O)NC4=C3C5CCC(C3=CC=C4)O5,D2A60B59EF315B6B_73D15CD0B56A6B6F_6041_UN,7.753089,00000000000000000000000000000000000000000010000000000000010000100000000000010000000101010001100011001100010100110000011011100101010011110100001111011011111011110111110,RAXQQMURHLLWNW-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CCC3)C4=C(C=NC=C4)F,AA0005B6B0D86BC4_D5E42E1A7493EE95_6041_UN,8.313106,00000000000100000000001000000000000000000010000000001000000000100110000000010001101100010011011010101000000100001000001011101100110001110100001010011011010110101111010,FSHHZIYVZAAHEF-UHFFFAOYSA-N
CC1=C(C(=CC=C1)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,47B90DCB468DE539_532D862EA6CB445E_6041_UN,8.264123,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000110010000001011101100110001110110001011011111010110101111010,OWWSZUOJMLEFOD-QRWLVFNGSA-N
CC1=C(C(=CC=C1)Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,59867E17589342EC_EC234CDC6F131E8E_7022_UN,8.264117,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101001000110010000001011101100110001110110001011011111010110101111010,JXTYBTXDJSFZJS-QRWLVFNGSA-N
CCN4CCC1=C(C(=CC(=C1)NC3(CC2=CC(=C(C=C2)F)C)CC3)F)C4,26CFC64F7D0EB1B4_6410C30D195BFD03_6041_UN,8.38143,00000000000000000000001000000000000000000010000000000000000000000010000000010000000001110011000000101100110110011010101001100100110001110110001011011111010110101111010,NCWMJKLWGMJPKM-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CCNC(C)(C3)C)Cl,816685BD381B7FC8_8AF7F6762565CB4B_6034_UN,8.42546,00000000000000000000000000000000000010000000000100000000000000000110000000110110011101011011000010101001101110011001101111100100110101110110011011011111010110101111010,SWYXZCQGXNUCOW-UHFFFAOYSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)C[C@H]4N[C@H]3CCC[C@H]3C4,6E9BC0ABB6394776_5E87D6ED68114DAD_6034_UN,8.799953,00000000000000000000000000000000000010000000000100000000000000100100000000010111010101011011000010001101111100010011001111100100110001110100001010011111010110101111010,DSMFFWAKDAICIC-GVDBCLODSA-N
C2(=C1[NH]C3=C(C1=CC=N2)CCC3)NC4=CN=C([Si](C)(C)C)C=C4,D47A9B2132CBDBBA_11E3A3E84A7C31D2_6041_UN,7.5733147,00000000000000000000100000000010000000100000000000000010000000000100000000100101000100100011010010100100110000011000001011000100010101010100011011011101000010101111010,QBGQNAMPGKANDJ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CC=N2)NCC3CCCC(CC)CC3,C2BCAB0A00DE92CF_5DE4A7A1F9149209_6041_UN,8.43534,00000000000000000001000000000000000000000010000000000000000000000100000000000000101000010011000000101100010110000010101001000100110001110100001001010001010110101111010,ASTVRHFLSJLJGU-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2CCOCC2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,9CD9DE08DFFDDF4F_B0FF30B52447D514_6041_UN,7.6033735,00000000000000000000000000000000000000000010000000000000010000100000000000010001000001110000010000101000000101010001101011100100110011110110001011011011010111101111110,NRYKCXDOOAOUHO-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)COCC2)[S](C4=C3[NH]C=CC3=CC=C4)(=O)=O,029E2DFFC35C084F_2F11E5A7080865BE_6029_UN,9.051717,00000000000000000000000000000000110000000000000000010101011111001101010001000000111100101000001011101110011001001000011011001100111110001110001011111001010111110111110,ODRXNJLUPIPSEC-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC2CNC3(CO2)CCC3,4CD9CF3DC1091FBB_5B8CE873FAB19737_6041_DP,7.875876,00000000000100000000000000000000000000000110000000000100010000000010000000000000101000010011000100101000110111011000001011000000110111110110001011010011110111101111110,RIKOODJAVOWUJC-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC23CCNC2CCCC3)Cl)C4CC4,DA1DDA2B700F016F_87FBA38B4BC45DD9_7022_DP,8.043679,00000000000000000000001000000000000000000000000000000100000000100010000000000000101100010011000010001101110110011000001001000000110101110110001011010011010110101111010,JLPGXVOONNXHMZ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2C3COCC23)F)CC4,F81C2810457289AF_C378857FDE9A7944_6041_UN,7.6022844,00000000000000000001001000000000000000000010000000000000010000000000000000010001101101110001010010101000010111010001101011100000110001110110001011011011010111101111110,FUANSZBCAANZPZ-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)CCC2)NCC3C(N(C)CC3)C4=CC=CC=C4,E07A35F502057153_754DECEE4AADFE7C_6041_UN,8.478441,00000000000000000000000000000000000000000010000000000000000000100000000000010000101101110011010010001100010110010001101001100100110001110110001011011011010110101111010,GVSNNTBWTWIORI-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCCCC3COCC3,A0B1D66698860993_363B712F17F43515_6041_UN,7.901421,00000000000000000000000000000000000000100000000000000000010000000100000000000100001100100010000010101100110011010000001011000100110011010110011011010111010111101111110,RWBPVAKVEFWCAF-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,3A58994404E88EE3_06E25F8C4FFBDF69_6041_UN,8.475125,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101100010110010001101011100100110001110110001011011011010110101111010,NWJZITORXMGPLV-JXFKEZNVSA-N
N(CC1C2CCC(C1)CC2)C(C3=C[N](C)C4=C3C=C(C=C4)F)=O,20171D359529EDAC_123F14732EBBA3A7_6038_UN,8.280115,00000000000000000000000000000000000000000010000000000000000000000100000000010000101101010011110011001100010100100000011001100100110000100100001001011001011110101111110,DTCSRQLSBNNPJR-UHFFFAOYSA-N
FC1=CC=C(C=C1)C3=CC2=C(C=CC=C2)N3C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,7906300653DCE99F_FFAF61A5FF2A7C82_6034_UN,8.823834,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,MQKBTEIAWWQSBS-ZBLYBZFDSA-N
C1(=C2C(=NC=C1)[NH]C=C2C3CC3)NC4=CN=C([Si](C)(C)C)C=C4,720D3275072F6FF1_A75E1588201F3382_6041_UN,8.083996,00000000000000000000101000000010000000100000000000000100000000100100000000100101100100100001010010100100010000001000000011000100000101010100011001011101000010101111010,UFAQCEBYVVTGPA-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC[C@@H]2CCCN(C)[C@H]2C3=CC=N[N]3C)C4OCCO4,9659BB543D3B8B2E_5A30D8AE4E570D84_6041_UN,8.40125,00000000000000000000000000000000000000000010000000001000010000100100000010010001101101110011011010101000000111010001101011111100110011110110001011011111010111111111110,BVHIKWMNNNWWTQ-IFXJQAMLSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CCCC23CCOCC3)F,19AC868946F6D188_9059C03478774003_7022_UN,7.666952,00000000000000000000000000000000000000000010000000000000010000000010000000100000001001110011010010101000010101001001001000100000110011110110001011011111010111101111110,GDHJGXOEXNMYIO-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NC4CCOC(C3=CN=C[N]3C)C4,E26B1F67C775EABF_82ECE541FDB5C61A_6041_UN,7.8795433,00000000000000000000001000000000000000000010000000000000010000100100000000010101000101010011010111100000100111010000001011100100110011110100001011011011110011101111110,GYPITWVRZZPWLI-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCCC(O3)C4CC4,158F0E9ED88EC51C_36F879BF6C7B7FC8_6041_UN,8.023665,00000000000000000000001000000000000000100010000000000000010000100100000000000100001000010011000100101100010110000000001011000100110011110100001011010111110111101111110,CZFYQTWHLPMOBA-UHFFFAOYSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC3=C[N](N=C3C)C4=CC(=CC=C4)F,17E339569DD4BE08_5CCB1C52B3ED7C2D_7019_UN,8.7957115,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010000001010010000000100000000000011101100110001110100001010011010000110101111010,CMSVMJJEQXWHST-BEFAXECRSA-N
FC1=CC5=C(C(=C1)C=CC3=CC(=C2OCCCOC2=C3)C4=CC=N[N]4C)OC(OC5)C6=CSC=C6,F396A6FAD40519E5_5C27B9354C98D22B_7019_UN,9.029574,00000000000000000001000000000000000010000010000000001000010000100100000010010000100100011100011011110100010101000100001011111100000010100110101011111010110011111111110,ZBDQGBGNXLMQSR-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC4(CC3=CC=C(C=C3)F)CC4,2EFF557261FE8562_B23040925B2A7120_6041_UN,8.092143,00000000000000000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100010001110100001010011011010110101111010,FBNOJRZKSBSIDM-UHFFFAOYSA-N
COC1=CC=C(C=C1)C3=CC2=C(C=CC(=C2)Cl)N3C[C@H]5N[C@H]4CCO[C@H]4C5,FCB18C1E58B02B18_3A585E87F098EBE8_6034_UN,8.394712,00000000000000000000000000000000000000000000000000000000010000100100000000010001000101010011010111001101110101010100001011100111110010100110001111011011110111111111110,VAPHOMDKBAVNQZ-JLMWRMLUSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NCC2CCC(CN2)(C)C,5A6C7B0F60B93296_DE7AA2E98D5B0104_7022_DP,8.6461735,00000000000000000000000000000000000000000110000000000010000000000010000000100001001000010011000000101001100100011001101001000000110101110110001011010111010110101111010,RTCOTQVJKGJQIG-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC2CNCC3(O2)CCC3,0222D495C8F0DDE7_C1BA998267F25B6B_6041_DP,7.797757,00000000000100000000000000000000000000000110000000000100010000000010000000000000101000110011000100101000010110001000001011000000110111110110001011010011110111101111110,PDVSNUQWYUTLIE-UHFFFAOYSA-N
FC1=C(C=C(C=C1)CC#N)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F,0220A9B92D881852_0F13C791BD71C1C7_6041_DP,8.185399,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,FHOYDCHGFNAIIG-AUUYWEPGSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2C3(C2)CCOCC3)F)CC4,36B922DB3058B2F7_4F8D89E7E5114861_6041_UN,7.191403,00000000000000000001001000000000000000000010000000000000010000000010000000010001101001110011010000101000010111011001101011100000110011110110001011011011010111101111110,GFCWPHOEAKBDHV-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3(CC)CCNCC3)Cl,198886918E2DB28C_1130321C2601EAAF_6034_UN,8.501133,00000000000000000000000000000000000010000000000100000000000000000110000000010110011101111011000010101001101110011010101111100100110101110110001011011111010110101111010,MVSBOWLAGJAWMO-UHFFFAOYSA-N
CCC4CCC1=C(C3=C([N]1CC2(CCNCC2)C)C=CC(=C3)C)C4,A9F7792F4C3500A3_9A2C51541999FCBF_6034_DP,8.673427,00000000000000000000000000000000000000000000000000000000000000000110000000010000001101100001000010101100110010011011101011100100110000000110011011011101010110101111010,SEAKCAGHHSDPNA-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)F)NCCN(C)CC2OCCC2,176167EB70D3D8F7_5B8C9B4776A88AF7_6041_UN,7.5979033,00000000000000000000000000000000000000000010000000000000010000000000000000000001001101110001010110001000100111010001101000100000110011110110001010011111110111101111110,VNXBIKRPNXVALW-UHFFFAOYSA-N
C1(=CC2=C(N=C1)[NH]C=C2C3CC3)NCCC4=CC=C([Si](C)(C)C)C=C4,A951B8A925F98697_E76102C7F87A417E_6041_UN,7.9422874,00000000000000000000101000000010000000100000000000000000000000100100000000100101001100100001010010101100110000011000001011000100000101010100011001011101010110101111010,DDCVZKUOOIHLBM-UHFFFAOYSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC3=C[N](N=C3C)C4=C(C=CC=C4)F,E139F551B798FA1A_8E057BC26493A61E_7019_UN,8.742686,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010000001010010000000100000000000011101100110001110100001010011010000110101111010,FULZRBOOLJXFBN-WBVHZDCISA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCOCC3)CC4=CC=C(C=C4)F,C617A1443A8DEF1B_992D67621E13A1DF_6041_UN,7.7386723,00000000000000000000001000000000000000000010000000001000010000100110000000010001100100110011011011100000100101011000001011101100110011110110001011011011010111101111110,QFQNODFOAVACGN-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)NC[C@@H]2CNCC(O2)(C)C)C#N)F,4BB6434BB837D39D_90A60634BC3F8346_6041_DP,8.850615,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110001011000111110111101111110,OQYQFYYXEDZQNS-JTQLQIEISA-N
C1(=CC(=CC=C1)C2OCCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,4B2125538D481062_3088B1A36445EAFF_6041_UN,8.829026,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110111010010101000100111010001101011110100100011110110001011011011010011111111110,YCQWEAPVCSTJLR-UXHICEINSA-N
C(=CC1=CC(=CC(=C1)F)F)NCCN(C)CC2COCCC2,361DF3AEECC9269A_FA53DBFB9E8194C4_7022_UN,7.7202826,00000000000000000000000000000000000000000010010000000000010000000000000000000001001001110001010001111000100111010001101000100000110010100110001001011001010101101111110,GWEGQOKKKWJKJF-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CCCC3)C4=C(C(=CC=C4)F)F,FA4CCC04EDCF211A_C68A9834C8644AAB_6041_UN,7.9604177,00000000000000000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100110001110100001010011011010110101111010,GBDHSDGGSZZOSR-UHFFFAOYSA-N
N5CCC(CCC3=C(C1=C(SC2=C1CCN(C)C2)N=C3)C4=CC=C(C=C4)C)CC5,1CD8433B50428101_DE4DE150010769D7_2201_DP,8.263912,00000000000000000000000000000000000010000000000100000000000000100100000000010000011101101001010010101100110000010001101011100100110000000110001011011111010110101111010,QSEIKCJRGRBEDX-UHFFFAOYSA-N
O([C@@H]([C@H]1NCCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Cl)F)C#N,50266B5792809469_31A4AD0EA6AB0B0E_6035_UN,7.821514,00000000000000000000000000000000000000000110000000000000000000000000000000000000001100010011000111001001100100010100001001000111010000100100001111010011110011100111110,SRNMHBKUPZUWOK-FUHWJXTLSA-N
O([C@@H]([C@H]1NCCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Br)Br)C#N,B7CB712411E7CBE5_BC3C5420A5E2DAF2_6035_UN,7.8215094,00000000000000000000000000000000000000000100001000000000000000000000000000000000001100010011000111001000100100010100001001000111010000100100001111010011110011100111110,IKQDKJGIRWRAAI-FUHWJXTLSA-N
C[N]1C=C(C(=N1)C2CC2)NC3=C(C=C(C=C3)C4CCOCC4)F,30C5310A0DD7CB8A_62CDC975BF8705E9_6041_UN,7.9597855,00000000000000000000001000000000000000000010000000001000010000100100000000010001100100110001011010100000000101000000001011101100110011110110001011011011010011101111110,GBNXDDWFLLONNZ-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,823BBDBDC9D6D76B_41F2DC07381CE151_6041_DP,8.251186,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100110101110110001011011111010010101111010,IKOMSVVUQNOOMS-HHBDYARMSA-N
N1CCCC2=C1C=C(C(=C2)NCC3C(N(C)CC3)C4=CC=CC=C4)F,89B8A3FE361EC09E_27B278EC24181F1E_6041_DP,7.760213,00000000000000000000000000000000000000000010000000000000000000100000000000010000101101110011010010101100110110010001101011100100110101110110001011011011010110101111010,AGJKYPWFYOECLG-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CCCO2)C3CC3)F)CC4,B29508ADF94F653F_5FF46AC0954A73E8_6041_UN,7.7251644,00000000000000000001001000000000000000000010000000000000010000100010000000010001101101110011010110001000000111011001101011100000110011110110001010011011110111101111110,BXZHPXSDKMXDAC-UHFFFAOYSA-N
C(CC1CCCOC1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,E775E53867FD26F0_88CDBCAB9278DB2D_7019_UN,8.134459,00000000000000000000000000000000000000000010000000000000010000000000000000000000000001110000010010110000000111010000101000100000110011110110000011011010010111101111110,LTYJHUCXBUZRJX-UHFFFAOYSA-N
C(C12CCC(CC1)C2)=CC3=C[N](C)N=C3C4=CC(=CC=C4)F,C1E542534B9F0DB2_E037A05489043610_7019_UN,7.967107,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001011011010000010101111010,DDZNSWSLKJQEKA-UHFFFAOYSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(=O)C=CC4=CC(=CN=C4)F,39447CB3E5A309B6_5535056EE1D6CC57_6038_UN,8.354125,00000000000000000000000000000000000000000010000000000000010000000100000000000000000100010001100011110100010100100000011011000100000011110100001011010001101011110111110,MDGUAWLBJNJVLX-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)N[C@@H]3CNC[C@H]3C4=CC=CC=C4,D03E5D85AB65AA75_809EA6DF3D29A909_7022_DP,7.8746967,00000000000000000000001000000000000000000110000000000110000000100010000000000001101100110011000010001000100100011000000001000100010101110110001011010011010010100111010,CFGMZWVSRKZPRF-QFBILLFUSA-N
C1(=CC(=CC=C1)CC2CCC2)NC3=C[N](C[Si](C)(C)C)N=C3,956E49B1D0FFF730_BDAB009006960FCC_6041_UN,7.898485,00000000000100000000100000001010000000000000000000001000000000000100000000110001100100100001011010001000000000011001001011101100110001010100011000011101010110101111010,SDPODMXGXBNIKB-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCNC23CC3)F)CC4,FC984E87F77CC100_451A32B2E4F05DF1_6041_DP,7.6846747,00000000000000000001001000000000000000000010000000000100000000000010000000010001101101110011010010001000110110011001101011100000110101110110001010011011010110101111010,FWYLLUAYODSQMN-UHFFFAOYSA-N
C1CC(CNC1)C2=CN(C=N2)CC(CC)NCC3=C(C=C(C=C3)Cl)Cl,967EEA85148F908E_88211BF9E86359B1_6034_UN,8.563307,00000000000000000000000000000000000000000000000000000000000000100100000000010101101101110011000010101001100110010010101011100100110100100110001011011011010110101111010,HOFXXGFZMYWFJI-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=C2C3CC3)CC4(CC)CNC4,A2B5900EF0DA1C00_5FB141579841CBDE_6034_UN,8.9533205,00000000100100000000001000000000000000000000001000000000000000100110000000010000101101110010000010001100010100001010100011100100100000100110001000011001010110101111010,PDDDHXISVKUWPN-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCCCC3(C2)OCCO3)F)CC4,1A6AE94D4818D71C_1D6C78704A7886BF_6041_UN,7.2177916,00000000000000000001000000000000000000000010000000000000010000000000000010010001101101110011010010001000010111011001101011110000110011110110001010011011110111111111110,VTEXEHHRLFAYOB-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)F)CC#N)N[C@@H]2[C@@H](C(C)C)NCC2,401E05FD4F52FBE9_66F66CFF63D5EA9E_6041_DP,8.240023,00000000000000000000000000000000000000000110000000000110000000000000000000100001101100010011000010001000100110010000001001000000000101110100001010010111010110101111010,VKCQABUHUZLTPZ-UONOGXRCSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC34OC(C)(C)C(C3)C4,E2CCBD76B4E0396E_08CBD85ADECFD8B8_6041_UN,7.411668,00000000000100000000000000000000000000100000000000000000010000000110000000100100001100000010000110101100010010001000100011000100100011010100011011000111110111101111110,YLWVHTULACRVIK-UHFFFAOYSA-N
N1CCC4(CC1)CCC2=C(C=CC(=C2)NC3=C[N](C[Si](C)(C)C)N=C3)O4,A65D3C4FFCD8DA22_3A64732F6351DE38_6041_DP,6.871272,00000000000000000000100000001010000000000000000000001000010000000110000000110001101100100001011011101100110000011101001011101100110111010110011011011101110111101111110,PCKASLHVOUNTBL-UHFFFAOYSA-N
C(C12CCC(CC1)C2)=CC3=C[N](C)N=C3C4=C(C=C(C=C4)F)F,16D08236022554E0_0CAA870E5B750385_7019_UN,8.462528,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001011011010000010101111010,NILTZULUQYLERW-UHFFFAOYSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC4CCN(C)C45CCCNC5,B2EA7DB46C0569A7_B75EF30579335032_6041_DP,7.5860353,00000000000000000000000000000000000000100010000000000100010000100110000000010101101101110011010010101100110111011001101011100100110111110110001001011001010011101111110,QDYVEDFYSIWSON-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)C=C,42FB0C942C36414E_A79A4F0552B73293_6041_UN,9.093116,00000000000000000000000000000000001000000010000000001000010000100100000000010000101101110001011110111000000111010001101011101100110011110110001011011111110111101111110,OLNZWSYXMZQKCF-ROUUACIJSA-N
N(CCC1CC2CCC1O2)C(C(C)(C)C3=C(N=CC=C3)F)=O,10CDB55E94675790_EA97C1DE230DF135_6038_UN,8.616645,00000000000000000000000000000000000000000010000000000000010000000110000000100000001100010001100010101000110110111000011011000000110010100100001011010111111111111111110,BPDMILRELGDNEY-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2C(=CC=C(C2=NC=C3)F)F)C4,DA85604C0214006F_4E2952E66D8336E7_6035_UN,8.2261715,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010011101100010100000101001001100111110000100100001101011110110111101111110,GZTRJCFCJQDFJW-XUOCYBMCSA-N
FC1=C(C(=CC=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)C5CC5,795654FB97319974_7AA14CC1A624CE4C_6041_UN,8.576565,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,PAHAIESIKLIWCI-ZHRRBRCNSA-N
CC1=C(C=CC(=C1F)C#N)NCC3OCC2(CCNC2)C3,6C06C8DD70E57D63_83B6BA099A60ED23_6041_DP,8.118587,00000000000000000000000000000000000000000110000000000000010000000010000000000000001100110011000111001000110111011000001011000000110111110110001010010011110111101111110,PDTUTMLIWIRDRW-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2OCCN(C)[C@H]2C3=CC=CC=C3)Cl)C4CC4,64CA0F209EA21AA5_F1AEB2B2A0BA25B2_7022_UN,8.348348,00000000000000000000001000000000000000000000000000000000010000100000000000010000101001110001010100101001000111010001101011100100110011110110001011011111110111101111110,XJTHNMKXGCLCFG-VXKWHMMOSA-N
FC1=C(C=CC(=C1)C2CC2)NC4CCOC(C3=CN=C[N]3C)C4,4E92062705735547_E77BD129B4F8C8D7_6041_UN,7.8499765,00000000000000000000001000000000000000000010000000000000010000100100000000010101000101010010010111100000100111010000001011100100110011110100001011011011110011101111110,NIRWCLGGHVZNFJ-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C2CC2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,D33724ABACCCB022_9FDBE69D8A59D4B3_6041_UN,8.726376,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,ZIKGRBZUUPPVBZ-ZHRRBRCNSA-N
C(C12CCC(CC1)CC2)=CC3=C[N](C)N=C3C4=CC(=CC=C4)F,893A3D564E999752_CDC7A6B00994F6BF_7019_UN,8.090802,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001011011010000010101111010,OHQNVCOURJTUOL-UHFFFAOYSA-N
N(CC1C2CCC(C1)CC2)C(=O)CC3=C[NH]C4=C3C=C(C=C4)F,5787694DBE225BC6_4449E099F93FBA1C_6038_UN,8.09642,00000000000000000000000000000000000000000010000000000000000000000100000000000000001100010011100010001100110100110000011001000100110110100100001001010001011110100111110,WUFCDAMZMRRQSB-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NC3=CC=CC(=C3)CC4CCCN(C)C4,36A485F9E2FF5260_EC3487EB97713C5C_6041_UN,7.5417004,00000000000000000000000000000000000000000010000000000000000000000000000000010000000001110011010010101100010110010001101001100100110001110110001011011001010110101111010,QNBARTMSRVUXDB-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NCC23CC(C)(CO2)CCC3,CB76CB499911773E_5CA60CD5ABB7D345_7022_UN,7.3343787,00000000000000000001000000000000000000000010010000000000010000000010000000000000001100010011000110011000010111001001101000000000110010100110000001010001110101101111110,UCBKBDREHUWVTL-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2C3(CCNC2)CCOCC3)F)CC4,9D56F0C52F14EBB9_5636760243A76568_6041_DP,7.3865814,00000000000000000001000000000000000000000010000000000100010000000010000000010001101001110011010000101000110111011001101011100000110111110110001011011011010111101111110,AQDWGSLYPCFWAV-UHFFFAOYSA-N
C2(=C1OCCCC1=CC=C2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,9905E6EE7C6C6AED_A3F83B24E0938CCF_7022_UN,8.539853,00000000000000000000000000000000000000000000000000000000010000100000000000010000101001110011010100101101010111010101101011100100110011110110001011011011110111101111110,SYAISZUHWNBMJD-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2=C(C=CC=C2)F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,8963E47DE777D50D_F7481BC1C428AA01_7022_UN,8.638425,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,IQFPUPHNTAUGJT-CLOONOSVSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3OC(CC3)C4CC4,F2AD7CAF2A6807B7_C3A055A16611635B_6041_UN,8.031996,00000000000000000000001000000000000000100000000000000000010000100100000000000100001100000011000110101100010010000000001011000100110011010100011011010111110111101111110,HPWAZCNBGSWLIU-UHFFFAOYSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC6=CC4=C([N](C)C(=N4)C5CC5)C=C6,3F122931DA1B2F37_E459E92489B14BF2_6041_UN,8.231397,00000000000000000000001000000000000000100010000000000000010000100100000000010101100101110000010010100100010111000000001011100100110011110110001011011011010011101111110,ZDJWZXQRXKCBNG-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(C)COC2)F)CC3,6F22F6995BE9AE7D_6629655155B027CA_6041_UN,7.825238,00000000100100000001000000000000000000000010000000000000010000000010000000010001101001110010010001001000000111011001101011100000110001110110001010011111010111101111110,VEHUUGANZSQFHX-UHFFFAOYSA-N
C2(=C1[NH]C3=C(C1=CC=N2)CCC3)NCCC4=CC=C([Si](C)(C)C)C=C4,EAFF193E07B4DBBE_510517796B15362D_6041_UN,7.557706,00000000000000000000100000000010000000100000000000000010000000000100000000100101001100100011010010101100110000011000001011000100010101010100011011011101010110101111010,VZOYJJZTDWIXQR-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CCCC(CC)C2)Cl)C3CC3,4CFB5FA592FB07FE_0EE0318F40BB6535_7022_UN,8.004827,00000000000000000000001000000000000000000000000000000000000000100000000000000000000000010011000000000001100110010010101000000000110001110000000011010111000110101111010,AAIODCSDNXQUEM-UHFFFAOYSA-N
CC1=C(N=C(C=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,B3EF53C346864F80_8B43832BD4F9682B_6041_DP,7.551166,00000000000000000000000000000000000000100110000000000100000000100100000000000101101000110011000000101000100100010000001011000100110101110110001011010011010110101111010,UAYDCOPXNCFWCC-DOTOQJQBSA-N
N1CC2CCCC1C2C=CC3=C[N](C)N=C3C4=CC(=CC=C4)F,0071004F344733CB_D2E46A13D13CD964_7019_DP,8.007935,00000000000000000001000000000000000000000010000000001000000000100100000000010000101100010011011010011000110100010000001011101100110000100100001011011011010010101111010,HREGTIHHUXJJMH-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)N[C@@H]2C4=C(OC3(C2)CCCC3)C=CC(=C4)F,DE3D2AB89D06739F_558A417F0CFBEF61_6041_UN,7.89457,00000000000000000000100000000010000000000010000000000000010000000110000000100001000000110001010011100100110100011100001011000100110011110100011011011111100011101111110,JYGLTBJRCLUWAM-SFHVURJKSA-N
C1(=CC2=C(C=C1)C3CCC2O3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,AC1C75494AE2D41E_323927BEC9FA5BAE_6041_UN,8.088287,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011010010001100110110010001101011100100000011110100001011011011110011101111110,QOABSJPZPDBPKE-UEKLYDJUSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CCCC3)C4=CC=C(C=C4)F,C40B483A41CED54E_4E6A4C568826FA42_6041_UN,7.6694527,00000000000000000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100110001110100001010011011010110101111010,UTHKSVVEWKVMKD-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2C3(CCNC2)CCOCC3)F)CC4,571BB31577D9EB22_16EDD5B967CC476D_6041_DP,7.2774386,00000000000000000001000000000000000000000010000000000010010000000010000000010001101001110011010000101000110111011001101011100000110111110110001011011011010111101111110,OLTSIQCXALRYPL-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2OCCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,6044CC59346770C3_C4A3E948DBD6A4E2_6041_UN,8.799574,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110111010010101000100111010001101011110100100011110110001011011011010011111111110,QBUQEDJAXZJDJP-UXHICEINSA-N
CC1=C(C=C(C(=C1)NCC#CC2CCCCO2)Cl)C3CC3,CF068BCB0BF1D3F7_964AC4787E20419D_7022_UN,8.343962,00000000000000000100001000000000000000000000000000000000010000100000000000000000001000010000000000101001000111000000001000000000110011110110000011010011110111101111110,UPWSXONJSLEHHC-UHFFFAOYSA-N
N1CCC2=C1N=C(C=C2)NC4C3=CC=CC(=C3OCC4)CC,65DB26F0EEB5FACB_B754D5B82C162308_6041_DP,8.372895,00000000000000000000000000000000000000100000000000000100010000000100000000000100101100000011000011101100110001010110001011000100100111010110001011010001110111101111110,FCGHORPOAFILCX-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2C[C@H]3[C@@H](CNC3)C4CCOCC4,E5F838D735425175_78A817193D75B51F_6034_UN,8.9166,00000000000000000000000000000000000000000000001000000000010000100100000000010000101101110011000010101100010101000000101011100100110010100110001011011111010111101111110,HSAAYJWKOLNLBW-LPHOPBHVSA-N
CC1=C(C(=CC(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C)C#N,E462D0EF6FDA6E1E_E52E03BF80126B3C_6041_DP,7.8295875,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010111010110101111010,LKOQQZQBGXVMKD-FXAWDEMLSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CCCC3=C2N=CC=C3,2C10B57A15CBA787_B3BD4143923EF514_6041_UN,8.0527725,00000000000000000000100000000010000000000000000000000000000000000100000000100001101000100011010000101100010000001000001011000100110001010100011011011111010110101111010,AVHXRGWKEBWZIT-UHFFFAOYSA-N
N1CCC4(CC1)CCC2=C(C=CC(=C2)NC3=C(C=CC(=C3)CN(C)C)C)O4,C0746E377D39AD95_E830B5D5529CCCDB_6041_DP,7.008754,00000000000000000000000000000000000000000000000000000000010000000010000000100000001001100001010001101100110000011101001011100100110111010110011011011111110111101111110,OHFADEWFTDFXRW-UHFFFAOYSA-N
N1CC2CCCC1C2C=CC3=C[N](C)N=C3C4=CC=C(C=C4)F,178D4981AA49D111_6CF138C6127E294D_7019_DP,8.065041,00000000000000000001000000000000000000000010000000001000000000100100000000010000101100010011011010011000110100010000001011101100110000100100001011011011010010101111010,PUHHZDINAFOATG-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Br)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,9328B336EB59CC12_9A7EE249367B2849_7022_UN,8.38021,00000000000000000000001000000000000000000000001000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,NZIRGWANMYTGMI-JPYJTQIMSA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,B2D3DE46F4178EFD_CA9EAA7FDDF04C3F_7022_UN,8.380203,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101101010100010000001011101100110001110110001011011011010110101111010,GZNLKRSTLICFCV-JPYJTQIMSA-N
CC1=C(C=C(N=C1)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,7E85F2FEE67D6BE5_A6C0EA956717BE7D_6041_UN,8.221785,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000110010000001011100100110001110110001011011111010110101111010,XOSLJJILPFCUSP-KUHUBIRLSA-N
NCCCC(OC1=C2C(=CC=C1)CNCC2)C3=CC=C(C=C3)F,53B8F787071D58CC_0A1C94027623CF4A_6035_UN,8.454097,00000000000000000000000000000000000000000010000000000000000000000000000000000000001010110011000000101100110100010100001001000111110110100110001111010001110101100111110,UNUWKYYHPAZFJF-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,55EB8F8FD2D8B302_30122B13DD95A00D_6041_UN,8.684097,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011010010101000100111010001101011100100110011110110001011011011010011101111110,NICIQWLZJACSSV-YADHBBJMSA-N
CN4CCN(CC1=C(C=CC=C1)N[C@H]2[C@@H](OCC2)C3=CC(=CN=C3)Br)CC4,79815C1C7A27EA76_0E04F95E3FD550E7_7022_UN,7.97019,00000000000000000000000000000000000000000000001000000000010000100100000000010001100101110011010111101000100101010001101011100100110011110110001011011011110111101111110,YXKKPRQSDBBMFH-RTWAWAEBSA-N
C[Si](C)(C)C1=C(C=CC=C1)NC3=CC2=C(CCCNC2)C=C3,45464B314FAE6824_C555D9585B133D14_6041_DP,7.909392,00000000000000000001100000000010000000000000000000000000000000000000000000100000001000100011010000001100110000011000001001000100110101010110011011011111010010101111010,PCXCNDDWYBZNNK-UHFFFAOYSA-N
FC2=C1C=CC=CC1=CC(=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,512F160F13A77767_9777788C74B14806_6041_UN,8.630936,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,PHCIMCFDSXPKQD-HXOBKFHXSA-N
N(CC1C2CCC(C1)CC2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,CBA8DD0DECD46661_30F18BAFB0C04572_6038_UN,8.39819,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010011100001101100010100110010011001000100110000100100001011010011011110101111110,ZSISGAFGZZIKQC-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NC(C2CNC2)C3=CC=C(C=C3)F,0D837B84B2BB7E62_B05FC140C036C875_6041_DP,7.569834,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110010000000001000000100000000000001000100000101110110001011000011010010101111010,WBKTYJBOKAYESF-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CC=N2)NCC3C(CC)CCCC3,9654B7237157BF05_E113B42604625212_6041_UN,8.3929825,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010011000000101100010110000010101001000100110001110100001001010011010110101111010,KJGIJMHBMYTYFW-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2N(C)CC3(CC2)CCC3,F4108C7DEAD5CCBE_932817ED5D1EC39F_6041_UN,7.919696,00000000000100000000100000000010000000000000000000000000000000000110000000110001001001100011010000101000010010011001101011100000110001010110011011011111010110101111010,GWROGNAXTGMBIO-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)N[C@H]4[C@H](C3=CC=N[N]3C)OCC4,A7E3F8EFFCD8DA77_3C306FD753786017_6041_UN,8.911508,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011011111000000100101010000001011101100000011110100001010011011110011101111110,YQGUYTAZIKBHIG-RHSMWYFYSA-N
N1CCC5(CC1)CCC2=C(C=CC(=C2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F)O5,506F14936F866CAB_29FDDA45ADDBCB71_6041_DP,7.465463,00000000000000000000000000000000000000000010000000000000010000000010000000010001001001110001010001101100110100011101101011100100110111110110001011011011110111101111110,NTWUXTCEUZCFTB-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2C=CC(=C(C2=NC=C3)F)F)C4,F14C86841B3C568D_C82321A5E307531E_6035_UN,8.550178,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010011101100010100000101001001100111110000100100001111011110110111101111110,MGJXMGVFLOUNFT-GWSNDMCOSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2C=CC(=C(C2=NC=C3)F)Cl)C4,9C59F33F7B085487_D23852F4A4D8C236_6035_UN,8.550173,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010011101101010100000101001001100111110000100100001111011110110111101111110,CSUMMTSGNIKDEC-GWSNDMCOSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3C5=C(C4CCC3C4)C=CC=C5,7C544FDFA4FE9E4F_74A73A9DEC58C285_6041_UN,8.585522,00000000000000000001000000000000000000000010000000001000000000000100000000010000100100010011011010000100010100000000001011101100010001110100001011011001000010101111010,DVMVGWCDYDKTDM-UHFFFAOYSA-N
FC1=CC2=C(C=C1)[NH]C=C2NC3CCN(C)C34CCCNC4,87C2ED145D5D0258_02C48E6B66AA53F0_6041_DP,8.644687,00000000000000000000000000000000000000000010000000000110000000000110000000010001101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,QDTGNHIRSHPLSD-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC4=CC2=C([N](C)C(=N2)C3CC3)C=C4)C5OCCO5,D74362F56FCADB9A_7CFCD7E3C3D022D8_6041_UN,8.318484,00000000000000000000001000000000000000100010000000000000010000100100000010010101100101010000010010000100010111000000001011110100000011110110001011011011010011111111110,XAMGDTICVFQPQS-UHFFFAOYSA-N
C1(=C(C=CC(=C1)Br)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,C272B59E5189E336_840F245A6120CB2C_7022_UN,8.592447,00000000000000000000001000000000000000000010001000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,SAXOEVCHTBNOFG-YJYMSZOUSA-N
C1(=C(C=CC(=C1)Cl)Cl)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,D10F2E435C276964_FE6755DD4582F98A_7022_UN,8.592427,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,AZQNNXVESVJKKY-YJYMSZOUSA-N
C1(=C(C=CC(=C1)Cl)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,667A6B790A2405C1_1D8C9C103B7E0C08_7022_UN,8.592433,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,ICFSHQTUWIYAFK-YJYMSZOUSA-N
N(CC1C2CC(C1)C3CC23)C(C5=C(CC)N=C4C=C(C=CC4=C5)F)=O,FDB70D8E136FF281_C8E8DF0B3EF890FE_6038_UN,8.995827,00000000000000000001001000000000000000000010000000000000000000000100000000000000101000010011100011101100010100110010010001000100110000100100001011000011011110101111110,FNWZKKRQKIZMSP-UHFFFAOYSA-N
C(CC1CCOC1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,473F575DBD799F81_07099E83934DA56F_7019_UN,8.208134,00000000000000000000000000000000000000000010000000000000010000000000000000000000000101110000010010010000000111010000101000100000110011110110000010011010010111101111110,WXXUWMXHRHMBDS-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,66A7F0EA5AD72C45_AB84798256E2D970_6041_DP,8.092607,00000000000000000000000000000000000000100010000000001100000000100100000000010101101100110011011010101000100110010000001011101100110101110110001011011111010110101111010,RAKDOAMXPDQVIY-AZUAARDMSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC34COC(C)(C3)CCC4,C11C909977883955_3F3DDBEF1C9046EC_7022_UN,8.063443,00000000000000000001000000000000000000000010000000001000010000000110000000010000101100010011001011001000010111011001101011101100110011110110001011011011110111101111110,ZJVKTDGWOLKLIN-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)C=C,77031997218F03C0_D3E3D6B67D2B9EFC_6041_UN,9.097912,00000000000000000000000000000000001000000010000000001000010000100100000000010000101101110001011110111000000111010001101011101100110011110110001011011111110111101111110,GTVHIBJQFKZJQI-ROUUACIJSA-N
CC1=C(C=CC(=C1)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,4AE7F2C00B9BBF50_AAABB36532A7F6B7_6041_UN,8.328644,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000110010000001011100100110001110110001011011111010110101111010,DIYBZRPRYHCAJU-QRWLVFNGSA-N
C1(=C[N](N=C1)C2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,EBB429632CE8BCB0_54697BC2EBC68478_6041_UN,7.9071193,00000000000000000000000000000000000000000010000000001000010000100100000000010001100101110011011011101000100111010001101011101100110011110110001001011011010011101111110,DQVCVVQLZDNJNJ-MOPGFXCFSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC3=C2CCCCC2=CC=N3,ABBE1696C20A8DA8_237FB5E5FB3819A9_6041_UN,7.9365234,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100001010000101100010000011000001011000100110001010100011011011111010110101111010,OTPHRIQKWYEXGE-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCCC2CCC=CC2)Cl)C3CC3,8CE862646B701C0D_24ABA028B076D81A_7022_UN,8.205026,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010001000000011001100110010000001000000000110001110000000011010011010110101111010,KYZOBRJBZWTZGS-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(=O)CC3=C[NH]C4=C3C=C(C=C4)F,69A13AFC15A96E99_61BC8A1123947756_6038_UN,8.185921,00000000000000000000000000000000000000000010000000000000010000000100000000000000001100010011100010001100110100110000011011000100110110100100001001010001111111110111110,MAIWWDUQSNTJMJ-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2(CCOCC2)CC3=CC=C(C=C3)F)C4CCCC4,3560D50F99B34460_3593C9D056EE85BA_6041_UN,8.314969,00000000000000000000000000000000000000100010000000001000010000100110000000010101100100110010011011100000100101011000001011101100110011110110001011011011010111101111110,YAZLHRAGEQDMKI-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2C3(COCC2)CCCC3)F)CC4,22A6E3333481E349_160BE351A1BB5DDA_6041_UN,7.1504636,00000000000000000001000000000000000000000010000000000000010000000010000000010001101001110011010010101000010111011001101011100000110011110110001011011011010111101111110,KYFCZRBUFSQQAQ-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)F)NC(COC)C2CCCOC2,35C5727F90C68758_5130B32A76ED3A2A_6041_UN,7.779624,00000000000000000000000000000000000000000010000000000000010000000000000000000000000000110011010101100000100101010001001000000010110011110110000011010111010111111111110,ISMBCMGCUVFLDQ-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)COCC2)[S](C4=C3[NH]C=CC3=C(C)C=C4)(=O)=O,0E7FC420DDBEC297_CF1B4899F4346077_6029_UN,9.104574,00000000000000000000000000000000110000000000000000010101011111001101010001000000110100101001001011100110011001001000011011001100111111011110001011111001010011111111110,BWENGWGMVPUOGD-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC3NC2COCC2C3)Cl)C4CC4,E19712B62736FB49_5194241CCD492CB5_7022_DP,8.220479,00000000000000000000001000000000000000000000000000000010010000100000000000000001001100110011000111001101110111010000000011000000110101110110001010010011010111101111110,CGUXNDSOJFVYKO-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(CCCO3)C4CC4,96FC3D28066D9D46_2FC2EF5B7617211E_6041_UN,7.4964685,00000000000000000000001000000000000000100000000000000000010000100110000000000100001100000011000110101100010011001000001011000100110011010110011011010111110111101111110,ALJZPPRHSMOIMY-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)Cl)C4CC4,286B67B4E2EA311C_F9B69D8D8777E39F_7022_UN,8.626061,00000000000000000000001000000000000000000000000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110011011011111110111101111110,PSLMCWKYAOFULD-PMACEKPBSA-N
N2C5COC1=C(C(=C(C=C1F)F)C24CCN(CC3=CC=CC=C3)C4=O)C5,CD8ADEBA0B9EE3BF_DD4442A355DBC926_2238_UN,8.046727,00000000000000000000000000000000000000000010000000000000010000000010000000010001100101110011100110101100110101111100011011100101110000100110001111011011111111110111110,NAOOYWVJTGCTJY-UHFFFAOYSA-N
N3C1CC2=C(OC1)C=C(C=C2C35CCN(CC4=CC=CC=C4)C5=O)F,8BC35773F26A14C5_C0C647C1BF3C74D6_2238_UN,8.084987,00000000000000000000000000000000000000000010000000000000010000000010000000010001100101110011100110101100110101111100011011100101110000100110001111011011111111110111110,XZYSCAUBCVGAGG-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NC[C@@H]3CNCC(O3)(C)C,F242F88B7F79F706_2B5E38ED34496028_7022_DP,8.270942,00000000000000000000000000000000000000000010000000001100010000000110000000110000101100110010001110101000000110011001000011101100100111110110001011001111110111101111110,OBETYAXJUJFZLP-HNNXBMFYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CC3(NC2)CCOCC3)F)CC4,CF66748245762A5D_0C9BDEE0C6F9CA7C_6041_DP,7.3962555,00000000000000000001000000000000000000000010000000000110010000000010000000010001101101110011010011101000110111011001101011100000110111110110001011011011010111101111110,IGJNHSRIBAHLLW-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)F)NCC23COC(C)(C2)CCC3)F,4B329029BD2C36A9_4D95FEF0F24D39BB_7022_UN,8.373739,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100010011000011001000010111001001101000000000110011110110000011010111110111101111110,DPZYDYNOWKSSQD-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)C=CC3=C2CCCCC2=N[N]3C)OC(OC4)C5=CSC=C5,9E665306533BCB70_31AD69BAA6DDC76E_7019_UN,8.31918,00000000000000000000000000000000000010000010000000001000010000100100000000010000100100011100011010110100010111010100001011111100110000100100001011011010110011111111110,FWXZEQRHNONXMD-UHFFFAOYSA-N
N1CCC(CC1)C2=NC=C(S2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,B52DAA8105525BE1_891F8527DB509BDC_6041_DP,8.872157,00000000000000000000000000000000000010000010000100000000000000100100000000010001111101111011010010101000100110010001101011100100110101110110001011011011010010101111010,IKURWIKMGQZYAX-AEFFLSMTSA-N
CN(C)CC1=C(C=CC(=C1)NC2CCCC23CCOCC3)F,11748D70AD7FCF2F_74092CE307ECB351_7022_UN,7.7808986,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110011010010101000110101011001001000100000110011110110001011011111010111101111110,BPKYRFAAISNATN-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NCC2=CC=CC3=C2CCCN3,6388F15EAD715F99_878996E2F18BD761_6041_DP,8.30802,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100011010000101100110000011000001011000100110101010110011011011101010110101111010,AGBXAHKFYZWGPW-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@H]2[C@@]3(CCC2)OCCC3)F)CC4,B949CF7A3B5FE3A9_1099FFC29CE9F200_6041_UN,7.1451597,00000000000000000001000000000000000000000010000000000000010000000010000000010001100101110011010110001000110111011001101011100000110011110110001010011011110111101111110,RGSQXSFCFDFEMP-RTWAWAEBSA-N
C1(=CC2=C(C=C1)CCC2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,37C8D511751770E4_41C1359DD53B80E9_7022_UN,8.460597,00000000000000000000000000000000000000000000000000000000000000100000000000010000101001110011010010101101010110010001101001100100110001110110001011011011010110101111010,DYSKAYKSVQSVAO-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2CCC3(CC2)CCOCC3)F,8469531A83F59B54_35EFEBBC14458ED1_7022_UN,7.9915524,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110010010000101000110101011001001000100000110011110110001011011111010111101111110,LEWKSLQSDZKDKT-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)C[C@H]3NC[C@H](C)CC3)Cl,6B2554F280B2D86F_2C9FE8017CE150A1_6034_UN,8.195127,00000000000000000000000000000000000010000000000100000000000000000100000000010111011101011011000010101001101110010001101111100100110101110110001011011111010110101111010,AXRUQMGUUMHOML-DOMZBBRYSA-N
C1(=CC2=C(C=C1)[NH]C3=C2CCCC3)NC4=C[N](C[Si](C)(C)C)N=C4,3545ED9C5EFE81E5_B0061B4DCDE2CBE6_6041_UN,7.8209558,00000000000000000000100000001010000000000000000000001000000000000100000000110001100100100011011010001100110000011001001011101100110101010100011011011101010110101111010,SALZIZVUHPARMA-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NCC2C(N(C)CC2)C3=CC=CC=C3)C4CC4,1B6A23EA0C72479C_15EF2BB17D0D9329_6041_UN,8.435076,00000000000000000000001000000000000000000010000000000000000000100000000000010000101101110011010010001000000110010001101001100100110001110110001011011011010110101111010,OQJCAWKARRSFAB-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CNCCC34CN(C)C4)Cl,4E99CA7041E73170_965DA3E4E01E84B4_6034_UN,8.008426,00000000100100000000000000000000000010000000000100000000000000000110000000010110111101111011010010101001111110011001001111100100110101110110001011011111010110101111010,OTIZIBQCFKOCCQ-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C(F)F)Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,E785F29AB6B2D069_27F3C4A6F6321785_7022_UN,8.677057,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,MYGVZZAQDZGMFG-HOTGVXAUSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CCCCC3)C4=CC=C(C=C4)F,7299EC6D01058CBD_7F2A0979072CA984_6041_UN,7.5917063,00000000000000000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100110001110100001011011011010110101111010,SSCBSUMNGIMUPO-UHFFFAOYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC4=C(N(C)C)C=CC(=C4)F,9BF2B568DDFC3272_9A56A7FB003C2FF4_6041_DP,8.515629,00000000000000000000000000000000000000100010000000000000000000100100000000100101100101110011010010100000110100010000001011100100010101110100001011011111000010101111010,UYTVNNSBKPHJSP-PPHDSNJXSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=C[NH]C4=C3C=C(C=C4)F,7610163349A7C7CF_6BA2876340DB4BF8_6038_UN,8.034975,00000000000000000000000000000000000000000010000000000000000000000100000000000000001100010011100010011100110100110000011001000100110110100100001001010001011110100111110,KGUSFRPMJHTMQT-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC5=CC3=C([N](C)C(=N3)C4CC4)C=C5,905F2DCFE8E1B840_E14A9103762DF425_6041_UN,8.326693,00000000000000000000001000000000000000100010000000000000010000100100000010010101100101010000010010000100010111000000001011110100000011110110001011011011010011111111110,SWGQDGJHNIVBKG-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCC3(CC2)COC3)F)CC4,AACD78B410F050EC_0E217A3205E9589F_6041_UN,7.4078007,00000000100100000001000000000000000000000010000000000000010000000010000000010001101001110011010000001000010111011001101011100000110001110110001011011011010111101111110,TVNAEAWGAOPOKP-UHFFFAOYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC4=CC(=C(N(C)C)C=C4)F,07D074227CF89A8D_F5D7D3723768D99E_6041_DP,8.523048,00000000000000000000000000000000000000100010000000000000000000100100000000100101100101110011010010100000110100010000001011100100010101110100001011011111000010101111010,LKNIUZIGQHVEJR-JKDFXYPNSA-N
C[Si](C)(C)C1=C(C=CC=C1)NC3=C2CCCCC2=CN=C3,D548E0AA1655D07F_F2DD3B6DF3EE4C01_6041_UN,8.016334,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100011010000100100010000001000001001000100110001010100011011011111000010101111010,BWVWSWPAUFABKU-UHFFFAOYSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NCCCC3=NC2=C(CCCN2)C=C3,597FCFC46E9E2B39_95634206D0A0474E_6041_DP,7.73915,00000000000000000000100000000010000000100000000000000000000000000100000000100100001000100011010000101100110000011001001011000100100101010110011011011111010110101111010,GRPGZVZOVJGVKI-UHFFFAOYSA-N
O([C@H]1C[C@H](NCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Cl)F)C#N,4B449D1DD3F55740_C561CD883689AF40_6035_UN,7.874715,00000000000000000000000000000000000000000110000000000000000000100000000000000000001000010001000001101001100100010100001001000111110010100100001111010011110011100111110,CWOWZPICFKRGCN-WBVHZDCISA-N
O([C@H]1C[C@H](NCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Br)Br)C#N,1FAD457AE359706A_48F934A635C07EBC_6035_UN,7.874705,00000000000000000000000000000000000000000100001000000000000000100000000000000000001000010001000001101000100100010100001001000111110010100100001111010011110011100111110,QRQLMMHTHBJVTK-WBVHZDCISA-N
C[N]1C=C(C=N1)NC2=C(C=C(C=C2)C35CC4CC(CC(C3)C4)C5)Cl,C96DADEBAD5C07F4_3BDD6FE3785206C8_7022_UN,8.573219,00000000000000000000000000000000000000000000000000001000000000100110000000010001100100010000011010000101010100001000000011101100100001110100001011001011000010101111010,AUTKQRPIOJBACE-UHFFFAOYSA-N
C1(=CC(=C(C(=C1)F)F)F)NCC(OC)C2CCCOC2,F048BC9EA0248440_37EE3E454EBB2F41_7022_UN,8.283556,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110101010100101000000111000000101000000010110011110110000011010011110111111111110,QNIQFBBPCCTYRS-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,D6C765FCECA2032F_220EC50B9D925547_7022_UN,8.108674,00000000000000000000001000000000000000000000000000000000010000100000000000010000101001110001010100101001000111010001101011100100110011110110001011011011110111101111110,KDBGBBHPNLKDOA-SFTDATJTSA-N
C1(=C(C=C(C=C1)C2CC2)F)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,45D6D5250BCC2116_D6CE3706D5D1F4F8_7022_UN,8.1086645,00000000000000000000001000000000000000000010000000000000010000100000000000010000101001110001010100101000000111010001101011100100110011110110001011011011110111101111110,XQZSMOOWKOMXTI-SFTDATJTSA-N
N(C1C2CCC(CC1)CO2)C(=O)CC3=C[NH]C4=C3C=C(C=C4)F,25D2218A9BB98125_B8E9B9D8FE646BD5_6038_UN,8.054546,00000000000000000001000000000000000000000010000000000000010000000100000000000000000100010011100110100100110101110000011011000100110111100100001001010001111111110111110,IHKNAKZGYBPQSO-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,1A0928CE94A6F62C_7FC3AEADA3943F8D_6041_UN,8.269404,00000000000000000000000000000000000000000010000000001000010000100100000000010000101100010011011011001100010101000000001011101100110011110110001001011011110111101111110,LXAFOODNVFKGLD-DJJJIMSYSA-N
CCNC4CCC1=C(C3=C([N]1CC2CCC(CN2)(C)C)C=CC(=C3)Cl)C4,FA73E3009AB6F456_114E56EC27DE090F_6034_DP,8.155347,00000000000000000000000000000000000000000000000000000000000000000110000000110001001101010011000010101101110110011011101011100100110101100110011011011101010110101111010,PAQWPAOXIQSTNR-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)C3=NC2=C(C=CC=C2)N3C[C@H]4[C@@H](CNC4)C5CCOCC5,346F6631BD39FECD_83CF7E650F5779ED_6034_UN,8.501279,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101110011000010101100010101000000001011100100110010100110001011011011010111101111110,UVVFFCNUMOYEGX-RXVVDRJESA-N
FC1=C(C=C(C=C1)NCC3=CC=C(CN2CCCN(C)CC2)C=C3)C4OCCO4,3ADDBEE766E5F507_817D95F693CC1DF3_6041_UN,7.8094044,00000000000000000001000000000000000000000010000000000000010000100000000010010001101101110000010010001000000111010001101011110100110011110110001011011011010111111111110,DZMMTFJGHRUGCT-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(C)C(OCC2)C3CC3)F)CC4,D5D487837FBD1437_65A49D839E527D7D_6041_UN,7.9484453,00000000000000000001001000000000000000000010000000000000010000100010000000010001101101110011010011001000000111011001101011100000110011110110001010011111110111101111110,RRBAITHOWGKKCC-UHFFFAOYSA-N
N3CC4(C=CC1=C[N](C)N=C1C2=CC=C(C=C2)F)CC3C4,971EB5338750FC58_33E08D8D4CA709EE_7019_DP,7.564353,00000000000100000000000000000000000000000010000000001000000000100110000000010000101100010011011010011000110100011000000011101100110000100100001010001011010010101111010,MMCUTRJPFDCODH-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NC3CN(C)C4(C3)CCOCC4,BBC7C47A3BD0764E_1058AC4D997B703A_6041_UN,8.379686,00000000000000000000000000000000000000000010000000000000010000000110000000010001100101110001010011101100110111011001101011100100110011110110001011011011010011101111110,SCYQRMBASGHUQY-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCC23CNC3)F)CC4,39362075C9C6D696_D04B517CA7463F8D_6041_DP,7.662324,00000000100100000001000000000000000000000010000000000100000000000010000000010001101001110011010000001000110110011001101011100000110101110110001010011011010110101111010,POGFVAKTUQUHMM-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CCC3(CC2)COC3)F,4F05D06AECF80EBB_E2068B20A40A8AB2_7022_UN,7.765012,00000000100100000000000000000000000000000010000000000000010000000010000000100000001001110011010000001000010101001001001000100000110001110110001011011111010111101111110,PVHWUZCTMGOLBL-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)C=CC3=C2CCCC2=N[N]3C)OC(OC4)C5=CSC=C5,19CF9D1ECE40213A_F3713D5841EA2827_7019_UN,8.400685,00000000000000000000000000000000000010000010000000001000010000100100000000010000100100011100011010110100010111010100001011111100010000100100001011011010110011111111110,UTYZDQYUEISMEC-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3C(CCN3)C4CC4,27DE19F3B4E1E780_752190BA201DB436_6041_DP,8.332774,00000000000000000000001000000000000000100000000000000010000000100100000000000101001100000011000010101100110010010000001011000100110101010110011011010111010110101111010,ZUQINTLBKIOYBF-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(C)CCOCC2)F)CC3,A35DFCE96DAD521A_2D5FEABAA8BC7243_6041_UN,7.505334,00000000000000000001000000000000000000000010000000000000010000000010000000010001101001110011010000101000000111011001101011100000110011110110001011011111010111101111110,IUZWIWRGCAKPKU-UHFFFAOYSA-N
C1(=C(C=CC=C1Cl)Cl)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,AF970FEB1C7B6ADA_5EA45C314694DFD7_7022_UN,8.662427,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,BCGVDKLGWKPXKE-YJYMSZOUSA-N
C1(=C(C=CC=C1F)Br)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,8E7D2D958B9EF90C_7DF79A411F81D0A9_7022_UN,8.662423,00000000000000000000001000000000000000000010001000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,NFNCSLVZCWBKGZ-YJYMSZOUSA-N
C1(=C(C=CC=C1F)Cl)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,2FA534D83323EC04_EC8025F26DBE984A_7022_UN,8.662386,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,QEZWYIPHVORXKJ-YJYMSZOUSA-N
C1(=CC=C(C=C1)[Si]23OCCN(CCO2)CCO3)NCC(OC)C4CCCOC4,E25D74CA2C8B5DE9_D9BDFD8A37E5126E_6041_UN,7.2027144,00000000000000000000100000000000000000000000000010000000010000100000000000000000001001100101010100101110011011011000101011101010111011010110101001111001110111111111110,FAVQEEVIMOKGJX-UHFFFAOYSA-N
CC1=C(N=C(N1CC2(CC)COC(CI)C2)C3CCCN3)C4=CC=CC=C4,120717882DB4ED90_C8143863ADC905A3_6034_UN,8.552624,00000000000000000000000000010000000000100000000000000000010000100110000000010101001101000011000011001000100001011010101011100100110010100110001010011111110111101111110,RISRSCZECHHBQV-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=C1)NC3=CC2=C(CCNC2)N=C3,3A5EFBEC30F0F500_1DFF60337873885F_6041_DP,7.6821117,00000000000000000000100000000010000000000000000000000000000000000100000000100001101000100001010000101100110000011000001011000100110101010110011011011111010010101111010,KNFRWANARUWHRO-UHFFFAOYSA-N
FC1=CC(=C(C(=C1)F)NC[C@@H]2CNCC(O2)(C)C)C#N,1EA933CA5D886042_EF17D664EB3DB547_6041_DP,8.542374,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110001011000111110111101111110,RVFPQICBNCMMBA-NSHDSACASA-N
CC1=CC(=C(C=C1)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,5785BE67134D1ADA_78B3C5E21C6F7E45_7022_UN,8.538658,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011111010110101111010,XSBYMAGUKSPPIC-QRWLVFNGSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,E3DAF75610190356_066768A8DE28148C_6041_UN,7.6759033,00000000000000000000000000000000000000100010000000001000010000100100000000010101101101010011011011001000000111000000001011101100110011110110001011011111110111101111110,KAIVEZKPLRRVKC-PXNSSMCTSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2=C(C=C(C=C2)C3CCOCC3)F)F)CC4,FB8BBF5597686ECA_ECDF8EDC075B3BDC_6041_UN,7.898324,00000000000000000001000000000000000000000010000000000000010000100000000000010001100001110000010000101000000111010001101011100100110011110110001011011011010111101111110,RRVBXWMGUUZCMH-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC3=CC=C(CN2CCN(C)CC2)C=C3)C4OCCO4,FDEF91E9C87078E9_47648A8F89EBB53E_6041_UN,7.734175,00000000000000000000000000000000000000000010000000000000010000100000000010010001000101110000010010101000000101010001101011110100110011110110001011011011010111111111110,KERNLEXIWMZSPZ-UHFFFAOYSA-N
C1(=CC(=CC(=C1)F)COC2CCCCC2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,CCC636DB18C4F74A_6881942D77968AB0_7022_UN,8.565493,00000000000000000000000000000000000000000010000000000000010000100000000000010000101001110001010100101000000111010001101011100111110011110110001101011011110111111111110,CGOPVOUNUIVLKU-DQEYMECFSA-N
FC1=C(C2=C(C=C1)CCC2)NC4CCOC(C3=CN=C[N]3C)C4,9A813C41C124CAEA_8D4F50ED1204E433_6041_UN,7.5654573,00000000000000000000000000000000000000000010000000000000010000100100000000010101000101010011010111100100110111010000001011100100110011110100001011011011110011101111110,QEHJCQRLQMHOMT-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,60EC594A6395B2D1_ED6DC5D4DECD7B55_6041_DP,7.750901,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110101111010,MYODXQNEEWVFGR-MAUKXSAKSA-N
C1(=CC2=C(C=C1)CCCC2)NC3=C[N](C[Si](C)(C)C)N=C3,D137637EBCDF3DDE_37D905F0F5AB3C85_7022_UN,7.7816286,00000000000000000000100000001010000000000000000000001000000000000100000000110001100100100001011010001100010000011001001011101100110001010100011011011101010110101111010,GFFNURTXFAAQQM-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC34CC(C)(CC3)CO4,67DD5406D5BE2C02_FC207B9823B09A71_6041_UN,8.205329,00000000000000000000000000000000000000100010000000001000010000100110000000010101101100010011011110101000010111001001101011101100110011110110001011011111110111101111110,MWZHDHZNFZDUNA-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3=C4C(=CC(=C3)F)COCO4,0907589936AE2990_20894AA8CDF622FA_6041_UN,8.048471,00000000000000000000001000001000000000000010000000001000010000100100000000010001101100110101011011101100010101000100000011111100100001110110001011011011110111111111110,BLEWWBITFIHJDM-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC3=CC2=C(CCCNC2)C=C3,C4799BD8746804AC_B0AAD0A465371A7F_6041_DP,7.888956,00000000000000000001100000000010000000000000000000000000000000000000000000100000001000100011010000001100110000011000001001000100110101010110011011011101010010101111010,ZFVWZKLXNXEMBT-UHFFFAOYSA-N
N(C1C4C2CC5C3CC(C1C23)C45)C(C7=C(C6=CC=CC(=C6[NH]7)CC)F)=O,BF613BF374C8F41F_0B2B3A1075B23E86_6038_UN,8.73663,00000000000000000001000000000000000000000010000000000010000000000100000000000001000100010011100110000100010100100010010001000100110101100100001011000011001110101111110,IBSPMLIICHASEV-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NCC3CCN(C(CC)C)C3,41230290628AEC5B_51C2E2AD3D724E79_6041_UN,8.021034,00000000000000000000000000000000000000000010000000000000000000000000000000010000101101110011000010001100010110010011101001100000110001110110001010011101010110101111010,INXZSGXJABEFDA-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CCC3)C4=C(C=NC=C4)F,8401BBCE3A02005B_1AB75DF62780A82B_6041_UN,8.240259,00000000000100000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,JNHXOOIQBVSWJV-SFHVURJKSA-N
C2(=C1C=CC=CC1=CC=C2Cl)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,42950A96DB901514_B3115C23BC4DC9DD_7022_UN,8.545754,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101010011010010101101010100010000001011100100110001110110001011011011010110101111010,NGTLGZCZZHXHDC-HXOBKFHXSA-N
CC1=C(C2=C([NH]1)C=CC=C2NC[C@@H]3CC[C@@H](O3)C4CC4)C,20CBB76D24EEE59F_841438B8F8B1CA75_6041_UN,8.076507,00000000000000000000001000000000000000000000000000000100010000100100000000000000101100000011000110001100010000000000001011000100110111010100001010010111110111101111110,SZJPAFZSKDSXRT-WMLDXEAASA-N
CC1=CC(=C(C(=C1)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)F,86FE7B3C1591EA80_4D03FD6828D989B9_7022_UN,8.411632,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011111010110101111010,BOOKDGXAQJPWDT-VLIAUNLRSA-N
CN(C)CC1=C(C=CC(=C1)NCC2C3(C2)CCOCC3)F,834E1C6049B17993_BBE4198EDD9009DA_7022_UN,7.3628855,00000000000000000000001000000000000000000010000000000000010000000010000000100000001001110011010000101000010101001001001000100000110011110110001011011111010111101111110,SCELHQHEXOAELJ-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC(=C2)NCC3CCCN(C)C3C4=CC=CS4,F030AC33EFB6520B_E6B71304DF0EE7D3_6041_UN,8.663409,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110101110110001001011011010110101111010,NSMHRXSTAWVWEV-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CC3(OCC2)CCOCC3)F)CC4,3FAC5C5EDA8F9E01_F7F5B40DC735B72A_6041_UN,7.1572084,00000000000000000001000000000000000000000010000000000000010000000010000000010001101001110111010000101000010111011001101011100000110011110110001011011011110111111111110,CNZJFSGPSWHQEB-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCCC3SCCC3,8E59E058C2AAC49D_478A03B229E350D9_6041_UN,7.7980905,00000000000000000000000000000000000010100010000000000000000000000100000000000100011100011001000010101100110110010000001011000100110001110110001011010111010110101111010,BDWCQEQUIPOHKI-UHFFFAOYSA-N
NCCCC(OC1=CC2=C(C=C1)NCCCC2)C3=CC=C(C=C3)F,E0BF6F938F283572_DEA09C998E3AF1AB_6035_UN,8.298664,00000000000000000001000000000000000000000010000000000000000000000000000000000000001010010011000000001100110100010100001001000111110110110110001111010001110111100111110,NNCXJBNENWKABY-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(COC3)CC4=C(C=C(C=C4)F)F,12D65123EA401FB5_81D005EFB2D8FAD2_6041_UN,8.32935,00000000100100000000001000000000000000000010000000001000010000100110000000010001100100110001011110000000100101011000000011101100100001110110001010011011010111101111110,HHTVWBBGGAGELN-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC2=CC=CC(=C2)CN3CCN(C)CC3)C4OCCO4,1A34A5E6BA57D708_AD572C55C9803FE8_6041_UN,7.6658306,00000000000000000000000000000000000000000010000000000000010000100000000010010001000101110001010010101000000101010001101011110100110011110110001011011011010111111111110,UQHOPGWNMCFHDP-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,EA716E3A651AC0B8_8C9E2F6D39C9B312_6041_UN,8.36882,00000000000000000000001000000000000000000010000000000000010000100100000010010101101101010011010010101000000101010000001011110100110011110110001011011011010111111111110,CTVZYMWBUMPSLG-IERDGZPVSA-N
N(CC1CC2CCC(C1)O2)C(=O)CC3=C[NH]C4=C3C=CC(=C4)F,5A449D962DF05221_8F60E36487E44F11_6038_UN,7.9773445,00000000000000000001000000000000000000000010000000000000010000000100000000000000001100010011100010101100110100110000011011000100110110100100001001010001111111110111110,QPIXBQQTLCPBSY-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC[CH]3C[C]2(C[C](C)(C2)C)C3)F)CC4,39CA5F33EE661825_AEEA8DCE736BCEC7_6041_UN,8.067509,00000000000100000001000000000000000000000010000000000000000000000010000000110001101001110010010000001000010110011001101011100000110001110110011010011111010110101111010,GRBXIKZDYPARAN-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC3(CC2CO2)CCOCC3)C=CC(=C4)Cl)C5,7263971705C4D89A_3CFB182D661EE5C0_6034_UN,7.6582675,00000000000000001000001000000000000000000000000000000000010000000110000000010000100101110000010010101101010101011001101011100100110010100110001011011000110111111111110,MNRRFTLMCMQUFW-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2CN[C@@H]3CCCC[C@H]23)Cl)C4CC4,72F90B9C9C211FE9_296193EF80580D41_7022_DP,8.406488,00000000000000000000001000000000000000000000000000000100000000100000000000000000101100010011000010001101110110010000001001000000110101110110001011010011010110101111010,NFVCZMGMLFFUET-HDMKZQKVSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CC3(C2)CCOC3)F)CC4,8CAE5BBEEA52A984_4B5D2EA33A68D93E_6041_UN,7.2039127,00000000000100000001000000000000000000000010000000000000010000000010000000010001101101110010010010001000010111011001101011100000110011110110001010011011010111101111110,MUMRNXRYIQDCIH-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3=C(C=CC(=C3)C4OCCO4)F,004B3B717F38332A_CFCDBDBC1277B651_6041_UN,7.4220276,00000000000000000000001000000000000000000010000000001000010000100100000010010001101100010001011010001000000101000000001011111100000011110110001010011011010111111111110,DDNBDHSMTJQZGX-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC3=C2CCCCC2=CN=C3,D80B7F75CF8C21EA_D5E0502ABB8802F9_7022_UN,7.9654813,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100011010000100100010000001000001001000100110001010100011011011101000010101111010,WRVZSTJKJOPBMZ-UHFFFAOYSA-N
C2(=C1[NH]C3=C(C1=CC=N2)CCCC3)NCC4=CC=C([Si](C)(C)C)C=C4,633C0CDC357B211D_C34142162C998C4C_6041_UN,7.4322124,00000000000000000000100000000010000000100000000000000010000000000100000000100101001100100011010010101100110000011000001011000100110101010100011011011101010110101111010,HGWHZZHTWMZZSP-UHFFFAOYSA-N
CC2=C(C=C1N=C(C(=CC1=C2)C)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C,D6581F95A019FCA1_49AA4535A44ACFDD_6041_DP,8.623867,00000000000000000000000000000000000000100010000000000100000000100100000000000100101000110011000000101100110110010000001011000100110101110110011011010111010110101111010,WPVKLVRGTBWQFC-RBBKRZOGSA-N
C[N]1N=CC(=C1F)NC2=CC=C(C=C2)C35CC4CC(CC(C3)C4)C5,7CAA9034613DC91C_8B76C9B1C16BF595_6041_UN,8.584611,00000000000000000000000000000000000000000010000000001000000000100110000000010001100100010000011010000100010100001000000011101100100001110100001011001011000010101111010,WTXLMGUJHJEASU-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@H]3CCS[C@H](C)C3,9F8706FDCDB8DD4A_43981B8FEAE1D400_6041_UN,8.233742,00000000000000000000000000000000000010100010000000000000000000000100000000000100011000011011000000101100010110000001101011000100110001110110011011010111010110101111010,YLQPJXTYTAJCOP-KGLIPLIRSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)C[C@H]4N[C@H]3CCCC[C@H]3C4,1D0A67434C8EB7F5_64274649E1ECA237_6034_UN,8.755423,00000000000000000000000000000000000010000000000100000000000000100100000000010111010101011011000010001101111100010011001111100100110001110100001011011111010110101111010,AEKUPJIYUKYPNU-RNHXBHQPSA-N
CC1=C(C=C(C(=C1)N[C@H]2[C@@]3(C2)C4=C(CCC3)C=CC=C4)Cl)C5CC5,F6B264157D2FD6FE_D58E4503118FC898_7022_UN,8.189261,00000000000000000000001000000000000000000000000000000000000000100010000000000000000000010011000000000101110110011000001000000100110001110000000011010011000010101111010,UDOIMMWNHVQKFK-YADHBBJMSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC[C@@H]3CCO[C@H]3C4=CC=CC=C4,3E09A30C67BA4A98_55979E6612A8F6C5_6041_UN,8.648155,00000000000000000000000000000000000000000010000000001000010000100100000000010000101100010011011011001100010101000000001011101100110011110110001001011011110111101111110,HJGXURFIWOFYFW-LIRRHRJNSA-N
FC1=C(C(=CC=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)C5CC5,FE735CAAFDFACCD0_4D0E29E6EFF14EA9_6041_UN,8.356774,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,RNCFIXSYBYSLFV-ZHRRBRCNSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NCC3CCCN(C)C3C4=CC=CS4,73B3F0477270A129_7E1E6BED3D706EBC_6041_UN,8.657765,00000000000000000000000000000000000010100011000000000000000000100100000000010100111101111011010010101100010110010001101011100100110101110110001001011011010110101111010,MWNJLPCSTIBMBW-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCCOC3C4=CC=CC=C4,BCFE2E240263931C_BA38C2AF279E23CE_6041_UN,8.130936,00000000000000000000000000000000000000000010000000001000010000100100000000010000101100010011011011101100010101000000001011101100110011110110001001011011110111101111110,YTXUEPAMEVLFOT-UHFFFAOYSA-N
CSCC2(C=CCCCC1CCNCC1)CCOCC2,CEF06550EAFC1FFB_9F471833532F5CBC_7019_DP,8.672372,00000000000000000000000000000000000000000000000000000000010000000010000000000000001000101001010000111000100011011001001011000000110010000110000001010001010101101101110,RUSHNOWRJSQHJM-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CC=N2)NCC3(CCOCC3)C4=CC(=CC=C4)F,22F843F64D2A2556_90594EFED9A28FB3_6041_UN,7.633682,00000000000000000000000000000000000000000010000000000000010000100110000000010001101101110011010010101100010101001000001011100100110011110110001001011001010111101111110,OSZDYAWWOMKPPM-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@H]3NC[C@H](C)CC3)Cl,FF6E237A6584878F_C9BE49AFEE4EC20A_6034_UN,8.072025,00000000000000000000000000000000000010000000000100000000000000000100000000010111011101011011000010101001101100010001101111100100110101110110001011011111010110101111010,UOFCKLIRUOUMNY-DOMZBBRYSA-N
N(C1C2CCC(CC1)O2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,FAACD46424C6C003_9874769A6918A7BB_6038_UN,8.432669,00000000000000000001000000000000000000000010000000000000010000000100000000000000100100010011100111100100110100110010011011000100110011100100001011010011101111111111110,IDICRIBOHCOZCL-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CCNCC3)C4=C(C=NC=C4)F,23BEA03AACB30BEB_9B4248A046A724C3_6041_DP,8.505635,00000000000000000000001000000000000000000010000000001000000000100110000000010001101100110011011010101000100100011000001011101100110101110110001011011011010110101111010,GZURPIMTPBFLNW-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC3=C2CCCC2=CC=C3,45285134F5044BB3_B17EEF7A116951AF_6041_UN,7.977865,00000000000000000000100000000010000000000000000000000000000000000100000000100001001000100001010010101100010000001000001001000100110001010100011011011111010110101111010,VVDDSHDGEQNFOS-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC3=CC2=C(CCNC2)N=C3,57F18DB23CBDC8E8_680069CF4657AF34_6041_DP,7.6024647,00000000000000000000100000000010000000000000000000000000000000000100000000100001101000100001010000101100110000011000001011000100110101010110011011011101010010101111010,FOQMVQRAQXCYOC-UHFFFAOYSA-N
BrC1=CC2=C(N=C1)N(C=C2CC3=CC=CC=C3)CC4CNCCC45CCN(C)CC5,FADE4BEB3853C52B_EAA29BB114EB9CD1_6034_UN,7.865555,00000000000000000000000000000000000000100000001000000000000000000110000000010100101101110011010010101100110100011001101011100100110000100110001001011001010110101111010,DYBDTVSHUDFIDJ-UHFFFAOYSA-N
N1CC(C1)(C#N)C2=NC=C(C=C2)N[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,B9BE004FCB071225_A65D446685D0782F_6041_DP,7.7376432,00000000100100000000001000000000000000000110000000000000000000100110000000000001101000110010000000101000100100011000000011000100000101110110001011000011010010100111010,AQLCCZVRGUCFCA-IUODEOHRSA-N
FC1=C(C(=C(C=C1)F)CC#N)N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,BFB1BAB4153CDDA6_6BAC5BBF4A57013F_6041_DP,8.022559,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,DXAMSBNULXIEDP-RDTXWAMCSA-N
N(C1C2CCC(CC1)O2)C(=O)CC3=C[NH]C4=C3C=C(C=C4)F,8D587C5B3AD418ED_ECCC1DAC20E758D5_6038_UN,8.020875,00000000000000000001000000000000000000000010000000000000010000000100000000000000000100010011100110100100110100110000011011000100110111100100001001010001101111110111110,DECCNWXLGNIYQD-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC(CC)C2CCOCC2)F)CC3,2C1F02AE0E131FEE_63CEEBB82E3A58D4_6041_UN,7.8954406,00000000000000000001000000000000000000000010000000000000010000000000000000010001101001110011010000101000000111010011101011100000110011110110001011011111010111101111110,OHTWCNYUWKKWHL-UHFFFAOYSA-N
CC1(C)CCCCC1C=CC2=C(F)C=CC3=C2C=C[NH]3,5160A2D532209257_4C3EE18509C84D19_7019_UN,8.83293,00000000000000000000000000000000000000000010000000000000000000000110000000100000000100010000000010010100010110001001101001000100110000100100000011010111000010001111010,IZOTWWLFAXDKAS-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3OCC2(CCNCC2)C3)F)CC4,03889660480EE087_8348CDF77F7B68C6_6041_DP,7.546019,00000000000000000001000000000000000000000010000000000000010000000010000000010001101101110011010110101000110111011001101011100000110111110110001011011011110111101111110,WILCOPIJUXCAQC-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2C3(CC2)CCOCC3)F)CC4,A5584F279E467D85_1CFA39B8874AAC1D_6041_UN,7.2044544,00000000000100000001000000000000000000000010000000000000010000000010000000010001101001110011010000101000010111011001101011100000110011110110001011011011010111101111110,KYPFESBEMPZJKQ-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3CNCC(C3)(C)C)Cl,E4C3776811DBF904_2EDAFDFAA8B549A4_6034_DP,8.688901,00000000000000000000000000000000000010000000000100000000000000000110000000110110111101111011000010101001001110001001000111100100100101110110011011001111010110101111010,PWQINMYMLPWVAF-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NC[C@H]4[C@H](C3=NC=C[N]3C)OCC4,14A4042F962038A7_0BF590D222BB89D1_6041_UN,8.387645,00000000000000000000001000000000000000100010000000000000010000100100000000010101001101010011010111001000000101000000001011100100110011110110001010011011110111101111110,DEBOZFSYZSFTHQ-SUMWQHHRSA-N
CC1=C(C=CC(=C1F)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,18E28292943BEBCD_3ACD0D5EAC3155BE_6041_DP,7.995392,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110101111010,XFRCHANHASYTQA-FUHWJXTLSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC[C@]23C[C@H]2COC3)F)CC4,D36C9021C9E138F5_804B46D36336D2AC_6041_UN,7.3128967,00000000000000000001001000000000000000000010000000000000010000000010000000010001101101110011010011101000010111011001101011100000110001110110001011011011010111101111110,KXKYPUYDASAKFQ-LPHOPBHVSA-N
CC1=C(C(=C(S1)C)C#N)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,B0DBD06E7B37CB90_B9B268451748176F_6041_DP,7.4254627,00000000000000000000000000000000000010000110000000000100000000100000000000000000111100111011000010101000100110010000001011000100110101110110001011010111010110101111010,RPJYLGMDNUMRJD-DOTOQJQBSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC3=C2CCCCC2=CN=C3,0BFC6EC1D58A6219_87223291CDCA6B6A_6041_UN,7.9413223,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100011010000100100010000001000001001000100110001010100011011011101000010101111010,SWYQOZQHBGVKBV-UHFFFAOYSA-N
FC1=C(C(=CC=C1)F)C4(C=C[C@@H]2CCCO[C@H]2C3=CC=N[N]3C)CCC4,AA3454816D6EE5A9_1617CCFB72DE9546_7019_UN,8.52571,00000000000100000000000000000000000000000010000000001000010000100110000000010000100100010000011111110000000101001000001011101100100010100100001011011010110011101111110,ZFWLAWDJPRGRIS-MGPUTAFESA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCC2=NC(=CC=C2)COC3COCC3,DFB755EB6E16367A_3C443F9E26634E83_6041_UN,8.405133,00000000000000000000100000000010000010000000000000000000010000000100000010100001011100101100010110101000000001011000001011000111110011010110011110011111110111111111110,ZEJSTIFHHBAGGV-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CNCC3(O2)CCC3)F,3F1E7DC8D44C8016_008DFB8E53173856_7022_DP,7.500713,00000000000100000000000000000000000000000010000000000100010000000010000000100000101001110011010100101000010100001001001011100000110111110110001011011111110111101111110,LDMJYUKIUHEWAP-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCCC3(C2)OCCO3)F)CC4,92C59B1BF0BCEAAE_CF12B5D0189280EF_6041_UN,7.1798835,00000000000000000001000000000000000000000010000000000000010000000000000010010001101101110011010010001000010111011001101011110000110011110110001011011011110111111111110,YWUBBZWXVHYRHD-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,ED62D0429F023E89_140F112AB1EDA5B3_6041_UN,8.097451,00000000000000000000000000000000000000100010000000001000010000100100000000010101101100010011011011001000000111000000001011101100110011110110001011011111110111101111110,JBXAJHAOQWUEDG-PXNSSMCTSA-N
NCCCC(OC1=C2C(=CC=C1)CNC2)C3=CC=C(C=C3)F,EA3BC0CD7D854DFB_CA830BEF9BB5DF34_6035_UN,8.463005,00000000000000000000000000000000000000000010000000000000000000000000000000000000001110110011000011001100110100010100001001000111010110100110001111010001110101100111110,BLWDQRSVDXPCNU-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[N](N=C2)C3CCCCO3)NC4=CN=C([Si](C)(C)C)C=C4,6F654A27F5421B51_4102BC7575CF7462_6041_UN,7.782168,00000000000000000000100000000010000000000000000000001000010000100100000000110001100100100000111110100100010001111000011011101100110011010100011001011101010011101111110,CXVVYKHVYFUTAC-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@H]2[C@H](CCCC2)N3CCOCC3)Cl)C4CC4,7296E6B57E5B1F82_6C963200488817C7_7022_UN,7.7263193,00000000000000000000001000000000000000000000000000000000010000100000000000010000101001110011000100101001000111010000001011100000110011110110001011011011010111101111110,SWWJUFJQJWKPDY-UWJYYQICSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CCNCC3)C4=C(C=NC=C4)F,9C8C81025C3BCE9E_CBD05D78F84CB1D0_6041_DP,8.421,00000000000000000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000100110011001101011100100110101110110001011011011010110101111010,GHBVKSKBKXFYIU-IBGZPJMESA-N
N1CCC4(CC1)CCC2=C(C=CC(=C2)NCC3=CC(=C(C=C3)F)CN(C)C)O4,6795E3D1F509C28D_28A300803AC6526D_6041_DP,7.454624,00000000000000000000000000000000000000000010000000000000010000000010000000100000001001110001010001101100110100011101001011100100110111110110001011011111110111101111110,KJQDJCZYAXGNNN-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)C=C,D4F9D9DDF02DF28D_9AE5703E5075FB0C_6041_UN,8.540736,00000000000000000000001000000000001000000010000000000000000000100100000000010101101101010011010010111000000100010000001011100100110001110110001011011011010110101111010,GEIDPOFZDBTFOJ-VFNWGFHPSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,03C9E68DBBAD7034_BEBD5FBF67995E91_6041_DP,8.239476,00000000000000000000000000000000000000100010000000000100000000100100000000000100101000110011000000101100110110010000001011000100110101110110001011010111010110101111010,MYKNEIUSFHFSOA-PKOBYXMFSA-N
N(CCN1CC2CCC(C1)O2)C(=O)CC3=C[NH]C4=C3C=CC(=C4)F,7EDB544AA8D57515_4F5E2711D247F750_6038_UN,8.226291,00000000000000000001000000000000000000000010000000000000010000000100000000010001001101110011100110101100110100110000011011100100110110100110001001011001111111110111110,XECXJCFUBMVLJU-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,7F6CB6428BEBD41D_1451840682459DBC_6041_UN,8.957148,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110011011011111110111101111110,ROAWFJDPDARAJD-RDJZCZTQSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2N=CC(=CC2=CC=C3)Br)C4,B07D9A9C46FE76B2_B1128794EA5C46BE_6035_UN,8.568207,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000010111101100010100000101001001100111110000100100001101011110110111101111110,UJYQWBDDACCXEV-PQIIZBDJSA-N
CC1=CN(C2=C1C=CC(=C2)F)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,812EC100F89D05B4_086E2CA2C7A52D86_6034_UN,8.63755,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101100010110010000001011100100110001100110001011011110010110101111010,NEHOSXPEDWGNSS-ZHRRBRCNSA-N
CC1=CN(C2=C1C=CC(=C2)Cl)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,87684E4E66A64C73_842C731882C3A6D5_6034_UN,8.637552,00000000000000000000001000000000000000000000000000000000000000100100000000010101100101010000010010101101010110010000001011100100110001100110001011011110010110101111010,HQOFPGJTQOKNAB-ZHRRBRCNSA-N
CC(C)C1=C(C=C(C=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)F,670E5226DC3C6D7E_2A45C70CE4B76C4E_6041_UN,9.008121,00000000000000000000000000000000000000000010000000001000010000100100000000110000101101110001011110101000000111010001101011101100110011110110011011011111110111101111110,WPSRSDIJJKALAO-OALUTQOASA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NCC34CC(C)(CC3)CO4,9F9424CB9D43CF8E_4C79B9B762DD92C8_6041_UN,7.4396267,00000000000000000000000000000000000000000010000000000000010000000110000000000000101100010011000110101100010111001001101011000100110011110110001011010111110111101111110,RONLJHGTIDRAFV-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2CC3(CC2)CCOCC3)F,611AADD8F0CC953B_1F8580CE0BBE7470_7022_UN,7.6615095,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110011010010101000110101011001001000100000110011110110001011011111010111101111110,HHAWVYHYGRSJDA-UHFFFAOYSA-N
CC1=C(C=CC(=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)F,113276F0D504BCF6_658D25C822665CC1_6041_UN,8.193877,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011111010110101111010,XWWSBSCPFWOXDY-QRWLVFNGSA-N
CC1=C(C=CC(=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)Cl,C9707FB4EEF7B8FD_E9A005606161E015_7022_UN,8.193865,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011111010110101111010,TWRHADUWSSRHQT-QRWLVFNGSA-N
NC2=NC1=C(C=CC(=C1)Br)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,49C19ADB66A07CDE_C1299C929F7841B4_6034_UN,7.7694263,00000000000100000000000001000000000000000000001000000000000000000110000000110101000111010010000010001100011110001000101011100100110001110100001011011111010110101111010,IPECCXDJBCEBLT-KUNJKIHDSA-N
NC2=NC1=C(C=CC(=C1)I)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,ADD28CD1F27C53DA_C38994BF47E54D60_6034_UN,7.7693777,00000000000100000000000001010000000000000000000000000000000000000110000000110101000111010010000010001100011110001000101011100100110001110100001011011111010110101111010,NOBUNYVLVUVENK-KUNJKIHDSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CCOCC3C,25A4C32E2F64F8F6_13ADAF0B949E2D6E_6041_UN,8.210711,00000000000000000000000000000000000000100000000000000000010000000100000000000100001000100011000000101100010011000001101011000100110011010110011011010111010111101111110,UDMAWKMSNCMZLQ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCNC23CCC3)F)CC4,2D27D86DE2157F48_A00C3183CA5372A2_6041_DP,7.770954,00000000000100000001000000000000000000000010000000000100000000000010000000010001101101110011010010001000110110011001101011100000110101110110001010011011010110101111010,PKUAQWXPTAXFLI-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC2C(CCN2)C3CC3,14ADB1D221BCFF46_2807863F564657D0_6041_DP,8.199352,00000000000000000000001000000000000000000110000000000010000000100000000000000001001100010011000010001000100110010000001001000000110101110110001010010011010110101111010,JLDGUUQKTCOVOF-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(CC)CNC3)C4=CCNCC4,2BAEC6328FCF8E9C_E9226A3FAA95C8C7_6034_UN,8.92618,00000000100100000000000000000000000000000010000000100000000000100110000000011000101101110011000010111100110100011010101011100100110100100110001001011001010110101111010,BFMHNJZPCHLHCB-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NCC3CCCN(C)C3C4=CC=CS4,9C2C93E6D0AFACA8_9E5940E95AE7058E_6041_UN,8.289464,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011111010110101111010,CHTTZRPMZITTTM-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC3NC2COCC2C3,55B5D522E980B07E_377A0C235616E36E_6041_DP,8.224065,00000000000000000000000000000000000000000110000000000010010000000000000000000001001100110011000111001100110111010000000011000000110101110110001010000011010111101111110,BPXUKQZOKRJJHV-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NC[C@@H]3CC[C@@H](O3)C4CC4)C,93E253C18F3483E4_59E211BA72D8DAF3_6041_UN,8.326853,00000000000000000000001000000000000000000010000000000000010000100100000000000000101100010011000110101100010110000000001011000100110011110100001011010111110111101111110,VIUYJSMFTOCXLN-WMLDXEAASA-N
C(C12CCC(CC1)C2)=CC3=C[N](C)N=C3C4=C(C=CC(=C4)F)F,8100F6ABFFC10729_5CDDBC6D68C08C54_7019_UN,8.301324,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001011011010000010101111010,BTCVFNICCFROBL-UHFFFAOYSA-N
C(C1(CC1)C2CCCO2)=CC5=CC3=C([N](N=C3C)C4=CC=CC=C4)N=C5Cl,4A4392B76B75FDDB_7D0CA2B6796FED5A_7019_UN,8.408657,00000000000000000000001000000000000000100000000000001000010000100110000000010101100100010000001010110101010101001000001011101100110011110100001011011010110011101111110,AIKSWGCBAUSZEP-UHFFFAOYSA-N
FC1=CC(=CN=C1)C2=C5C(=CC(=C2)C=C[C@@H]3CCO[C@H]3C4=NC=C[N]4C)OCO5,6FB5D2C3C93E70E1_CF34B7A134755413_7019_UN,8.628031,00000000000000000000000000001000000000100010000000000000010000100100000010010101000101010000010110110100010101000100001011110100000010100110001011111010110011111111110,DLRVTWFRNSVSET-FOIQADDNSA-N
C([C@]12C[C@H]1COC23CCC3)=CC5=C(N(C)C4CCCC4)C=CC(=C5)F,997E6B648F13C864_E2679AC7A67F41A9_7019_UN,8.040697,00000000000100000000001000000000000000000010000000000000010000000010000000000000000101010000010010110000010111011000101000100000110011110100000011011010110011101111110,UIXIYGIITFJUOK-UWJYYQICSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2C3(CCNC2)CCC3)F)CC4,478726E9B08BBA94_86FBDB4D0C17E81D_6041_DP,7.6970425,00000000000100000001000000000000000000000010000000000100000000000010000000010001101001110011010000101000110110011001101011100000110101110110001011011011010110101111010,SDZBMFIRQFXWEH-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)C=C[C@@H]2CCO[C@H]2C3=NC=C[N]3C)OC(OC4)C5=CSC=C5,EA82FED37E9A61CB_BE0E968E6E59B4D5_7019_UN,8.747729,00000000000000000000000000000000000010100010000000000000010000100100000000010101000101011100010110110100010101000100001011110100000010100110001011111010110011111111110,FMUJRTSRZINEDG-MKVJMOTESA-N
N1CCCC2=C1C=C(C(=C2)NCC3CCCN(C)C3C4=CC=CS4)F,412CD1126BE1A8ED_B262A09CD2BD7925_6041_DP,8.109228,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101100110110010001101011100100110101110110001011011011010110101111010,HCUIEJOTYGBXFT-UHFFFAOYSA-N
CN4CCC1=C(C3=C(N1CC2CCSC2(C)C)C=CC(=C3)Cl)C4,1E0D40A6A81C4FBB_A2C5E74B22D309AD_6034_UN,8.0197115,00000000000000000000000000000000000010000000000000000000000000000110000000110000110101111000010010101101010110011001101011100100110000100110011011011110010110101111010,FIPBFDVEHLHLJG-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NCC3CCCN(C)C3C4=CC=CS4,087B813A0D17D6B7_1DC79BD74AB4E3A3_6041_UN,8.037212,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,KGABZZOEWUPJBK-UHFFFAOYSA-N
FC2=C(C=C1C=C[NH]C1=C2)NCC3CCCN(C)C3C4=CC=CS4,09B06D9799BC304E_EDFF346ACEA3C6A4_6041_UN,8.689524,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110101110110001011011011010110101111010,FIWQXZOWMFPWBQ-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=CN2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5)Br,D14BAB0BD81D15B0_B6B32A2A8325FB99_6034_UN,8.267135,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011110010110101111010,YMQSIWFTMWQCTK-UTKZUKDTSA-N
CC1=C(C2=C(C=C1)C=CN2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5)F,6D5A639202E86A23_9CB9C5D0B364BF33_6034_UN,8.267135,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011110010110101111010,JBMOHMBNXYZYIT-UTKZUKDTSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@H]3CC[C@]2(OCCNC2)CC3)F)CC4,CCE307E30AD32A03_98A121C0CF6A6970_6041_DP,7.4430323,00000000000000000001000000000000000000000010000000000000010000000010000000010001101001110011010100101000110111011001101011100000110111110110001011011011110111101111110,HDEPAGYOEPSGEK-XYWHTSSQSA-N
FC1=C(C=C(C(=C1)NCC2CCNC(C2)(C)C)C#N)F,ED82EEBE0C5DAE98_96E3FE1D200834CE_6041_DP,8.752431,00000000000000000000000000000000000000000110000000000000000000000010000000100000101000010011000000101000100110011001101001000000110101110110001011010111010110101111010,XZKOXOSFVVOLJN-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)F,BCEC4FD6E7201375_EA94D3C4C06F2B7E_6041_UN,8.957427,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110011011011111110111101111110,LUWGYOYTRIBHMS-IRXDYDNUSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CCNC3CC)Cl,0AE5F6717B27C9ED_67B298C574F0D1FE_6034_UN,8.278818,00000000000000000000000000000000000010000000000100000000000000000100000000010110111101011011000010001001101110010010001111100100110101110110001010011111010110101111010,YIYONKLMRKFEID-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC3CNCC(O3)(C)C,18464351419EFCB3_883B8D24A4005A94_7022_DP,8.200268,00000000000000000000000000000000000000000010000000001100010000000110000000110000101100110010001110101000000110011001000011101100100111110110001011001111110111101111110,OBETYAXJUJFZLP-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC34OC(C)(C)C(C3)C4,4655395C1CF30F9B_1722F3C29BDD3874_7022_UN,8.127687,00000000000100000000000000000000000000000010000000001000010000000110000000110000101100010010001110001000010110011000100011101100100011110110001010001111110111101111110,RWVSVRWMJNKDKB-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C(F)F)Cl)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,DBF18344FE3F1B4D_37F70D82482C75B3_7022_DP,8.726515,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101110011010010001001000110000000000011100100110101110110001010001011010110101111010,MJAJEUHBANFBCW-NWDGAFQWSA-N
FC2=C(C=C1OC=CC1=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,2205229B8973F2A0_6529503E498A6958_6041_UN,8.6074,00000000000000000000000000000000000000000010000000000000010000000000000000000000100101110010010011001100010110010001101000100100110001110100001011011011110110101111110,VSDKFPAECBZRGH-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[C@H]3OC[C@H](C)CC3,83C30EDF458264D2_6FD72F294F8E0042_6041_UN,8.528748,00000000000000000000000000000000000000000010000000000000010000000100000000000001001000010011000100101100010111000001101011000100110011110110001011010111110111101111110,ULQONDCOQYTREV-RISCZKNCSA-N
N(CC1CC2CCC(C1)S2)C(=O)CC3=C[NH]C4=C3C=C(C=C4)F,69BC2558B49A082A_6EB6568CFED5E9C3_6038_UN,8.1346,00000000000000000001000000000000000010000010000000000000000000000100000000000000011100011011100010101100110100110000011011000100110110100100001001010001011110100111110,OVOKMDAEYWWNQO-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)F)F)F)NC(COC)C2CCCOC2,30989F1094474030_AB5B5B3597113C1B_7022_UN,8.263448,00000000000000000000000000000000000000000010000000000000010000000000000000000000000000110011010101100000100101010001001000000010110011110110000011010011010111111111110,SPRVNGGHHLJJBN-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NC(CC)C3CCCCCC3,1D4D4E8BE14A7239_48828D3F66B97344_6041_UN,8.046766,00000000000000000001000000000000000000000010000000000000000000000100000000000001000000010011000000100100110110010010001001000100110001110100001011010011000110101111010,JGUURJNHVZBZPM-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)C[N]3C=CC4=C3C=CC(=C4)F,43B4E2E731C8E1D2_87F02E179002C562_6038_UN,8.2839,00000000000000000000000000000000000000000010000000000000000000000100000000010001001101010011100110001100110100110000011001100100110010100110001001011001011110100111110,MWZFZFPBHNZAKD-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC34CC(OC3)CCO4,A6943DBDA2F41B12_733BE030B2AE6E2C_6041_UN,7.970147,00000000000000000001000000000000000000100010000000001000010000100110000010010101101100010111011111101000010101001000001011101100110011110110001011011011110111111111110,NBKQPVDDELXQTD-UHFFFAOYSA-N
C2(=C1[NH]C3=C(C1=CC=N2)CCC3)NCC4=CC=C([Si](C)(C)C)C=C4,E63A62CE39A6EC1E_426ABB911B4BC0AD_6041_UN,7.538784,00000000000000000000100000000010000000100000000000000010000000000100000000100101001100100011010010101100110000011000001011000100010101010100011011011101010110101111010,PBUBPISKLSRRMQ-UHFFFAOYSA-N
CC1=C(N=CN1C[C@H]2[C@@H](CNC2)C3CCOCC3)C4=CC=C(C=C4)Cl,E03CDC97F8BF363C_239CD7A7056F52DB_6034_UN,8.424373,00000000000000000000000000000000000000000000000000000000010000100100000000010101101101110011000010101001000101000000101011100100110010100110001011011011010111101111110,VXIMFTZGYPUGQX-HKUYNNGSSA-N
FC1=C(C=C(C=C1)CC#N)NC(C2CNC2)C3=CC=C(C=C3)F,E79E241506008437_47E0F3ADAA2AF056_6041_DP,7.634086,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110011000000001000000100010000000001000100000101110110001011000011010110100111010,DNZZPLWUSUDFBY-UHFFFAOYSA-N
N1CCC4(CC1)CCC2=C(C=CC(=C2)NC3=C(C)[N](N=C3)C[Si](C)(C)C)O4,125EB6209893F8CF_E421ADACB31CCD02_6041_DP,7.1661277,00000000000000000000100000001010000000000000000000001000010000000110000000110001101100100001011011101100110000011101101011101100110111010110011011011111110111101111110,HGECXTPTLVHZKE-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,4A43B620D9941950_72DDFF9E7D8D6484_6041_UN,8.344759,00000000000000000000001000000000000000100010000000001000000000100100000000010101101101010011011010101100010110010000001011101100110001110110011011011111010110101111010,XFOUMZLTWDBIOF-HXOBKFHXSA-N
C2(=C1OC=CC1=CC(=C2)F)NCC3CCCN(C)C3C4=CC=CS4,2805A73492725CC7_42AAB41CA640EB81_7022_UN,8.445331,00000000000000000000000000000000000010000010000000000000010000100000000000010000111101111011010110101100010110010001101011100100110001110110001001011011110110101111110,LTUQKGCVLGKING-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,385D5C6335D29767_5FFFE7C756B609B2_6041_UN,8.393602,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011111010110101111010,BSVYMBNQIMWPOD-HXOBKFHXSA-N
CC1=C(C=CC(=C1)F)NC[C@H]2[C@H](CCCC2)N3CCOCC3,56DD07AF187367A4_92B402BB8C67907E_6041_UN,8.285031,00000000000000000000000000000000000000000010000000000000010000100000000000010000101001110011000100101000000111010000001011100000110011110110001011011011010111101111110,IVCGUDQSAYHZFX-YJBOKZPZSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC(CC)C3CCOCC3,45F12F940A22551C_13F86E23CD670A22_6041_UN,8.133509,00000000000000000000000000000000000000100000000000000000010000000100000000000100001000100011000000101100010011000010101011000100110011010110011011010111010111101111110,KJOPBSLOOPAYQN-UHFFFAOYSA-N
CC1=CC(=CC(=C1)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,8126EB366C20485A_9607027147670A11_6041_UN,8.390705,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011111010110101111010,ATZSZQNKNFWXCY-QRWLVFNGSA-N
CCC(OC1=C2C(=C(C)C=C1)CCCN2)C4=C3OCCC3=CC(=C4)Cl,32E5D184402AD1F0_37FB0F46BE138B3C_6035_UN,7.95619,00000000000000000000000000000000000000000000000000000000010000000000000000000000001100010111000110101101110111010110101011000111100010110110000111010101110111111111110,FTFGMXMFSSWNGA-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC[C@@H]2CCCN(C)[C@H]2C3=CC=CC=C3)C4OCCO4,594EBC89791F6FED_2C14FBCDBDA2BB39_6041_UN,8.260843,00000000000000000000000000000000000000000010000000000000010000100000000010010000101101110011010010101000000111010001101011110100110011110110001011011011010111111111110,DYXQHJQSARNDNQ-UWJYYQICSA-N
FC1=CC(=CC(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C4(CC4)C#N,691A6ECA8DAC2A4B_008D0C40B8558DF4_6041_DP,7.507235,00000000000000000000001000000000000000000110000000000100000000100010000000000000101000110011000000101000100100011000001001000100110101110110001001010011010110100111010,AIVWPZQIEPGUEO-HRAATJIYSA-N
N5CC1=C(C=C(C=C1)NCC3=C(N2CCCN(C)CC2)C=CC(=C3)F)C4(CC4)C5,610A295EE9F9F961_0B3882D7EAD2256D_6041_DP,7.662767,00000000000000000001001000000000000000000010000000000000000000100010000000010001101001110011010000101100010110011001101011100100110101110110001011011011010110101111010,VKUCRMRTLYLGJS-UHFFFAOYSA-N
NCCCC(OC1=CC(=CC=C1)C2CNCC2)C3=CC=C(C=C3)F,8A77499084DFEAAC_4068BEE4FC314B9D_6035_UN,8.677124,00000000000000000000000000000000000000000010000000000000000000100000000000000000001110110011000010001000100100010100001001000111010110100110001101010001110101100111110,JXRHZMUAINKQQI-UHFFFAOYSA-N
C1(=CC(=C(C(=C1)F)F)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,F9963CD9AC30AE29_85AA2B6FB88BA3A2_7022_UN,9.056877,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,SRVJGQYRQDJPKU-BLVKFPJESA-N
FC1=C(C=CC(=C1)C2CC2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,45D6D5250BCC2116_45501A5E1277804F_6041_UN,8.296512,00000000000000000000001000000000000000000010000000000000010000100000000000010000101001110001010100101000000111010001101011100100110011110110001011011011110111101111110,XQZSMOOWKOMXTI-SFTDATJTSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,4BD78B9E030549FD_118C85D572852887_6041_UN,8.405294,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011111010110101111010,VGHHZIYVMPNDRA-HXOBKFHXSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2CC3CCCN3CC4CCCN4,AFCADDCCFAD78D1A_5EDE77B12D11FE7E_6034_UN,8.61946,00000000000000000000000000000000000000000000001000000000000000000100000000010001001101110011000010001100110100010000101011100100110000100110001010011111010110101111010,RFTIPVJPOLAKBU-UHFFFAOYSA-N
CC1=NC5=C(C(=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)C=CC(=C5F)F,9A5C6E27A6EBD975_26C244001F73803E_6041_UN,8.653105,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011111010110101111010,FFGXDESEOWLFTH-CMJOXMDJSA-N
NCCCC(OC1=CC=C(C=C1)C2NCCC2)C3=CC=C(C=C3)F,25AF13402FBF6E9E_9D08757F8564D5E1_6035_UN,8.670831,00000000000000000000000000000000000000000010000000000000000000100000000000000000001110010011000010001000100100010100001001000111010110100110001101010001110111100111110,PSAMUQVXBJIIOF-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CC3(CC2)CCOCC3)F)CC4,FB0E51BFD931FDE0_EBEC10A7333F35CB_6041_UN,7.169612,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110011010010101000110111011001101011100000110011110110001011011011010111101111110,RRADXBXQJTVKAK-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3(CC)CNCCC3)Cl,0E9C18776CD05177_82D6E72C3F3833C7_6034_UN,8.561263,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101111011000010101001101110011010101111100100110101110110001011011111010110101111010,HFZKDXAUCVPSGV-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2CCOC(C2)C3=CC(=CC=C3)F)C4CCCC4,F481C01695C66703_F731BAD7A0FBD020_6041_UN,8.226259,00000000000000000000000000000000000000100010000000001000010000100100000000010101100100010010011011100000100101010000001011101100110011110100001011011011110011101111110,KOQRVQCUTVMSQQ-UHFFFAOYSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC3=C(N(C)C2CCCC2)C=CC(=C3)F)C4,8C783290905246CE_09E8FDE079B86109_7019_DP,8.772564,00000000000000000000000000000000000000000010000000000000000000000000000000000000000101010010010010010000110110010000101001100000110001110100001011011011000010101111010,ATIZARCMGNGMQD-BJZITVGISA-N
FC2=C1C(=C[NH]C1=CC=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,744DADE26BE9F633_C01BF73315E91FE0_6041_UN,8.454156,00000000000000000000001000000000000000000010000000000110000000100100000000010101101101010011010010101100010100010000001011100100110101110110001011011011010110101111010,JEEOPYSKWQUQFS-SZNDQCEHSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3CC4(CN3)CC4,F413DA56768D2158_867E9816EAF3B68B_6041_DP,7.7130117,00000000000000000000001000000000000000100000000000001010000000100110000000010101101101000011011010001000110010011000000011101100110101010110001010011111010110101111010,IYFHIAKIZCEWBZ-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC3C5CCC3CC4=C(C=CC=C4)C5,085E6C6B7C5D0635_1419B2B7C97DE2D0_6041_UN,7.698336,00000000000000000001000000000000000000100010000000001000000000100100000000010101100100010011011010100100010100000000001011101100110001110100001011011011000010101111010,GRZLBBJBCNDZKH-UHFFFAOYSA-N
NCC3(OC1=C2C(=CC=C1)OCCNC2)CCC4=C3C=C(C=C4)F,66E3569B82860389_98E7062607F84674_6035_UN,7.8155975,00000000000000000001000000000000000000000010000000000000010000000010000000000000001010110111000111001100110101011100001011000111110110100110001111010001110101110111110,QUBKDRAPBIWCOO-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NC[C@@H]2CCCO[C@H]2C3=CC=N[N]3C,DCF90C6FEF5212F8_228CF4B446A70B09_7022_UN,8.131351,00000000000000000000000000000000000000000010010000001000010000100100000000010000101100010011011111111000000101000000001011101100110010100110001011011011110111101111110,XQFCCEAQSSAPPP-KBXCAEBGSA-N
CC1=CC(=C(C=C1)F)NC[C@H]2[C@H](CCCC2)N3CCOCC3,194923754C7827C2_091BF2CE768CA34F_6041_UN,8.424141,00000000000000000000000000000000000000000010000000000000010000100000000000010000101001110011000100101000000101010000001011100000110011110110001011011011010111101111110,ZHABUXWRVZTFFR-YJBOKZPZSA-N
CC1=C(N=C(N1C[C@H]2[C@@H](CCNC2)C3=CC=C(C=C3)F)C4CCCN4)C5=CC=CC=C5,A5259F83ABBD8A3D_4B257BE88F8C7D20_6034_UN,8.840717,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101000100100010000101011100100110100100110001011011011010110101111010,NVTKAHPNZJEZPC-GXBCDIMNSA-N
N(CC1C2CCC(C1)C2)C(=O)C[N]3C=CC4=C3C=C(C=C4)F,FED3C6F0A813F54B_55BC51C580797EFD_6038_UN,8.2864685,00000000000000000000000000000000000000000010000000000000000000000100000000010001001101010011100110001100110100110000011001100100110010100110001001011001011110100111110,FTJVSVIWRCVJQI-UHFFFAOYSA-N
FC2=C(C=C1C=CC=NC1=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,265E90BEB67A0A8C_9FFFD22B5036694E_6041_UN,8.741303,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,RJSJHPMHFAJBQH-ZHRRBRCNSA-N
CN5CCC1=C(C4=C(N1CC3CCC2(CCOCC2)CN3)C=CC(=C4)Cl)C5,4769549FB776FD41_170E891B361BF3E6_6034_UN,7.135678,00000000000000000000000000000000000000000000000000000000010000000110000000010001101101110011010010101101110101011001101011100100110010100110001011011001010111101111110,VDTOAMQCKFWLAQ-UHFFFAOYSA-N
CC4=CC1=C(C=CC(=C1)NCC2N(C)CC3(CC2)CC3)[NH]4,81077F6C8BDDD338_FAC9921D4A2582AD_6041_UN,8.096027,00000000000000000000001000000000000000000000000000000000000000000110000000010001001101100011010010101100010010011001101011100100110101010110001001011111010110101111010,PVEKMWSZCWFRMB-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2OCC3(C2)CCC3)F)CC4,CDBB78DCC8387A79_30C548D88520F586_6041_UN,7.219963,00000000000100000001000000000000000000000010000000000000010000000010000000010001101101110011010110001000010111011001101011100000110011110110001010011011110111101111110,CRWLBWWWCUFQTF-UHFFFAOYSA-N
N5CC1=C(C=C(C=C1)NC2=CC(=C(C=C2)N3CCCC3)F)C4(CC4)C5,ECA907D6984D7D06_C979A237880F3074_6041_DP,8.294206,00000000000000000000001000000000000000000010000000000000000000100010000000010000001101110011000010101100010100011000001011100100110101110110001011011011010010100111010,OCMVKADADNWWAR-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)F)NCCN(C)CC2COCCC2)F,C8994F956CDECA3C_713D8973C115DEF4_6041_UN,7.64172,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001011011111010111101111110,OEQPRFIDMXMFNY-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CCCC3)C4=C(C=CC=C4F)F,E5089AD14FBFB8E5_7588BDC0482D6948_6041_UN,7.8389797,00000000000000000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100110001110100001010011011010110101111010,TYUYRXBGWROYOM-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3CNCCC3)CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,3D1671BFC7A35E5D_BE083131591930E8_6034_UN,8.363387,00000000000000000000000000000000000000100000000000000000000000100100000000010101101101110011000010101101110110010010101011100100110100100110001011011111010110101111010,OEHMFIIQLIWMMR-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NC(CC)C3CCCCC3,6A3033A36C7E6F4B_14A5A50191715D55_6041_UN,8.2113085,00000000000000000000000000000000000000000010000000000000000000000100000000000001000000010011000000100100110110010010001001000100110001110100001011010011000110101111010,KHKWXDUHWIYAOL-UHFFFAOYSA-N
CC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3CCOCC3)C=CC=C4Br)C,478EDCCBDC59FCE6_C7BD2EAC3735758A_6034_UN,8.613313,00000000000000000000000000000000000000000000001000000000010000100100000000010000101101110011000010101100010111000000101011100100110010100110001011011111010111101111110,UBFPRHDGKAXEJB-IRXDYDNUSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,5C07A7FE7557372E_BFD8BC4103E86223_7022_DP,8.060483,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101001100100010000001001000100110101110110001011010011010110100111010,OPACFBUCFAOROU-DZGCQCFKSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2CCCN(C)[C@H]2C3=CC=CC=C3)Cl)C4CC4,AA3B5B3422E5BEDF_F9F530F6B423F4D6_7022_UN,8.500483,00000000000000000000001000000000000000000000000000000000000000100000000000010000101001110011010000101001000110010001101001100100110001110110001011011111010110101111010,GIIBPICGBIHOLP-CVDCTZTESA-N
N(CC1CC2CCC(C1)O2)C(C4=C(C)N=C3C=C(C=CC3=C4)F)=O,47D5D40A641F11D0_91623ECB6274D1D4_6038_UN,8.23898,00000000000000000001000000000000000000000010000000000000010000000100000000000000101100010010100011101100010100100000011011000100110010100100001011010011111111111111110,VIGVTNFWWBLNMA-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCSC(C)C3,1A04B1BEA75159B4_205A06FA7550E811_6041_UN,8.098935,00000000000000000000000000000000000010100010000000000000000000000100000000000100011000011011000000101100010110000001101011000100110001110110011011010111010110101111010,YLQPJXTYTAJCOP-UHFFFAOYSA-N
FC2=C(C=C1C=COC1=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,4D78196F7EC0B2E9_2D19A331528E61CC_6041_UN,8.865231,00000000000000000000001000000000000000000010000000000000010000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011110110101111110,QUNCSWHYVQCICS-VFNWGFHPSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CCC2(CNC2)C3)F)CC4,E5BD8076841E74F6_1B53F59992D00EF4_6041_DP,7.7348776,00000000100100000001000000000000000000000010000000000000000000000010000000010001101001110011010010001000110110011001101011100000110101110110001010011011010110101111010,JSENSGZVVNYNOM-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCCCO3)C4=CC=CC=C4,1DCF2C95308AB912_F5AC5E973905D8EC_6041_UN,8.215451,00000000000000000000000000000000000000000010000000001000010000100110000000010000101100010011011110101100010101001000001011101100110011110110001001011001110111101111110,LABZHUMWIMHHEP-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NC4CC(C3=NC=C[N]3C)OCC4,90D030A38C9F8B97_5FFF62E2A8DD604C_6041_UN,8.425613,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010010010111100100110111010000001011100100110011110100001011011011110011101111110,KDRDIEDQTJCUSZ-UHFFFAOYSA-N
O([C@@H]([C@H]1NCCC1)C2=CC=CC=C2)C3=C(C=C(C=C3F)C#N)Br,1BE18114FE542630_8CF3B23BAF393B09_6035_UN,7.859554,00000000000000000000000000000000000000000110001000000000000000000000000000000000001100010011000110001000100100010100001001000111010000100100001111010011110011100111110,OTZKPVBMJFDBOD-DLBZAZTESA-N
O([C@@H]([C@H]1NCCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Br)C#N)Br,42C92AB3B9366A95_76204D4B8454A3B1_6035_UN,7.8595552,00000000000000000000000000000000000000000100001000000000000000000000000000000000001100010011000110001000100100010100001001000111010000100100001111010011110011100111110,DEMWONMUXBXTAF-DLBZAZTESA-N
O([C@@H]([C@H]1NCCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Cl)C#N)Br,5E543F5F7765B306_CEA8A0FD196681A8_6035_UN,7.85955,00000000000000000000000000000000000000000100001000000000000000000000000000000000001100010011000110001001100100010100001001000111010000100100001111010011110011100111110,IUHIRMBDFOVABN-DLBZAZTESA-N
CCC(C)C1=CSC(=N1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,9CC79B3358853B5A_FDEB21746A3FF207_6041_DP,8.281509,00000000000000000000000000000000000010000010000100000100000000100100000000000100111100111011000010101000101100010011001011000100110101110110001001010111010110101111010,SDQJDTWYVHMQTA-BOBJKBKNSA-N
FC1=CC2=C(C=C1)N(C=C2C3=CCNCC3)CC4(CC)CNC4,9B4A12C463036702_654A5D68F6576426_6034_UN,8.812554,00000000100100000000000000000000000000000010000000100000000000100110000000011000101101110011000010111100110100011010101011100100110100100110001001011001010110101111010,DGOUETXVNATYGP-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2C[C@@H]3C[C@H]3C4=CC=C(C=C4)F)C5CCNCC5,C7A0CC60A0F5DB99_E19E9083E3EBD09A_6034_UN,8.886012,00000000000000000000001000000000000000000010000000000000000000100100000000010000001101110001000010101100110100010000001011100100110000100110001001011011010110101111010,PZVCBLPOUMTWSS-UGKGYDQZSA-N
C[N]1C=C(C(=N1)C2CC2)NC4(CC3=CC=C(C=C3)F)CCCCC4,8F0BE0410406D261_1A8ABD69875E017F_6041_UN,8.043209,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100110001110100001011011011000110101111010,VLZKLYIBMRJOBD-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC3=CC2=C(CCNC2)N=C3,97221C7AE364A017_3AC20B743015C6A7_7022_DP,7.588017,00000000000000000000100000000010000000000000000000000000000000000100000000100001101000100001010000101100110000011000001011000100110101010110011011011101010010101111010,OSHINLNWAJYNJE-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC23N(C)CC(C2)C3)Cl)C4CC4,1C9045981FF06911_44B025EFACD23ABF_7022_UN,7.346367,00000000000100000000001000000000000000000000000000000000000000100010000000010001001101110011010010001001010110011001100001100000110001110110001010011111010110101111010,YSUCFEXOXAXZQC-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2C[C@H]3N[C@@H]4CC[C@H]3C4)C5=CCNCC5,483B051F39258E09_661DF5D919726888_6034_UN,7.8882985,00000000000000000000000000000000000000000000000000100000000000100100000000011001001101100011000010111100110000010000001011100100110100000110001001011001010110101111010,HKDXEQWKPQHQTF-SQGPQFPESA-N
CC5(C)CCC1=C(C2=C([NH]1)C=CC(=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C5,E6F2F3A8A5FE1FF2_8093DB1B12DA6C78_6041_DP,7.8976865,00000000000000000000000000000000000000000010000000000100000000100110000000100000101100110011000010101100110100011001101011000100110101110110001011010111010110101111010,JILJRWMLYDCLGF-GHTZIAJQSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC3=C[N](CC2CCCN2)N=C3,9C0CD7869A963906_2898FC8098F2C57F_6041_DP,8.099329,00000000000000000000100000000010000000000000000000001000000000000100000000110001101100100011011010001000100000011000001011101100110101010110011000011101010110101111010,URQBHTFTKBSZDN-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@@H]2CCO[C@H](C2)C3=CN=CC=C3)F)CC4,C6240746CBEEF366_53B8ACD9B3661074_6041_UN,7.9823847,00000000000000000001000000000000000000000010000000000000010000100100000000010001100001110010010001101000100111010001101011100100110011110110001011011011110111101111110,NGDZYTVPSGYRFN-FYYLOGMGSA-N
N3CCCC1=C(C=C(S1)NCC2=CC(=C(C=C2)F)CN(C)C)C3,C999B7B5323FB9F5_0674ED8B1E165A7C_6041_DP,7.5191116,00000000000000000001000000000000000010000010000100000000000000000000000000100000011101111011010010001100110100010001001011100100110101110110001010011111010110101111010,CIVDWQRGHQBRCQ-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,4126D8DF3D0399D7_3F2514C28DD00DC1_6041_DP,8.456212,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001111010110101111010,DNWLILVKQCKEBK-GXTWGEPZSA-N
CC1=C(C=C(C=C1)Cl)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,C85324E009B8722D_24AD6A2AF74749B6_7022_DP,8.456204,00000000000000000000000000000000000000000000000000000100000000100100000000010101101101110011010010001001000110000000000011100100110101110110001010001111010110101111010,ZOHHJHLDINPGMX-GXTWGEPZSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CC2(CCCNC2)C3)F)CC4,379B206D9F462FCF_F01BC71243634C9F_6041_DP,7.7521896,00000000000100000001000000000000000000000010000000000000000000000010000000010001101001110011010000101000110110011001101011100000110101110110001011011011010110101111010,MDBYBMDMHATGIK-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,D71D8D2D4E834F7B_B9EC00003927684F_6041_DP,7.7438364,00000000000000000000000000000000000000100010000000001100000000100100000000010101101101110011011010101000100110010000001011101100110101110110001011011111010110101111010,INZIGFXXJFWYOP-AZUAARDMSA-N
NCCCC(OC1=CC2=C(C=C1)CNCC2)C3=CC=C(C=C3)F,E8D5BFBDC5B8B5E6_056FD100C9C5EC79_6035_UN,8.543542,00000000000000000000000000000000000000000010000000000000000000000000000000000000001010110011000000101100110100010100001001000111110110100110001111010001110101100111110,RQLYPSHVZOACOH-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CC4=CC(=C(C=C4)I)Br,4B198FFE196A0057_CF78AFE03AB6D4E3_6038_UN,7.435924,00000000000100000000000000010000000000000000001000000000000000000010000000000000001000010010100010001000110100111000011000000000110010100000000011010011011110100111110,LJKXOSVPUSOJSB-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CC4=CC(=C(C=C4)F)Br,61684E102C0BDF68_D1B5DB7BFE759F57_6038_UN,7.435915,00000000000100000000000000000000000000000010001000000000000000000010000000000000001000010010100010001000110100111000011000000000110010100000000011010011011110100111110,PYVMZYIILLQBAV-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CC4=CC(=C(C=C4)Br)Cl,5871AFD803741406_0C6F790942AB6C87_6038_UN,7.435909,00000000000100000000000000000000000000000000001000000000000000000010000000000000001000010010100010001001110100111000011000000000110010100000000011010011011110100111110,DYPSBMJUTWGNMJ-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CC4=CC(=C(C=C4)Br)Br,4DE4AB334A2BCEA2_4ACA131508199AB8_6038_UN,7.4359007,00000000000100000000000000000000000000000000001000000000000000000010000000000000001000010010100010001000110100111000011000000000110010100000000011010011011110100111110,KQYNSWZJQQTGSE-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CC4=CC(=C(C=C4)F)Cl,744FBC9EEC45FB10_D80662D721A2F87D_6038_UN,7.435906,00000000000100000000000000000000000000000010000000000000000000000010000000000000001000010010100010001001110100111000011000000000110010100000000011010011011110100111110,LBDDJWXOYOCAQP-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CC4=CC(=C(C=C4)Br)F,3298D81849134F72_D847A8A33F4B5942_6038_UN,7.435904,00000000000100000000000000000000000000000010001000000000000000000010000000000000001000010010100010001000110100111000011000000000110010100000000011010011011110100111110,UTPMFXXNNXGZOR-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CC4=CC(=C(C=C4)F)F,DC1ABAC6BE1E811E_955B6C2F4A0B1B3E_6038_UN,7.4359026,00000000000100000000000000000000000000000010000000000000000000000010000000000000001000010010100010001000110100111000011000000000110010100000000011010011011110100111110,IFKRLXQOIFTIQH-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CC4=CC(=C(C=C4)Cl)F,E5B0FB3BE7B90A3B_BD0AB0A9946A9D42_6038_UN,7.4358964,00000000000100000000000000000000000000000010000000000000000000000010000000000000001000010010100010001001110100111000011000000000110010100000000011010011011110100111110,NZWSHXUJQQNJNV-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CC4=CC(=C(C=C4)Cl)Cl,DE2F10B062537CD2_1DE8F477789CCCCA_6038_UN,7.435892,00000000000100000000000000000000000000000000000000000000000000000010000000000000001000010010100010001001110100111000011000000000110010100000000011010011011110100111110,YGHFLCOFUBOVQF-UHFFFAOYSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC[C@@H]4OCCN(C)[C@H]4C5=CC=CC=C5,40E17124DAE3F700_BCEA474EE35A0377_6041_UN,7.850717,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101110001010110101100010111010001101011100100110011110110001001011011110111111111110,UTCXRTWQGSNZAR-GOTSBHOMSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,81E4BEC26E959A6C_AA788EE0DE1A451D_6041_DP,7.908639,00000000000000000000000000000000000000100010000000000100000000100100000000010100101101110011010010101000100110010001101011100100110101110110001011011011010110101111010,ULMUXJZKRNEBTM-DSKINZAPSA-N
CC1=CC2=C(C=C1)C(=CN2C[C@H]3[C@@H](CCNC3)C4=CC=C(C=C4)F)C5=CCNCC5,0E36F4704EB47C86_D98244B22956C848_6034_UN,8.712367,00000000000000000000000000000000000000000010000000100000000000100100000000011000101101110011000010111100110100010000001011100100110100100110001001011011010110101111010,WAWXXIDIDOOVSW-GMAHTHKFSA-N
C[N]1N=C(C=C1NC2CCC(C2)C3=CC(=CC=C3)F)C4CCCC4,9CCD3429D2DAD826_647CBD57805430C4_6041_UN,8.104638,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011011010000000100100010000001011101100010001110100001010011011000010101111010,BCWCBUDWHLFJTK-UHFFFAOYSA-N
C1(=CC2=C(C=C1)OC(C2)C3OCCO3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,3EB1A5DAC43ABED7_F9EF35B7BF7944C5_6041_UN,8.156579,00000000000000000000000000000000000000000010000000000000010000100000000010010001100101110011010010001100110111010101101011110100100011110110001011111011110011111111110,FYGHGEZRHBBSSZ-IZWFHCBGSA-N
C1(=CC(=CC=C1)C2CCCCC2)NC3=C[N](C[Si](C)(C)C)N=C3,DF0A03D367DE18EC_D602F7581891820A_6041_UN,7.6789355,00000000000000000000100000001010000000000000000000001000000000100100000000110001100100100001011010001000000000011001001011101100110001010100011001011101010110101111010,DSAICJKNRIKJEM-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CC3(OCC2)CCOCC3)F)CC4,0BB84C2A975F188A_8579D5585B763A4D_6041_UN,7.109184,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110111010001101000110111011001101011100000110011110110001011011011110111111111110,DNHMTBUHEBZBPG-UHFFFAOYSA-N
FC2=C(C=C1C(=C[N](C1=C2)CCC3CNC(C3)(C)C)CC#N)F,A83F00C139B06CD6_71C6F9F66E485FAE_6034_DP,8.777026,00000000000000000000000000000000000000000110000000000000000000000110000000110000001101010011000010001100110110011001101011100100110000100110001010011111010110101111010,WYHUYBGQVFAICB-UHFFFAOYSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)NCC(C4CCNCC4)C5=CC=CC=C5)F,373EAD02EA5C04CF_09AEB2E8C2201711_6041_DP,8.049689,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000110011000000101100110100010000001011000100110101110110001011010011010110101111010,QNTBFNAVOPLLTG-UHFFFAOYSA-N
C1(=CC(=C(C=C1)Cl)Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,D8082044C2A5B118_A8945707CBB1A43E_7022_UN,8.400581,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101001000100010000001011101100110001110110001011011011010110101111010,VBVGJFHAURVZCF-YJYMSZOUSA-N
C1(=CC(=C(C=C1)F)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,7D1D3B84ECCD5FE3_85107B3B35E1D9AA_7022_UN,8.400579,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,GWQFVZQLSRJKGD-YJYMSZOUSA-N
C1(=CC(=C(C=C1)Cl)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,0F663886042D0296_D7F19D3885E10D54_7022_UN,8.400561,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101001000100010000001011101100110001110110001011011011010110101111010,DRGFWNPSNAAEBF-YJYMSZOUSA-N
C1(=CC(=C(C=C1)F)Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,83D2855533D53F12_80BA3C6F3B487A87_7022_UN,8.40055,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101001000100010000001011101100110001110110001011011011010110101111010,FYISNVMCBUYRRI-YJYMSZOUSA-N
C(C1CCCC12CCOCC2)=CC3=C[N](C)C4=C3C=C(C=C4)F,DA2ED2AE928AC941_380F1246F180E41D_7019_UN,8.435156,00000000000000000000000000000000000000000010000000000000010000000110000000010000000101110000010010110100010101001000001011100100110010100110000001011000010011101111110,WVFULKOOBOLFAU-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NCC4=C(CN(C)C3CCCCC3)C=CC=C4,407F2F5EF0AE6FC3_5A1E57FEF3DF49FF_6041_UN,7.9266562,00000000000000000000000000000000000000000010000000000000000000000000000000000000001001110011010010001100010110010001101000100100110001110010001011011011010110101111010,DHQASOLZMHNIFT-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=C1)NCC2C3(CCNC2)CCOCC3,68C4580BBA374D55_CBA9E1EB1AF16074_6041_DP,7.688949,00000000000000000000100000000010000000000000000000000100010000000010000000100000101000100011010000101000110001011000001011000000110111010110011011011111010111101111110,ANVDCGSDSQVGCR-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CC2=C(C=CC=C2)CC3CCNCC3)C(=CC(=C4)F)F)C5,54197B27C5C17F91_D7041C26D7F3B2EB_6034_UN,8.649504,00000000000000000000000000000000000000000010000000000000000000000110000000110000001101110001000010101100110100011001101011100100110000100110001011011111010110101111010,UBKHLQSPRXCMOV-UHFFFAOYSA-N
FC1=C(C=C(C=C1)CC=C)NCC2N(C)CC3(CC2)CC3,E4AD23A385359738_C66807C6BC405F77_6041_UN,8.275377,00000000000000000000001000000000001000000010000000000000000000000010000000010001001001110011010000111000010110011001101001100000110001110110001011011011010110101111010,SMKVUXHOKVTKQA-UHFFFAOYSA-N
CCN1C(CC2=C1C=C(C=C2)F)C3=NC=CN3CC5(CC4=CC=C(C=C4)F)CCNC5,B6666115E7BC6FC2_629A7449EA872D65_6034_UN,8.712539,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101110011000010001100110110011010001011100100110000110110001011011011010110101111010,RZGIESYHZAGNLN-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)C=CC3=C2COCCC2=N[N]3C)OC(OC4)C5=CSC=C5,E4BE7546659DCBD2_62F804D85A4381A1_7019_UN,8.321368,00000000000000000000000000000000000010000010000000001000010000100100000000010000100100111100011011110100010111010100001011111100110010100110001011111010110011111111110,ZAVGBSFJXAATHB-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)F)F,DFDC6606D7A65836_A3313703ED13799A_6041_UN,8.890561,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110011011011111110111101111110,MTDMZSUBFURCFY-IRXDYDNUSA-N
CC2=NC=C1C=CN(C1=C2)CC3CCCN3CC4CCCN4,0EF4C4D84EC0F5ED_2F7FB492BAD85EA1_6034_UN,8.114068,00000000000000000000000000000000000000000000000000000000000000000100000000010001101101100011000010101100110000010000001011100100110000000110001000011011010110101111010,PYKCUCOCTJCFRJ-UHFFFAOYSA-N
C1(=CN=C(N=C1)C2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,03257D0469FB62C4_6BF81EEDAFA87C8E_6041_UN,7.971257,00000000000000000000000000000000000000100010000000000000010000100100000000010101100101110011010010101000100111010001101011100100110011110110001001011011010011101111110,OFQZHVBIFZUOQQ-MOPGFXCFSA-N
C2(=C1CCOCC1=CC=C2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,049D301C95B2CE17_237F59A847014B3D_6041_UN,7.345701,00000000000000000000000000000000000000000010000000000000010000000000000000010001000001110011010000101100010101010001101011100100110011110110001011011011010111101111110,BHGUNDDZNLZVGN-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NC[C@@H]3OCCN(CC)[C@H]3C4=C[N](N=C4)C,096F247025404D97_D0F29401CB3A2691_7022_UN,8.626296,00000000000000000000001000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010010101011101100110011110110001011011111110111101111110,JMYOOGVPIBLMPI-PMACEKPBSA-N
CCC(C)C2=C[N]1C=CC=C(C1=N2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,27AB8CFCE2E758B5_453B8C9D3DC12F70_6041_DP,8.17937,00000000000000000000000000000000000000100010000000000100000000100100000000000101101101110011000010101100110100010011001011100100110101110110001001011111010110101111010,ZRYBHEMDWQSMBQ-WVGSSIFTSA-N
N(CC1C2CCC(C1)CC2)C(=O)CC3=C[NH]C4=C3C=CC(=C4)F,B4CB677952ED2AE2_5AAA1CA0E9FAB954_6038_UN,7.935012,00000000000000000000000000000000000000000010000000000000000000000100000000000000001100010011100010001100110100110000011001000100110110100100001001010001011110100111110,UUZAWDFZEUIGNK-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,DD75F86BE08EEAF1_F3572F92DE367431_6041_UN,8.589056,00000000000000000000000000000000000000000010000000001000010000100100000000010001101101110001011110101100010111010001101011101100110011110110011011011111110111101111110,GRRGNZOCIJEHAL-ICSRJNTNSA-N
C2(=C1OC=CC1=CC=C2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,5951BBC29CE9D19E_DFD62BB06D258955_7022_UN,8.840614,00000000000000000000000000000000000000000000000000000000010000100000000000010000101101110011010110101101010110010001101011100100110001110110001001011011110110101111110,KJYVEQKRPMHJTJ-UHFFFAOYSA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=C3)CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,2BE3EB6C7F68E97B_BDF71EA9BEA32BAA_6034_UN,8.613274,00000000000000000000000000000000000000000000000000000000000000100100000000010001001101110011000010101101110110010010101011100100110100100110001011011011010110101111010,LYEAWVMOXFHVHK-UHFFFAOYSA-N
FC2=C1N=CC=C(C1=CC=C2)NC3CCN(C)C34CCCNC4,F92306FBF0958278_1CE5A16258E9D05F_6041_DP,8.598832,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,BJRLUMLPGIFXLO-UHFFFAOYSA-N
C1(=C(C(=CC=C1Cl)Cl)Cl)NC(COC)C2CCCOC2,5D6698D511C33ACC_3810D22D6B977A07_7022_UN,8.089655,00000000000000000000000000000000000000000000000000000000010000000000000000000000000000110011010101100001100101010001001000000010110011110110000011010011010111111111110,XDVNSHUKEJCPSJ-UHFFFAOYSA-N
CC1=C(N=C(S1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)C5=CC=C(C=C5)F,6067016778D7F7E3_B6D42763ED5E4584_6041_UN,8.273821,00000000000000000000001000000000000010000010000100000000000000100100000000010101111101011011010010101000001100010000001011100100110001110110001011011111010110101111010,CZGGLGAFWJVURM-VGSWGCGISA-N
CC2=CC1=C(C=C(C=C1C)Br)N2C[C@H]4N[C@H]3CCC[C@H]3C4,F871F9FA1F72BB0A_520B3118F43C9DF7_6034_UN,9.140324,00000000000000000000000000000000000000000000001000000000000000000100000000010001000101010011000010001100110100010000101011100100110000100100001010011111010110101111010,WOXSAHNYMDZPBW-QRTARXTBSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC23CC(OC2)CCC3)F)CC4,D060FE4806E4515C_D9D3E181E72621A1_6041_UN,7.6629868,00000000000000000001000000000000000000000010000000000000010000000010000000010001100101110011010111001000110111011001101011100000110011110110001011011011110111101111110,LVYWYPDTBKNRQI-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=C(C=C(C=N2)Br)Br)C3,8EA0D48741CC74CD_4853AEC34795787E_6035_UN,8.672766,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000110011101000010100100101011001100011110000100100001111011110110111101111110,SDJPQJPQWYGAJB-HEQLZXTPSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=C(C=C(C=N2)F)I)C3,5696EB3F1D715A6A_A1D5EA2865ACB526_6035_UN,8.672754,00000000000000000000000000010000000000000010000000000000000000000100000000100000000001110000110011101000010100100101011001100011110000100100001111011110110111101111110,UBDCZMZYHUCJLZ-HEQLZXTPSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=C(C=C(C=N2)Br)Cl)C3,8FEEE2D4D1C40578_53EBB3B9DF6592C7_6035_UN,8.672754,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000110011101001010100100101011001100011110000100100001111011110110111101111110,LHJXMRWDVFJYGT-HEQLZXTPSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC[C@@H]3CC[C@@H](O3)C4CC4,633379801556F6A2_D903EAEE2BC4D6B5_6041_UN,7.7776084,00000000000000000000001000000000000000100000000000000000010000100100000000000100001100000011000110101100010010000000001011000100110011010100011011010111110111101111110,HPWAZCNBGSWLIU-FUHWJXTLSA-N
C(C1CC2CCC1C2)=CC3=C[N](C)N=C3C4=CC=C(C=C4)F,131B5688B61F492D_EEB5C4F308B28C90_7019_UN,8.088526,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010000010100000000001011101100110000100100001011011010000010101111010,KUQQMGLAJSYXOH-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)OCC2)[S](C4=CC3=C([NH]C=C3)C=C4)(=O)=O,2EF5A0F74AEA609E_962D47EC4A9E5799_6029_DP,9.051026,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100001000001010001110011001001100011011001100101110001110001011111001110111110111110,BHWBIEWOHAGCMN-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NC4CCOC(C3=CN=C[N]3C)C4,4E92062705735547_74E5FC71735EBC60_7022_UN,7.2669315,00000000000000000000001000000000000000000010000000000000010000100100000000010101000101010010010111100000100111010000001011100100110011110100001011011011110011101111110,NIRWCLGGHVZNFJ-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NC4CCOC(C3=CN=C[N]3C)C4,0F7C787A8BC8AA9F_80250E7C3B1D1DDF_7022_UN,7.266932,00000000000000000000001000000000000000000000000000000000010000100100000000010101000101010010010111100001100111010000001011100100110011110100001011011011110011101111110,LBXFPAKCSYGKOQ-UHFFFAOYSA-N
NCCCC(OC1=CC=C(C=C1)C2CNCC2)C3=CC=C(C=C3)F,54510B7A942EC548_2FA858690E576CCA_6035_UN,8.65849,00000000000000000000000000000000000000000010000000000000000000100000000000000000001110110011000010001000100100010100001001000111010110100110001101010001110101100111110,HIBVXFMVTRWHOT-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NCC(C2CCCN2)(C)C,0479619391F82A57_CAC20CDCADFA9116_7022_DP,8.715443,00000000000000000000000000000000000000000110000000000100000000000010000000100000101100010011000010001001100110011001101001000000110101110110001010010111010110101111010,XBHJFMXOTGOKAP-UHFFFAOYSA-N
CCC5CCC1=C(C4=C(N1CC3CCCN(CC2=CC=C(C=C2)I)C3)C=CC(=C4)C)C5,A8FC83F4CC568BC2_4A7AFB28AA706186_6034_UN,8.168588,00000000000000000000000000010000000000000000000000000000000000000100000000010000100101110000000010101100010110010010101011100100110000100110001011011100010110101111010,CJJAGOYFHPTXLQ-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3CCC(CN3)(C)C)Cl,67E304CEC0555420_29A8E45AEAF7009F_6034_DP,8.776633,00000000000000000000000000000000000010000000000100000000000000000110000000110111011101011011000010101001101110011001101111100100110101110110011011011111010110101111010,BLSBQLZSAYMEHC-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CC(=N2)NCC3CCCC(CC)CC3,92F650497EE03F8A_094B43588CB5DC7C_6041_UN,8.347687,00000000000000000001000000000000000000100010000000000000000000000100000000000100001000010011000000101100010110000010101001000100110001110100001001010001010110101111010,OBAGSPDTMBTBEV-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=NC=C2)NC3CCN(C)C34CCCNC4,82E706F7C809D64C_46A2642CD2B1C89F_6041_DP,8.319958,00000000000000000000000000000000000000000010000000001100000000100110000000010001101101110011011010101000110110011001101011101100110101110110001011011011010010101111010,YDVZRRQFQYFSFQ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(CC)COC3)C4=CCNCC4,2708E5C86669C7D0_5BBA5DDEF9FEFBA4_6034_UN,8.828799,00000000100100000000000000000000000000000010000000100000010000100110000000011000001101110001000011111100110101011010101011100100110000100110001001011001010111101111110,UVXMUWHOAOWFQE-UHFFFAOYSA-N
CC1=C(N=C(N1CC2CCC(CI)OC2)C3CCCN3)C4=CC=CC=C4,1A0B7C7DF7DD2A54_B2BFD38EB067F3C1_6034_UN,8.528762,00000000000000000000000000010000000000100000000000000000010000100100000000010101001101000011000011101000100001010000101011100100110010100110001011011011110111101111110,NYVWWWAQBREPIL-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC(CCC)C3=C(C=C(C=C3)F)F,3FAEAD8DC6B86BEE_BB60CF8DC65CF0CB_6041_UN,8.303746,00000000000000000000000000000000000000100010000000000000000000100100000000010100100101110010010010101000100110010011101011100100010001110100001011011111010110101111010,RCLZJQXMRLAZOP-GGYWPGCISA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC3=C2CCCCC2=CN=C3,8DEA3051A2B562A8_A70C7FE881E56D98_6041_UN,8.05634,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100011010000100100010000001001001001000100110001010100011011011111010110101111010,UYOIKONZZKBNKW-UHFFFAOYSA-N
FC1=C(C=C(C=C1)CC=C)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,5917299EFFAFC580_391345757682F69C_6041_UN,8.8238325,00000000000000000000000000000000001000000010000000001000010000100100000000010000101101110001011110111000000111010001101011101100110011110110001011011111110111101111110,XRJXMJJYAPUFOF-OALUTQOASA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCCC3CCSC3,4D4284AC0AEEB062_F22D075E7C91A569_6041_UN,7.901697,00000000000000000000000000000000000010100010000000000000000000000100000000000100001100111001000010101100110110010000001011000100110001110110001011010111010110101111010,GZEGGZNCVOTRIN-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CCCC3)C4=C(C=CC=C4)F,6FAC11AA3C277FEB_D1D379438FAC5B5D_6041_UN,7.616356,00000000000000000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100110001110100001010011011010110101111010,YJLTZJPDZOXMIZ-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NCC4=CC=C(CN3CCCN(C)CC3)C=C4,1151C77FB766EA6F_C05FF6B5267E2B16_6041_UN,7.7979937,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010010001100010110010001101011100100110001110110001011011001010110101111010,HUHYMDSMPMNZRO-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,514D4BF2C867B928_43486B7008480D53_6041_UN,8.787271,00000000000000000000001000000000000000000010000000000000000000100100000000010000101101110011010010101000000110010001101011100100110001110110001011011011010110101111010,XZPDAYJDJKMUOD-JXFKEZNVSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCCC23CCOCC3)F)CC4,B9107279D1110C74_8060BC8A3F6DF2EA_6041_UN,7.2025166,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110011010010101000110111011001101011100000110011110110001011011011010111101111110,TTXCBZPAJCIVFH-UHFFFAOYSA-N
CC1=C(C(=NC=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,E828799A620AF759_4BD8756659E4A5AB_6041_DP,7.479237,00000000000000000000000000000000000000100110000000000100000000100100000000000100101000110011000000101000100100010000001011000100110101110110001011010011010110101111010,UUPRGPURSQNGGZ-DOTOQJQBSA-N
CC1=C(C=CC(=C1)N2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,07FD4248A76F4887_6E033221FAD26AA4_6041_UN,8.577563,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011010110101000100111010001101011100100110011110110001011011111010011101111110,YUOSHCAFGIVXNI-YADHBBJMSA-N
C2(=C1CCCCC1=CN=C2)NC3=CC=C(CC[Si](C)(C)C)C=C3,67D2F56543EA4FF3_B93BE3934E6B7C36_6041_UN,7.9667625,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100011010000100100010000001001101001000100110001010100011011011101010110101111010,IGOQZZDCBVNWED-UHFFFAOYSA-N
CCC(C#N)C1=CC(=CC=C1)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F,5A6438177E601C9C_379C039533031939_6041_DP,8.185565,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010010001001000100110101110110001011010011010110101111010,LIXGMAAEAGIBGO-HGYXGMMLSA-N
CC4=CC1=C(C=CC(=C1)NCC2N(C)CC3(CC2)CCC3)[NH]4,B2A36990A3698150_5D02F8EBB10A8BDC_6041_UN,7.954684,00000000000100000000000000000000000000000000000000000000000000000110000000010001001101100011010010101100010010011001101011100100110101010110001001011111010110101111010,UDYRIGSNOGZDHS-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(C)CSC2)F)CC3,9B217AD0154B8D07_6DBA5592964B0F4B_6041_UN,8.155645,00000000100100000001000000000000000010000010000000000000000000000010000000010001101001111010010000001000000110011001101011100000110001110110001010011111010110101111010,RNOXNAUSMWRUBL-UHFFFAOYSA-N
FC1=C(C(=CC=C1)CC#N)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F,B9D13EB64EBF5D9E_61353CFCE5FF9F56_6041_DP,8.050161,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,WGBGORQMBDEDCG-RDTXWAMCSA-N
N3CC4(C=CC1=C[N](C)N=C1C2=CC(=CC=C2)F)CC3C4,18822CAD536B7B2B_8DF5DF588FE5F9C7_7019_DP,7.431657,00000000000100000000000000000000000000000010000000001000000000100110000000010000101100010011011010011000110100011000000011101100110000100100001010001011010010101111010,OVHNKOWRDQSGQT-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC[C@@]23CCCN[C@H]2CCCC3)F)CC4,1F1B17E089E9173E_F62A82EE68F65A05_6041_DP,7.6499434,00000000000000000001000000000000000000000010000000000100000000000010000000010001101001110011010000101100110110011001101011100000110101110110001011011011010110101111010,VVSAZVGAMFVVLO-XZOQPEGZSA-N
FC1=C(C=CC2=C1CCC2)N[C@H]4[C@H](C3=C(C)[N](N=C3)C)OCC4,E01DCBDB5988B4BE_0101BCEEA56C63D4_6041_UN,8.270636,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111000100110101010000001011101100010011110100001010011111110011101111110,WXKCULXADSVIRQ-AEFFLSMTSA-N
C1(=CC(=CC=C1)C2OCCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,D78D1C4BEE1B745F_D66F058629AAD1B7_6041_UN,8.0492325,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110111010010101000100111010001101011110100100011110110001001011011010011111111110,MRIKLSLVJMPNGE-UXHICEINSA-N
C1(=CC2=C(N=C1)[NH]C=C2C3CCC3)NCCC4=CC=C([Si](C)(C)C)C=C4,E8D918B66C05CE0B_BF72E9CB4DDC0B6F_6041_UN,7.7486176,00000000000100000000100000000010000000100000000000000000000000100100000000100101001100100001010010101100110000011000001011000100000101010100011001011101010110101111010,JVYXAQBWQSLQMO-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NC(CC)C3CCCCCC3,9DB6677967693D6A_3A8EA0BEE7CD173F_6041_UN,8.197913,00000000000000000001000000000000000000100011000000000000000000000100000000000100000100010011000010000100110110010010001001000100110101110100001000010001000110101111010,CJUTWWJQFXJAMS-UHFFFAOYSA-N
FC1=CC2=C(C=C1)OC=C2NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,040AEE303EB851B5_2564DC000E6A1727_6041_UN,8.93608,00000000000000000000001000000000000000000010000000000000010000100100000000010101101101010011010111101100010100010000001011100100110001110110001011011011110110101111110,ZPTTVCNNMYAGDU-SZNDQCEHSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4=C(C=CC(=C4F)C)F,5DE0E8903231FD1F_8975827C7F86F526_6041_DP,8.698034,00000000000000000001000001000000000000100010000000000000000000000100000000000100100101010011010010100000111100010000101011100100110101110100001011011111000010101111010,RYYYSEFTYABBAC-BTTYYORXSA-N
FC1=C(C=C(C=C1)NCC2CCCN(C)C2C3=CC=CS3)C4OCCO4,F25168EB9DD2FEBE_EBB6D68DA1B85EB1_6041_UN,8.0627365,00000000000000000000000000000000000010000010000000000000010000100000000010010000111101111011010010101000000111010001101011110100110011110110001011011011010111111111110,YWNBWAOTGARXKT-UHFFFAOYSA-N
COC1=CC=C(C=C1)C[N]2N=C(C(C)C)C3=C2N=CC=C3NCC45CC(CC)(C4)CO5,F2F47B24FFD4502A_8CA5141A21D8E184_6041_UN,8.474481,00000000000100000000000000000000000000100000000000001000010000000110000000110101101100000011011110101100010001011110100011101111110011010110011101001101110111111111110,WOITZEAMQYVJFA-UHFFFAOYSA-N
N(CC2=NC1=C(C=CC=C1F)O2)C(CC4=CC3CCC(N3)C4)=O,B99085E404A6992E_164E583BB9DA4B5D_6038_DP,8.514055,00000000000000000001000000000000000000000010000000100000010000000100000000001001001100010011100110111100110100110000011011000100110110100100001001010001111110110111110,QSPGJKFRYVXRMM-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C,AF4D70BCD228A972_A54D5D83B14FBCCB_6041_DP,8.410355,00000000000000000000000000000000000000000010000000000100000000100100000000000000101100110011000010101100110100010000001011000100110101110110001011010111010110101111010,XCOWPUMHOSCUBH-LAUBAEHRSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NC3=C(C=C(C=C3)C4CCOCC4)F,20DA799BBAFBAA0F_325FDCAD016C90FA_6041_UN,7.475027,00000000000000000000000000000000000000100010000000000000010000100100000000010100100101110001010010101000000111010001101011100100110011110110001011011011010011101111110,UCSYXFLBJVCFJS-FQEVSTJZSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC34COC(C)(CC3)C4,CDD702DB2CA0C592_54CAEEFF273077A1_6041_UN,7.615386,00000000000000000000000000000000000000000010000000000000010000000110000000000000101100010011000011101100010111001001101011000100110011110110001011010111110111101111110,BJPUXTSMJQVQQF-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)F,85A6F3E9975806F2_E04489D88B786204_6041_UN,8.419312,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011111010110101111010,GJXVHCLLBJWNIS-VLIAUNLRSA-N
C1(=CC=C(C=C1)C2CCCCC2)NC3=C[N](C[Si](C)(C)C)N=C3,33C247216A7430B0_34CD68E12ADA5988_6041_UN,7.677064,00000000000000000000100000001010000000000000000000001000000000100100000000110001100100100001011010001000000000011001001011101100110001010100011001011101010110101111010,XMTNVTANESNJDD-UHFFFAOYSA-N
NCCCC(OC1=CC(=CC=C1)C2NCCCC2)C3=CC=C(C=C3)F,E4696FF363932410_5E2EC880B2C1E4EF_6035_UN,8.598102,00000000000000000000000000000000000000000010000000000000000000100000000000000000001010010011000000101000100100010100001001000111110110100110001101010001110111100111110,HQANUEFNHDUTDN-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC3N(C)CC4(CC3)CC4,D4A3B76E64690409_22ECCA1CE5A38685_7022_UN,8.228651,00000000000000000000001000000000000000000010000000001000000000000110000000010001101101110011011010101000010110011001101011101100110001110110001011011011010110101111010,LLDMYIRNBAYXTR-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CNCC3(O2)CCC3)F,42FF4EACCD6064B6_18C39AF5CA75ABC0_7022_DP,7.2565174,00000000000100000000000000000000000000000010000000000100010000000010000000100000101001110011010100101000010100001001001011100000110111110110001011011111110111101111110,FHAKVRQWMOMCRN-UHFFFAOYSA-N
C(CC1CCCOC1)=CC2=C[N](C)N=C2C3=C(C=CC(=C3)F)F,D06C5ABAABAA0485_D88466B069166CA1_7019_UN,8.0804615,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100110000011010110000000101000000001011101100110010100110001011011010010111101111110,CHCVVEVYFJAEFV-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCCN(C)CC2OCCC2)F)F,1FB87F391C0A102A_FCDEC5AAEF976C93_7022_UN,7.851277,00000000000000000000000000000000000000000010000000000000010000000000000000000001001101110001010110001000100111010001101000100000110011110110001010011111110111101111110,JVZHUBYCDXNIEM-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NC(CC)C3CCCCC3,4955D7C98B52E7A2_66A988801005392E_6041_UN,8.379249,00000000000000000000000000000000000000100011000000000000000000000100000000000100000100010011000010000100110110010010001001000100110101110100001001010001000110101111010,FDNOLWKXYZUKPP-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC[C@@H]2CCCO[C@H]2C3=CC=N[N]3C)C4CC4,D44DFE80ADA4C2A3_04A806027DBA6D94_6041_UN,8.419372,00000000000000000000001000000000000000000010000000001000010000100100000000010000101100010011011111101000000101000000001011101100110011110110001011011011110111101111110,WPEXZOMRNBISGU-IFXJQAMLSA-N
CC1=C(C=C(C(=C1)N[C@H]2C[C@H](CC2)C3=CC=CC=C3)Cl)C4CC4,8F2006027BCBB946_CF5063F080C1B4A6_7022_UN,8.711038,00000000000000000000001000000000000000000000000000000000000000100000000000000000000000010011000010000001100110010000001000000100010001110000000011010011000010101111010,FTDSHHXRCUQLBM-ZWKOTPCHSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3CNCCC34CCN(C)CC4)Cl,010DA881C6537BEC_F40AB5DB2F52DC77_6034_UN,7.813859,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101111011010010101001111110011001101111100100110101110110001011011111010110101111010,WHMPAIVSUNDNFF-UHFFFAOYSA-N
FC2=C(C=C1OC=CC1=C2)NCC4CC3(CCN3C)C4,CA2B61F27F6049B8_19356A6A855449FF_6041_UN,8.15638,00000000100100000000000000000000000000000010000000000000010000000010000000010000001101110010010011001100010100011001101011100100110001110110001010011011110110101111110,KXJDINGIONEBLT-UHFFFAOYSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC3=C2CCCCC2=NC4=C(C)C=CC=C34,36B8AC378CCE859E_A011B977DBCCE32C_6041_UN,8.311272,00000000000000000000100000000010000000000000000000000000000000000100000000100000100000100011010000100100010000011001001001000100110001010100011011011111010110101111010,LBWBKBJWKKZVQM-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3(CC)CCNCC3)Cl,95217A019637EC76_F41193B2B4AE7804_6034_UN,8.3440895,00000000000000000000000000000000000010000000000100000000000000000110000000010110011101111011000010101001101110011010101111100100110101110110001011011111010110101111010,PEXHMOMCQPOMDA-UHFFFAOYSA-N
C2(=C1OC=CC1=CC=C2F)NCCC3CC(C)CC(C3)(C)C,4DA1B7F4F7078093_F12BE3D1B89E4FB2_7022_UN,7.97606,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010001000110001100110110011001001000000100110001110100010011010111110110101111110,PAFGGPXEFLCAMC-UHFFFAOYSA-N
CSCC3(C=CC1CCC2(CN1)CCCC2)CCOCC3,F01B51C3D0FDF25E_C2267E96265F6813_7019_DP,8.17507,00000000000000000000000000000000000000000000000000000000010000000010000000000000001000101011010010111000110011011001001011000000110010000110000001010001010111101101110,WZSSWJLKEDMPDT-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2OCC3(C2)CCC3)F,ADBC861EE025A559_C4ACD8B1BDA1B43D_7022_UN,7.5346975,00000000000100000000000000000000000000000010000000000000010000000010000000100000001101110011010110001000010101001001001000100000110011110110001010011111110111101111110,FURLCVQGFQRMFU-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,5083E3FCE5DBF67B_35B9E8D433E296B0_6041_DP,7.9189777,00000000000000000000000000000000000000100010000000000100000000100100000000010100101101110011010010101000100110010001101011100100110101110110001001011011010110101111010,WVILOHHHFKWHBM-TYPHKJRUSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCCC23CNC3)F)CC4,561E4DEF1AB5BE30_B3FDB97A63033626_6041_DP,7.4958663,00000000100100000001000000000000000000000010000000000100000000000010000000010001101001110011010010001000110110011001101011100000110101110110001010011011010110101111010,UAZKZTQDFYHBDT-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5)C,6DEA76731C19456E_DD2BE92BD540E01D_6041_UN,8.29933,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010110010000001011101100110001110110011011011111010110101111010,KQSOJDJXUNNLSR-OSPHWJPCSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC3=CC2=C(CCCNC2)C=C3,65D8AF5B592ED3C0_E268B21F137573EC_7022_DP,7.830001,00000000000000000001100000000010000000000000000000000000000000000000000000100000001000100011010000001100110000011000001001000100110101010110011011011101010010101111010,GLFGVSINRIQIQE-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NC3CC2(CCNCC2)OCC3,A599309E65E4FAF1_1B057ADFACDE5CA0_6041_DP,7.9485936,00000000000000000000000000000000000000000110000000000000010000000010000000000000001000110011000001101000110101011000001011000000110111110110001011010011110011101111110,IFUKSZUGXXJORQ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2C[C@H]3N(C)CCOC3)C4CCNCC4)F,65401AAF65FC1C56_E515F2714614985B_6034_UN,8.649613,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101110001010111101000100101010001101011100100110010100110001011011011010111101111110,ULOHQDDQYMTOIZ-MRXNPFEDSA-N
C1(=C(C=CC(=C1F)F)Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,7B8A4CCBD4C31AF4_A1BAEF87C6E1C2FF_7022_UN,9.056696,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,HREPMVROQDPJIQ-BBRMVZONSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CC(C2=NC=C[N]2C)OCC3)F)CC4,F2341DE242027717_BE3CF674CF80786A_6041_UN,8.019819,00000000000000000001000000000000000000100010000000000000010000100100000000010101100101110010010111101000100111010001101011100100110011110110001011011111110111101111110,PAPVEUUGARAHTE-UHFFFAOYSA-N
CC6=NC1=C(C=C(C=C1F)NC2=CC=C(C=C2)C35CC4CC(CC(C3)C4)C5)O6,7D2A5165864D78C8_55F0FC4B06FF4893_6041_UN,8.102866,00000000000000000000000000000000000000000010000000000000010000100110000000000000000100010000100111000100010100101000010011000100100001110100001001000001100010101111110,IMRYPBVDQZHTHN-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC(C3CCNCC3)F,264FE8C37BF40D63_35598EE1CD689A3B_6041_DP,8.587854,00000000000000000000000000000000000000100010000000000000000000000100000000000100001000110001000000101100110110010000001011000100110101110110001011010111010110101111010,JMGGEAKKKRKHMO-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC[C@@H]2CCCN(C)[C@H]2C3=C[N](N=C3)C)C4OCCO4,8ED09BB28833888A_056CDCAC1CCBD2C1_6041_UN,8.57883,00000000000000000000000000000000000000000010000000001000010000100100000010010000101101110011011010101000000111010001101011111100110011110110001011011111010111111111110,TWHPOVOUOMCGAS-IFXJQAMLSA-N
C(CN1CC2CCC(C1)O2)=CC3=C[N](N=C3C)C4=CC(=CC=C4)F,F7EEB4E8C6AE5AA1_776FB28D8A3B713C_7019_UN,8.349148,00000000000000000001000000000000000000000010000000001000010000100100000000010000100101110000001110111000010100000000001011101100110011110110001011011010110111101111110,PHHUVSBDDDGAGY-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC23CC(C)(C2)OC3)F)CC4,92ED92BA88FA0C13_E1AC700F34E9B29D_6041_UN,7.3083286,00000000000100000001000000000000000000000010000000000000010000000010000000010001101101110010010011001000010111011001101011100000110011110110001010011111110111101111110,ODDQSNLXLZLDTM-UHFFFAOYSA-N
C1(=C(C=CC=C1Cl)Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,EF05DBD5B9171487_63DB630A44561648_7022_UN,8.792616,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,DQOQHUJORUOXFO-HOCLYGCPSA-N
C1(=C(C=CC=C1F)Br)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,A2AA5757A3187704_4088A57A1D431936_7022_UN,8.792612,00000000000000000000000000000000000000000010001000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,VFRCYHICFCHRSU-HOCLYGCPSA-N
C1(=C(C=CC=C1F)Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,276BFAD7EF91E20A_D1FF1AC96F7C51D5_7022_UN,8.792598,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,ONEORHMSPMPXCV-HOCLYGCPSA-N
FC1=C(C(=C(C=C1)F)CC#N)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,EFCD28CB98F13610_DE9DE5046DDD32B9_6041_DP,7.743945,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110100111010,MZMXUYASXSXRKM-GOEBONIOSA-N
N(CC1CC2CCC(C1)O2)C(=O)C3=C[NH]C4=C3C=C(C=C4)F,A0BB17AF92D90F30_4F7887E06AD4AA28_6038_UN,7.8781886,00000000000000000001000000000000000000000010000000000100010000000100000000000000101100010010100011101100010100100000011011000100110110100100001001010001111111110111110,MEBCDOACYUMWQK-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC3=C[N](CC2CCCN2)N=C3,936DBE81C03DC704_7A5A9E3BEEB0ACEC_7022_DP,8.08702,00000000000000000000100000000010000000000000000000001000000000000100000000110001101100100011011010001000100000011000001011101100110101010110011000011101010110101111010,PSVWPGNCIFMDHA-UHFFFAOYSA-N
C[N]1C=CN=C1C2=CC=C(C=C2)NC3C4CC5CC3CC(C4)(F)C5,13E29181E20E3C7B_13433526439B1FE4_6041_UN,7.8099604,00000000000000000000000000000000000000100010000000000000000000100110000000010101000101010010010010000100010100001000000011100100100001110100001011001011000010101111010,RZQNLISTQHUTKV-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)NC[C@H]4O[C@H]3CCC[C@@H]3NC4,95F212C1E40EE950_4199CA70F865BB7F_7022_DP,7.723612,00000000000000000000001000000000000000000110000000000100010000100010000000000000101000010011000110101100110100011000001011000000110111110110001011010011110111100111110,BYIDSODEGMOHPY-QRTARXTBSA-N
FC1=C(C=CC(=C1)C2CC2)N[C@H]4[C@H](C3=CC=N[N]3C)OCC4,8CEB7BC2F40D425C_59A75BBF1A356EDA_6041_UN,8.794176,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011011111000000100101010000001011101100000011110100001010011011110011101111110,NACIIHWFAQTWFQ-NVXWUHKLSA-N
N4C[C@@H]1COC[C@]1(C=CC2=C(C)[N](C(=C2)C)C3=C(C=C(C=C3)F)F)C4,3DB3EE606F8B8639_A501D4C2CD5CBA1D_7019_DP,8.811504,00000000000000000000000000000000000000000010000000000000010000100110000000010000001101110011000011011100010101001000000011100100110001110110001010001111010011101111110,DUKUDNMAKMZVMH-UZLBHIALSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC3=NC=C2CCCCCC2=C3,90BAF8384892B31A_C3B04004B965C6B7_7022_UN,8.099157,00000000000000000001100000000010000000100000000000000000000000000100000000100100000000100001010000100100010000001000001001000100110001010100011011011101000010101111010,XPNNAYARGNDECK-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2CCC3(CC2)CCOCC3)F,04D4E7435489158F_2DA18AC78D271D47_7022_UN,7.7391467,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110011010000101000110101011001001000100000110011110110001011011111010111101111110,HJZUAMWGMHFPPI-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC4(CC3=CC(=CC=C3)F)CCOCC4,403220F2BC6FE9E2_31FAD1D0CB59741E_6041_UN,8.066443,00000000000000000000001000000000000000000010000000001000010000100110000000010001100100110011011011100000100101011000001011101100110011110110001011011011010111101111110,UQBIICUPCXPGPX-UHFFFAOYSA-N
C(C12CCC(CC1)CC2)=CC3=C[N](C)N=C3C4=C(C=C(C=C4)F)F,BE8A7BD484531012_215A81EADBE5C32A_7019_UN,8.422816,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001011011010000010101111010,APXKTTRWEKWBKD-UHFFFAOYSA-N
CC4(C)COC3(C[C@@H]2CC(OCC1=C(F)C=NC=C1)C[C@@H]2C3)OC4,EC8A4C6A9CE907A0_BD5E840E0E166FF2_6039_UN,8.885759,00000000000000000000000000000000000000000010000000000000010000000110000000100000000000010100000010100100010101001001000011010011110010100110000111100110110101011111110,GFDGSIAQDCMCLV-XYPWUTKMSA-N
O[C@H](CCl)C1=CC=C(C=C1)NCC2CC3CCC2N(C)C3,959EE2AD33AF286B_D7224842BB78B52A_6041_UN,8.477829,00000000000000000000000000000000000000000000000000000000000000000000000000010000101001100011010000101001110010010001101001100000110111110111001001011001110111101111110,HUJQVJGCCSWMSY-DCOKWODLSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2C(COCC2)N3CCOCC3)F)CC4,8B2EB38549B61A16_B5C2691054E0DA12_6041_UN,7.470998,00000000000000000001000000000000000000000010000000000000010000100000000000010001100001110011010101101000100111010001101011100000110011110110001011011011010111111111110,UVGPUCIUMUEACM-UHFFFAOYSA-N
CC1=NC(=C(C(=C1)C)C#N)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,F70A470249EDAEFA_583DB510F90CEA4E_6041_DP,7.2132006,00000000000000000000000000000000000000100110000000000100000000100100000000000100101000110011000000101000100100010000001011000100110101110110001011010111010110101111010,QZDHGIHITJYJLN-FUHWJXTLSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC34CCNC3CCCC4,B6FFB343A94DA9DC_78B5023ED92B8E67_6041_DP,8.352408,00000000000000000000000000000000000000000010000000001100000000000110000000010000101100010011011010001100110100011000001011101100110101110110001001011001010110101111010,UYTHMBFBAIJWOL-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)C=C[C@@H]2CCCO[C@H]2C3=NC=C[N]3C)OCOC4,8114420BC6FF0736_CBE8E2FD58A4E914_7019_UN,8.365473,00000000000000000000000000001000000000100010000000000000010000100100000000010101000101110100010110110100010101000100001011110100100010100110001011111010110011111111110,KFOOGGLNDHNUFG-SCLBCKFNSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CNCC(O3)(C)C,64DAE589637F5153_2DA1A009BDFB5804_6041_DP,8.376736,00000000000000000000000000000000000000100010000000000100010000000110000000100100101000110010000100101100010110001001000011000100100111110110011011000111110111101111110,YGDANRCHBJKOGB-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NC3CCN(C)C34CCCNC4,8ABE46BB3F3A9618_BA5370A2AF9A0915_6041_DP,8.512629,00000000000000000000000000000000000000100011000000000100000000000110000000010101101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,ZYHVDZOCSKEQBZ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3=CC=C(C2OCCNC2)C=C3)F)CC4,3BDDBFBF34C976C9_B8E1AAB1B527DEAD_6041_DP,7.95192,00000000000000000001000000000000000000000010000000000000010000100000000000010001101001110001010100101000100111010001101011100100110111110110001011011011110111101111110,VOXLCFSONGBVSB-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(C)CCCS2)F)CC3,D0FA58DC5C21198B_FCB69C71EB39EC4A_6041_UN,8.058634,00000000000000000001000000000000000010000010000000000000000000000010000000010001111101111011010010001000000110011001101011100000110001110110001010011111010110101111010,JHNJCCPAWSQHIR-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)C2OCCO2)N[C@H]3[C@H](CCNC3)C4=CC(=CC=C4)F)C#N,CBBE27E90EC96A1A_D3928D438F4B01B4_6041_DP,7.650752,00000000000000000000000000000000000000000110000000000010010000100000000010000001101100110011000011101000100101010000001011010100110111110110001011010011010011110111110,MQXLNRAUKMCNQA-DNVCBOLYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CC3)CC4=C(C=C(C=C4)F)F,5838BD4E9610FD7E_C712E9BE447FD1EB_6041_UN,8.438445,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100010001110100001010011011000110101111010,REAWTQAZMUHJOP-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC3C[C@H]2CCC[C@H](N2C)C3)C4OCCO4,0291B8EFA9C9AE62_144126D0954200A1_6041_UN,7.306971,00000000000000000000000000000000000000000010000000000000010000100000000010010000100101010001010010100100110111010000101011110000110011110110001011011011010011111111110,UDVQPHSKVQRFIO-GOOCMWNKSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CC(C2=CC=N[N]2C)OCC3)F)CC4,129B45B458F82752_67D4CB31A793E9B6_6041_UN,7.9080515,00000000000000000001000000000000000000000010000000001000010000100100000000010001100101110010011111101000100111010001101011101100110011110110001011011111110111101111110,JQLSCRNFJIZPAX-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC3C(C)(C)C4CCC3C4)F,7C7D2A3DDD1075AF_6D39F65BFC1EFDEF_6041_DP,7.4290786,00000000000000000000000000000000000000000010000000000000000000000010000000100000001000010011000010101100110110011000101001000000110101110110001011010111010110101111010,ZOVPQPDYJGXBFX-UHFFFAOYSA-N
CC1=CC(=C(C=C1)F)NCC2(CCCCC2)OC3CCCC3,525DC88FE250A333_04C9AC19B2DF1DB7_6041_UN,8.360041,00000000000000000000000000000000000000000010000000000000000000000010000000000000001000010011000110001000000100001000001000000011110011110000000111010011110111101111110,AJJWPIZGJUPOLU-UHFFFAOYSA-N
CC1=C(C(=CC=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)Br,51F0C7A9525F3FE7_01E2C1CF34412273_7022_UN,8.271373,00000000000000000000001000000000000000000000001000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011111010110101111010,RLQDSKKJKZCYRD-QRWLVFNGSA-N
CC1=C(C(=CC=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)F,DB5D847782827DEA_09BABF38BE519913_6041_UN,8.271355,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011111010110101111010,SVLASKWKDDZEOC-QRWLVFNGSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@@H]3CNC[C@H]3C4=CN=C[N]4C,2FF8C014A323BC1A_68096CA688844FC8_6041_DP,8.524651,00000000000000000000000000000000000000100010000000000100000000100100000000010101101101110011010010101100010110000000000011100100110101110110011011001111010110101111010,JPXRALKYOSNGES-GOEBONIOSA-N
FC1=CC(=C(C=C1)C2CC2)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,2527A6903826D829_C933B3DFFC2458D0_6041_UN,8.64775,00000000000000000000001000000000000000000010000000000000000000100100000000010000101101110011010010101000000110010001101011100100110001110110001011011011010110101111010,UOIXQLQYOWLKPM-JXFKEZNVSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC5=C(N4CCN(C)CC4)C=CC(=C5)F,357903F69C01F3F2_D36DD3BDF86586F5_6041_DP,8.159271,00000000000000000000000000000000000000100010000000000000000000100100000000010101100101110011010010101000110100010001101011100100110101110110001011011011010010101111010,FFQSAXICXRJZNG-NBQZKYEYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC3CCCC2=C(C=CC=C2)C3,271B4296D8C5E4B0_8EEBF08FAAE0BA13_6041_UN,7.973813,00000000000000000001100000000010000000000000000000000000000000000100000000100001000000100011010000100100110000011000001001000100110001010100011011011111000010101111010,BHWJPAFPZZHYHP-UHFFFAOYSA-N
CN5CCCN(CC1=C(C=C(C=C1)N[C@@H]3C[C@@H](N2CCOCC2)C34CCC4)F)CC5,F033F37442B8640E_8A931BE232B0B3DA_6041_UN,7.829692,00000000000100000001000000000000000000000010000000000000010000100010000000010001100001110011010100101000110111011001101011100000110011110110001011011011010111101111110,BNYYVDRFEBMGAL-DHIUTWEWSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CNCCC34CCN(C)CC4)Cl,1052A9B8696D739C_112B1475BDFD4EDC_6034_UN,7.7102933,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101111011010010101001111100011001101111100100110101110110001011011111010110101111010,WBDSNPSXGNXNPF-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)COC2)[S](C4=C3[NH]C=CC3=C(C)C=C4)(=O)=O,6DCBF0AD525A724D_F2B76E9222B295A8_6029_UN,9.059687,00000000000000000000000000000000110000000000000000010101011111001101010001000000111100101000001011001110011001001000010011001100111100001110001011101001010111111111110,SJLKQZHFGLDFAL-UHFFFAOYSA-N
CCC4CCC1=C(C3=C([N]1CC2(CNC2)C)C=CC(=C3)C)C4,6F5FD7691BC8073D_E423DA2B4E17EDDB_6034_DP,8.53605,00000000100100000000000000000000000000000000000000000000000000000110000000010000101101100010000010001100010010011011101011100100110000000110011011011101010110101111010,HRUMVCRZKSJAFL-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)C=C[C@@H]2CCCO[C@H]2C3=CC=N[N]3C)OCOC4,621B1DF9F4722F25_CDF545098B9C9A96_7019_UN,8.502069,00000000000000000000000000001000000000000010000000001000010000100100000000010000100100110100011111110100010101000100001011111100100010100110001011111010110011111111110,XODKUTQHXMFVOM-ORAYPTAESA-N
C1(=C(C=C(C(=C1)F)C#N)F)N[C@@H]2CNC[C@@H]2CC3=CC=CC=C3,1CA73DE7814651D0_F4B2CFBF618D37B9_7022_DP,8.075893,00000000000000000000000000000000000000000110000000000110000000000000000000000001101100110011000010001000100100010000000001000100110101110110001011000011010110100111010,ZQULGBOWFHPLAA-KBXCAEBGSA-N
C1(=C(C=C(C(=C1)F)C#N)F)NCC2CNCC(C2)(C)C,3AB0AE164596D5EF_998C09338FEC4B97_7022_DP,8.305285,00000000000000000000000000000000000000000110000000000100000000000010000000100000101000110010000000101000000110001001000001000000100101110110001011000111010110101111010,SNKZIYJURUWNAM-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CNCC(O2)(C)C)F)CC3,4248E05641605633_E7E42327024FE8AE_6041_DP,7.9373884,00000000000000000001000000000000000000000010000000000100010000000010000000110001101001110010010100101000000110011001101011100000110111110110011011011111110111101111110,XFUJZZWETQXZJN-UHFFFAOYSA-N
CCC4CCC1=C(C3=C([N]1CCC2CNC(C2)(C)C)C=CC(=C3)C)C4,2A748A2C803580E0_84EA81FD6EAD394A_6034_DP,8.4430275,00000000000000000000000000000000000000000000000000000000000000000110000000110000001101000011000010001100110010011011101011100100110000000110011011011101010110101111010,XHUNKTANLKFGTQ-UHFFFAOYSA-N
FC2=C1N=CC=C(C1=C(C=C2)F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,260E0C98925BE2C6_7C13CF7FE92BE2EC_6041_UN,8.931634,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,SCMCPYLNFBWBGF-PEBXRYMYSA-N
CC1=CC(=NC(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,1494FD47E657E3F1_5A96BCDCA4407E53_6041_DP,7.360005,00000000000000000000000000000000000000100110000000000100000000100100000000000101101000110011000000101000100100010000001011000100110101110110001001010011010110101111010,MQDDBRSUPYFPNL-MAUKXSAKSA-N
C1(=C(C=C(C=C1)C2CC2)F)NC[C@@H]3CCO[C@H]3C4=CC=N[N]4C,3F582D8DC3D19DC6_C988619C97E877C6_7022_UN,7.714573,00000000000000000000001000000000000000000010000000001000010000100100000000010000101100010011011111001000000101000000001011101100110011110110001010011011110111101111110,KZGTUVFEOCAIJH-KBXCAEBGSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NC[C@@H]3CCO[C@H]3C4=CC=N[N]4C,975D183ACF3F06D0_3D489391DFABD679_7022_UN,7.714568,00000000000000000000001000000000000000000000000000001000010000100100000000010000101100010011011111001001000101000000001011101100110011110110001010011011110111101111110,FEONSAPFKDISND-KBXCAEBGSA-N
C2(=C(C=C1C=CC=CC1=C2)Br)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,4BEA25EEAB41A8ED_90AEB8557D6C6133_7022_UN,8.032492,00000000000000000000000000000000000000000000001000001000010000100100000000010000101101110001011110101100010111010001101011101100110011110110001011011111110111101111110,FOQDZGNCZDVIMN-PMACEKPBSA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,D6088DC7F66F2048_C04EF06396E70545_7022_UN,8.032488,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101110001011110101101010111010001101011101100110011110110001011011111110111101111110,WWBUFNBXHUKBIJ-PMACEKPBSA-N
C(C1(CC1)C2CCCCO2)=CC5=CC3=C([N](N=C3C)C4=CC=CC=C4)N=C5Cl,C36AAFE5539150A3_CCB490F663AC5C0D_7019_UN,8.353405,00000000000000000000001000000000000000100000000000001000010000100110000000010101100100010000001010110101010101001000001011101100110011110100001011011010110011101111110,VZHLKWDSLJVGME-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,E4F458F67086FCEC_057898350EA503E2_6034_UN,8.537352,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000101011100100110001100110011011011110010110101111010,QNUKNNSXDXMIPM-HXOBKFHXSA-N
FC1=C(C(=C(C=C1)C2OCCO2)N[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C#N,49CDC31E0EE2F979_2A23D95EBA748E76_6041_DP,7.6302743,00000000000000000000000000000000000000000110000000000010010000100000000010000001101100110011000011101000100101010000001011010100110111110110001011010011010011110111110,AXULOLVCTSOFFJ-DNVCBOLYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCC3(CC2)OCCOC3)F)CC4,07A3BEA78B695AC6_746FA01303C8B4F7_6041_UN,7.1731834,00000000000000000001000000000000000000000010000000000000010000000010000010010001100001110010010000101000110111011001101011100000110011110110001011011011110111111111110,YZFGHDHXCQDVDG-UHFFFAOYSA-N
CC1=CC(=CC(=C1)F)NC[C@H]2[C@H](CCCC2)N3CCOCC3,0A8E1B05CFC892F1_3E5892C78A5A37D6_6041_UN,8.170783,00000000000000000000000000000000000000000010000000000000010000100000000000010000101001110011000100101000000101010000001011100000110011110110001001011011010111101111110,PKEOKLJULHAGCR-YJBOKZPZSA-N
CC1=C(C=C(C(=C1)C2OCCO2)C)NC4CCCN(CC3=C(C=CC=C3F)F)C4,847F36C100172443_953E3BAF2A03A6A7_6041_UN,8.075281,00000000000000000000000000000000000000000010000000000000010000100000000010010001000101110011000010101000100101010000001011110100110011110110001011011111010111111111110,MQZPMMHAYIYEOL-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC3CCC2(CCNCC2)CO3,1A97E851368985AD_28A96E45BBD81B59_6041_DP,7.8351145,00000000000000000000000000000000000000000110000000000000010000000010000000000000001000110011000100101000110111011000001011000000110111110110001011010011110111101111110,HNPBRJRMTYRVDJ-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2CCC2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,5028158D670C0A7D_9F90598D65FD22E9_7022_UN,8.490591,00000000000100000000000000000000000000000000000000000000000000100000000000010000101001110011010000101001000110010001101001100100110001110110001001011011010110101111010,BXNREKKCNQNUTQ-UHFFFAOYSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC3=C(N2CCN(C)CC2)C=CC=C3Cl)C4,9D17E27F00129028_4842951012032AF6_7019_DP,8.413843,00000000000000000000000000000000000000000000000000000000000000100000000000010001000101110010010010111001110100010001101011100000110001110110001011011011010010101111010,HLMJMWABXZFJFT-RKVPGOIHSA-N
N(CCC1CC2CCC1O2)C(=O)C3=C[NH]C4=C3C=C(C(=C4)Br)Br,2649D295F35BB578_54F20ADAAF0A0EB8_6038_UN,7.841851,00000000000000000000000000000000000000000000001000000100010000000100000000000000101100010001100011001100110100110000011011000100110110100100001011010011111111110111110,FCYCMHCGQUPLBR-UHFFFAOYSA-N
FC2=C1C=CC=C(C1=CC=C2)NCCC4CCN(C3CCN(C)CC3)CC4,1C7E6A726294AD0D_0360B844D716811D_6041_UN,8.12724,00000000000000000000000000000000000000000010000000000000000000100000000000010000101001110001010000101100110100010001101011100100110001110110001001011001010110101111010,IOUVFMFXWHCJNJ-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC3=C(C=C(C=C3)C4CCOCC4)F,B15E3345E2DDA7AF_A3FE9EF06B17004E_6041_DP,7.949083,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101110011010010101000100111010000001011100100110111110110001011011011010011101111110,JNESAZHUSZTBRY-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2OCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,6F35B89960EA9621_873A0261233CC581_6041_UN,8.824057,00000000000000000000000000000000000000000010000000000000010000100000000010010001100101110011010010001000100111010001101011110100000011110110001011011011010011111111110,ARPPWVNNJIWTFA-MOPGFXCFSA-N
FC1=C(C=CC(=C1)C2CC2)NCC3=C(C=N[N]3C)C4CCC4,AE6687A8F2763E0C_BC129CD0B74902D5_6041_UN,8.202808,00000000000100000000001000000000000000000010000000001000000000100100000000010001101100010000011010001000000100010000101011101100100001110100001010011011010110101111010,LYGORXXXYRAACN-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2C3(CCNC2)CCOC3)F)CC4,ABA89AD59D8E72C1_F59226C01392853F_6041_DP,7.333987,00000000000000000001000000000000000000000010000000000100010000000010000000010001101101110011010010101000110111011001101011100000110111110110001011011011010111101111110,RRJOBDJOQSGSMY-UHFFFAOYSA-N
FC1=CC(=C(C(=C1)F)NCCN(C)CC2COCCC2)F,33997133218A3053_C7C6BE6EE0412202_6041_UN,7.9420414,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001011011011010111101111110,MWILNHVEADKMSA-UHFFFAOYSA-N
C(C2CCCC1(CC1)C2)=CC3=C[N](C)N=C3C4=C(C=CC=C4)Cl,9B7EA96E5292AC72_CF2D1218387605B5_7019_UN,7.7855434,00000000000000000000001000000000000000000000000000001000000000100110000000010000100100010000011010010001010100001000001011101100110000100100001011011010000010101111010,GQISOXAICMIKOW-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)CCOC2)[S](C4=C3[NH]C=CC3=C(C)C=C4)(=O)=O,350E8D048880BC1A_AEF2B9CB5E18554D_6029_UN,9.082651,00000000000000000000000000000000110000000000000000010101011111001101010001000000110100101001001011100110011001001000011011001100111111011110001011111001010011111111110,WQKNWVBFWLROOB-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(C3=C(C=C(CC)C=C3)F)=O,16643067315C1C6D_E8F1EE16C951F3BC_6038_UN,8.330318,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001000010100100010011000000000110000100000000011010011011110101111110,VYRGRHLDTLZWGQ-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[C@H]3[C@@H](C3)C4CCOCC4,C18714995C32629C_A142E929EF154936_6041_UN,8.472979,00000000000000000000001000000000000000000010000000000000010000100100000000000001001000110011000000101100010111000000001011000100110011110110001011010011010111101111110,LUKFYFUZWBTWRU-HOTGVXAUSA-N
C2(=C1[NH]C3=C(C1=CC=N2)CCCC3)NCCC4=CC=C([Si](C)(C)C)C=C4,9529384C97903FF6_D02EEEFE5CC77ACC_6041_UN,7.32819,00000000000000000000100000000010000000100000000000000010000000000100000000100101001100100011010010101100110000011000001011000100110101010100011011011101010110101111010,LUOIYINJDKORLH-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CCC3)C4=C(C=CC=C4F)F,1EFC538E48745D43_71B068564CB2BB18_6041_UN,7.9170046,00000000000100000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100110001110100001010011011010110101111010,MWHMMCVXWJCAFD-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(CCNC3)C4CC4,85465F701C259393_B2BD3C139FFAD2F1_6041_DP,7.927087,00000000000000000000001000000000000000100000000000000100000000100110000000000100101100100011000010101100110010011000001011000100110101010110011011010111010110101111010,KBTCQBUGNGQCLF-UHFFFAOYSA-N
C(C1CCCC12CCOCC2)=CC3=C[N](C)C4=C3C=CC(=C4)Cl,A4C898B4ACE276D3_47BC9D6F9B9FD3B5_7019_UN,8.184307,00000000000000000000000000000000000000000000000000000000010000000110000000010000000101110000010010110101010101001000001011100100110010100110000001011000010011101111110,PPLWKXHHWXNTOF-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCC3(C2)OCCO3)F)CC4,A576632297BC7792_BCDD4718EAEC3A87_6041_UN,7.1386495,00000000000000000001000000000000000000000010000000000000010000000000000010010001101101110011010010001000010111011001101011110000110011110110001010011011110111111111110,IMDAENQSHDAUDZ-UHFFFAOYSA-N
C[N]1N=C(C=C1F)NC2(CCCC2)C3=CC4=C(C=C3)OCCO4,E01DCB216F096A1A_A4F121DF91B1FC33_6041_UN,8.188208,00000000000000000000000000000000000000100010000000001000010000100110000010010101100100010011011010100100110101011100001011101100010011110110001011011011110011111111110,OLGVMXFJYDWXPM-UHFFFAOYSA-N
FC1=CC5=C(C(=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)C=CO5,99BFA08DC7D60626_4AC5E3DDFD6CD734_6041_UN,8.603018,00000000000000000000001000000000000000000010000000000000010000100100000000010101101101010011010011101100010100010000001011100100110001110110001011011011110110101111110,OJVSERLAHMQNBS-SZNDQCEHSA-N
FC2=C(C=C1C(=C[N](C1=C2)CC[C@@H]3CCNC[C@@H]3C=C)CC#N)F,B4A551F8D8F82665_DC84750FCF8803AE_6034_DP,8.852711,00000000000000000000000000000000001000000110000000000000000000000100000000010000001101110001000010111100110100010000001011100100110000100110001011011011010110100111010,VIEVUBZKNAVMDI-KBPBESRZSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCOCC3)C4=CC=C(C=C4)F,E80B3C5BB8FF8ACA_8D9FD6F2ACA42427_6041_UN,7.824437,00000000000000000000001000000000000000000010000000001000010000100110000000010001100100110011011011100000100101011000001011101100110011110110001011011011010011101111110,UNQLCKFEMJBOCG-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,FB02D83281EBE614_8A496A0C9DCF14D2_6041_UN,8.076225,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,WZVWFEWDKBTXOH-ZHRRBRCNSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(CC3)C4CC4,FFF7A17C47C17925_979210507C7E1EDF_6041_UN,7.9442477,00000000000000000000001000000000000000100000000000000000000000100110000000000100001000000011000000101100010010001000001001000100110001010100011011010111010110101111010,BCENSQFEECDDTE-UHFFFAOYSA-N
CC1=C(N=C(N1C[C@H]2[C@@H](CNC2)C3=CC(=CC=C3)F)C4CCCN4)C5=CC=CC=C5,AAB8D4A316AD40D1_3BF26E2ABC95A972_6034_UN,8.771614,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010001000100100010000101011100100110100100110001011011011010110101111010,QCPRKZOYAURWSV-XWQVQCDNSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)N[C@H]4[C@H](C3=CC=N[N]3C)OCC4,92C7F76A243819C0_3EF984EA95D0BBD2_7022_UN,8.158857,00000000000000000000001000000000000000000000000000001000010000100100000000010000100100010011011111000001100101010000001011101100000011110100001010011011110011101111110,GAUIQFFLIWZMQF-NVXWUHKLSA-N
C1(=C(C=C(C=C1)C2CC2)F)N[C@H]4[C@H](C3=CC=N[N]3C)OCC4,8CEB7BC2F40D425C_CA3976E7DD931A6D_7022_UN,8.158847,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011011111000000100101010000001011101100000011110100001010011011110011101111110,NACIIHWFAQTWFQ-NVXWUHKLSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(C)CC=CCC3,91A75A15E93E318C_D46A86479D0BD0A6_6041_UN,8.043142,00000000000000000000000000000000000000100000000000000000000000100110000000010100101101100011010010111000000010011001101011100000110001010110001001011111010110101111010,UQGKWCDIWIQZKQ-ATNAJCNCSA-N
N(CC1=CC2=C(C=C1)COC2)[S](C4=C3C=C[NH]C3=CC=C4)(=O)=O,7AB316AA59BA726F_CD4F93ACBABC7E48_6029_UN,8.911493,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100101000001010001110011001001000010011001100111100001110001011101001010111110111110,LQFGSNJKVOLONY-UHFFFAOYSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC3=CC(=C(N2CCN(C)CC2)C=C3)F)C4,19C37BBADC3B2D57_B83FC77744A31CD1_7019_DP,8.436296,00000000000000000000000000000000000000000010000000000000000000100000000000010001000101110010010010111000110100010001101011100000110001110110001011011011010010101111010,BYJXGIKJTBCYPO-NUJGCVRESA-N
C2(=CC1=C(C(=CC=C1)Cl)S2)NCCC3CC(C)CC(C3)(C)C,0CF52F2BC18E7627_CD67CFF5E100E7E0_7022_UN,8.1805935,00000000000000000000000000000000000010000000000100000000000000000010000000100000011100011001000010001101110110011001001000000100110001110100010001010101010110101111010,VYHYKRYQTOGVKC-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CC4(NC3)CCC4,28E6A6152F7122D6_F1BB7CC00BAE4AF6_6041_DP,7.88198,00000000000100000000000000000000000000100010000000000100000000000110000000000100101100010011000010101100110110011000001011000100110101110110001011010111010110101111010,ZMFUJTHJYLSUEO-UHFFFAOYSA-N
C2(=CC1=C(C(=CC=C1)F)S2)NCCC3CC(C)CC(C3)(C)C,65C9244B67C2E5AA_2A7BAA071E98D510_7022_UN,8.180581,00000000000000000000000000000000000010000010000100000000000000000010000000100000011100011001000010001100110110011001001000000100110001110100010001010101010110101111010,QENAZIAUOSXGLW-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NC(CC)C3CCOCC3,06B1F5E3427CAC3E_1EE4F65F2941A5D1_6041_UN,8.527043,00000000000000000000000000000000000000100011000000000000010000000100000000000100000100110011000010100100110111010010001011000100110111110110001001010001010111101111110,SWWCSPFBOPVRAB-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3CNCCC3(C)C)Cl,416ED4AC6EBB1351_83C4225EA03DC4E8_6034_UN,8.724095,00000000000000000000000000000000000010000000000100000000000000000110000000110110111101111011000010101001101110011001101111100100110101110110011011011111010110101111010,AERPRSJJBWXBNY-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5)C,95CBF124A8994EAB_484F027F78788A9E_6041_UN,8.270898,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010110010000001011101100110001110110011011011111010110101111010,BXLONTZZMULZAM-OSPHWJPCSA-N
O(CC2(CC1CO1)CCOCC2)CCN3CCN(C)CC3,E2777AD7BDDC3502_762C34E74C826269_6039_UN,7.3539686,00000000000000001000001000000000000000000000000000000000010000000010000000010001000001100000010100101000000001011001101011100010110010000110001001111000110101111101110,FAGYOZUEXDAAEP-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CC3)CC4CC4,0EB6DC55604C2DB0_4FCEC42A9CD8A9BF_6041_UN,8.421888,00000000000000000000001000000000000000000010000000001000000000000110000000010000101100010011011010001100010100001000001011101100110001110100001000011001010110101111010,QFQGXFWLIKSPQL-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CC34CCSCC4,D2EAB2FA6864A0B6_903D09E2238212D5_6041_UN,7.5099373,00000000000000000000001000000000000010100010000000000000000000000110000000000100001000111011000000101100010110001000001011000100110001110110001011010111010110101111010,IHYKUIXPIMPJAX-UHFFFAOYSA-N
BrC1=CC2=C(N=C1)[N](C=C2CC3=CC=CC=C3)C[C@@]45CCN(C)C[C@H]4CNC5,7BC16D385DDBFF7C_93B3986E7BCB2764_6034_DP,8.136007,00000000000000000000000000000000000000100000001000000000000000000110000000010100101101110011010010101100010110011001101011100100110000100110001001011001010110101111010,BQEZYGYYFXTEJM-XXBNENTESA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=C(C(=CN=C2)Cl)Br)C3,850BE8F2A7F7EFF0_FB1B903BE27E50ED_6035_UN,8.32325,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000010111101001010100000101001001100011110000100100001111011110110101101111110,LDHUCZCWIQUVTO-BQVMBELUSA-N
C(C2CCCC1(CC1)C2)=CC3=C(Cl)[N](C(=N3)N(C)C)C4=CC=C(C=C4)F,0FA290820A4D64FC_738202CE855BBADF_7019_UN,7.538365,00000000000000000000001001000000000000000010000000000000000000100110000000110101000101110000010010010001011100001000001011100100110001110100001011011110000010101111010,RTZXHGGOJYZTPU-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CCCC3=C2C=CC=C3,93C1C4500B975D0B_378A21DDF44BFE23_6041_UN,7.658536,00000000000000000000100000000010000000000000000000000000000000000100000000100001001000100011010000101100010000001000001001000100110001010100011011011111010110101111010,VQTUMQGUVKTTFS-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3CNCCC3)C[C@H]4[C@@H](CNC4)C5=CC(=CC=C5)F,39914E13A9F2AD4A_E344A571BEDDCD9E_6034_UN,8.098965,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101100110100010000001011100100110100100110001011011011010110101111010,MJXHGVFVAUDNED-ZDZADGERSA-N
N3CC4(C=CC1=C[N](C)N=C1C2=C(C=CC=C2)Cl)CC3C4,C6ED32682A0C1515_78FAC64E82A014CC_7019_DP,7.637296,00000000000100000000000000000000000000000000000000001000000000100110000000010000101100010011011010011001110100011000000011101100110000100100001010001011010010101111010,CDYPOSDRUJKLQI-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC3CC4(C3)C5CCC(C4)C5,03CA4196281979DE_3A74B922B45A7FD9_6041_UN,7.76332,00000000000100000000000000000000000000100010000000001000000000100110000000010101100100010001011010100000110100011000001011101100110001110100001011011011000010101111010,VCESLMLHXBLSSH-UHFFFAOYSA-N
FC1=CC(=C(C=C1)CC#N)NC(C2CNC2)C3=CC=C(C=C3)F,412581B16245BD49_DABC5FBD070620BE_6041_DP,7.5866327,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110010000000001000000100010000000001000100000101110110001011000011010110100111010,OXAXLVKCIZKLAF-UHFFFAOYSA-N
C(C1C2CCN(C1)CC2)=CC3=C[N](C)N=C3C4=CC=C(C=C4)F,921D57350980FAC2_6A4F3172CFF58823_7019_UN,8.277452,00000000000000000000000000000000000000000010000000001000000000100100000000010000100101110000011010111000010100010000001011101100110000100110001011011010010010101111010,XNKSWTRFMTVPMS-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2CCC(C2)C3=CC=C(C=C3)F)C4CCCC4,D8026FB68D383991_87AD5EA7A5EEC562_6041_UN,8.102105,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011011010000000100100010000001011101100010001110100001010011011000010101111010,CXWMRFKACJUAOS-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CCCC3)C4=C(C(=CC=C4)F)F,DD6E82D82A7A3C6C_96188DEC768FDFB8_6041_UN,8.127382,00000000000000000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,OGVDQWMFQBPGJA-IBGZPJMESA-N
C(C1(CC1)C2CCCCO2)=CC3=C[N](C)C4=C3C=C(C=C4)F,499214B61782EE24_805555E93E1B5342_7019_UN,8.426674,00000000000000000000001000000000000000000010000000000000010000100110000000010000000101010000010010110100010101001000001011100100110010100100000001011000110011101111110,YCDRXKJVVZYQGN-UHFFFAOYSA-N
N1CCC4(CC1)CCC2=C(C=CC(=C2)NC3=C(N(C)C)C=CC(=C3)F)O4,198D6DE1BCC8E508_C02B72615BB66B7E_6041_DP,7.3826656,00000000000000000000000000000000000000000010000000000000010000000010000000100001001001110001010001101100110100011100001011100100110111110110001011011111110011101111110,SFPNTKDWUHQUAJ-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=C(C=NC=C2I)I)C3,C36E0D9E3AB924F5_776BE631A1712550_6035_UN,8.6866,00000000000000000000000000010000000000000000000000000000000000000100000000100000000001110000010011101000010100000101001001100011110000100100001111011110110101101111110,DRKAGOXWZCRKAG-BBGACYKPSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=C(C=NC=C2Br)Br)C3,FC277D6014C23B9E_5F3D79ABAF220AC6_6035_UN,8.686604,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000010011101000010100000101001001100011110000100100001111011110110101101111110,KANYNOIOODYUPY-BBGACYKPSA-N
CC1=C(C=CC(=C1F)C#N)NCC3CCCC2(CNC2)O3,1CD6668058B41E27_485A548B8D5E56F1_6041_DP,7.59996,00000000100100000000000000000000000000000110000000000000010000000010000000000000001000110011000100101000010110001000001011000000110111110110001011010011110111101111110,YUMFDTBFRGGOKH-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC2=NC=CN2C[C@]34[C@](C)(C3)CNC4,71EBE799C5E0113B_288F06C8F0D07D11_6034_UN,8.372077,00000000000000000000001000000000000000100000000000000000000000000110000000010101101101110011000010101001010110011001100011100100110101110110001011001111010110101111010,CFLPSIAHSMORHH-MSOLQXFVSA-N
C1(=CSC=C1Cl)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,32E86E82C6C8D791_25F5B9600CBEB95D_7022_UN,8.351305,00000000000000000000001000000000000010000000000000000000000000100100000000010101101101011011010010101001000100010000001011100100110001110110001010011011010110101111010,VFNVXHZRXPFMKL-PXAZEXFGSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3OC2CCCC2C3)F)CC4,B23A59C4E6D48AB0_0B24CDDE84274E2E_6041_UN,7.7070026,00000000000000000001000000000000000000000010000000000000010000000000000000010001101101110010010110001100010110010001101011100000110011110110001010011011110111101111110,RBBHWWGANZCQPJ-UHFFFAOYSA-N
N(CC1C2CCC(C1)CC2)C(=O)C3=C[NH]C4=C3C=C(C(=C4)Br)Br,A30C44AE6EC23B62_7107605275A1C3F2_6038_UN,7.661407,00000000000000000000000000000000000000000000001000000100000000000100000000000000101100010011100011001100010100100000011001000100110100100100001011010011011110100111110,XMPHQJPIBSNNPS-UHFFFAOYSA-N
C(C1C2CCN(C1)CC2)=CC3=C[N](C)N=C3C4=CC(=CC=C4)F,04A261DB49C62E92_D45A63A70CB7780A_7019_UN,8.218044,00000000000000000000000000000000000000000010000000001000000000100100000000010000100101110000011010111000010100010000001011101100110000100110001011011010010010101111010,DNXQBPHGFHNDME-UHFFFAOYSA-N
C1(=C2C(=NC=C1)[NH]C=C2C3CC3)NCC4=CC=C([Si](C)(C)C)C=C4,522E1CB35160DFFC_F4D70DF17128C2FD_6041_UN,7.835311,00000000000000000000101000000010000000100000000000000100000000100100000000100100101100100001010010101100010000001000000011000100000101010100011001011101010110101111010,GTCXSNHXDVJWFM-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC[C@@H]3O[C@H](CC3)C4=CC=CC=C4,82E12C17D69149B8_67A39CBF6E59E2AB_6041_UN,8.391076,00000000000000000000000000000000000000000010000000001000010000100100000000010000101100010011011110001100010100000000001011101100110011110100001001011001110111101111110,BODIWPYDKWQDQI-SJLPKXTDSA-N
CC1=CC(=C(C(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)F)C#N,B658C0DED7A93CDB_8DCB9D6832A17456_6041_DP,7.7900896,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110101111010,HXRWTNUWKJZHNJ-FUHWJXTLSA-N
CC1=C(N=C(N1C[C@H]2[C@@H](CNC2)C3=CC=C(C=C3)Cl)C4CCCN4)C5=CC=CC=C5,B6B9632FAE43F053_125343BF132D1E3B_6034_UN,8.77039,00000000000000000000000000000000000000100000000000000000000000100100000000010101101101110011000010001001100100010000101011100100110100100110001011011011010110101111010,UBWJFZNENPJUQC-XWQVQCDNSA-N
FC1=CC(=C(C=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)C=C,6CAA30C1A1764210_E8A27D87269BA20A_6041_UN,8.611489,00000000000000000000001000000000001000000010000000000000000000100100000000010101101101010011010010111000000100010000001011100100110001110110001011011011010110101111010,GZMFVHZSIZFFCE-IERDGZPVSA-N
FC1=C(C(=C(C=C1)F)CC#N)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F,EDF12C05CE07BB83_921D0FA27F688EFD_6041_DP,7.955469,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,FZZGGOZSTUEJJE-RDTXWAMCSA-N
C2(=C1OC=CC1=CC(=C2)F)NC[C@@H]3CCCN(C)[C@H]3C4=C[N](N=C4)C,7110E7C51D3B97B5_AC70BE3D1B3367F1_7022_UN,8.181049,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110011011110101100010110010001101011101100110001110110001001011111110110101111110,ZHSNREZMLHDOAU-KBXCAEBGSA-N
N3C1CC2=C(OC1)C=CC(=C2C35CCN(CC4=CC=CC=C4)C5=O)F,24896C1B50C736B0_129131657455E076_2238_UN,7.9463587,00000000000000000000000000000000000000000010000000000000010000000010000000010001100101110011100110101100110101111100011011100101110000100110001111011011111111110111110,SBMKBWYDWLHKDR-UHFFFAOYSA-N
N3C1CC2=C(OC1)C=CC(=C2C35CCN(CC4=CC=CC=C4)C5=O)Br,7848FE5A669021B3_E48846A1542C904F_2238_UN,7.9463563,00000000000000000000000000000000000000000000001000000000010000000010000000010001100101110011100110101100110101111100011011100101110000100110001111011011111111110111110,AHMUWIQXXVCJJX-UHFFFAOYSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NCC3=C2CCCCC2=CC=N3,34CC192C828C4FA7_FD62D3E2241A1D8B_6041_UN,8.001043,00000000000000000000100000000010000000000000000000000000000000000100000000100001001000100011010000101100010000011001001001000100110001010110011011011111010110101111010,VMWCTPNXJMSRBK-UHFFFAOYSA-N
FC2=C1N(C=CC1=CC(=C2)Cl)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,EE9638BE20EE4EDE_045243DE4DA30507_6034_UN,8.780576,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101101010100010000001011100100110001100110001011011010010110101111010,SKUGROMMFSQSMO-VFNWGFHPSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NC[C@H]3[C@@H](C3)C4CCOCC4)C,5B3C76FC4B42D371_31E86105D16FF2A3_6041_UN,7.9318438,00000000000000000000001000000000000000000000000000000100010000100100000000000000101100100011000010101100010001000000001011000100110111010110001011010111010111101111110,PQGIYGJXGWIOEP-YJBOKZPZSA-N
FC1=NC2=C(C=C1)C=C(C=C2)NCC3N(C)CC4(CC3)CC4,D2B178117FC82CBE_E89BF06E0535E61A_6041_UN,8.268342,00000000000000000000001000000000000000000010000000000000000000000110000000010001001001110011010000101100010110011001101011100100110001110110001001011011010110101111010,ROQXQLCSHCIQBU-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CCC3)C4=CC=C(C=C4)F,BDF916548D878D9E_41A47F18D128303E_6041_UN,7.613597,00000000000100000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100110001110100001010011011010110101111010,KWVITXSJJUMAOM-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3=C(C=C(C=C3)C4CCOCC4)F,6F6349A0FBEFAD79_AD9EBA99EC944357_6041_UN,7.4788475,00000000000000000000000000000000000000100010000000000000010000100100000000010100100101110000010010101000000111010001101011100100110011110110001011011011010011101111110,MPLNIEIPNFHPKO-FQEVSTJZSA-N
CC1=C(C(=CC(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)F)C#N,20989D97A90611BD_A93B3FF4F07D0C60_6041_DP,7.833385,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110101111010,QAYHTDSCSWRMFY-MAUKXSAKSA-N
C1(=CC=C(C=C1)[Si]23OCCN(CCO2)CCO3)NCC(OC)C4CCOC4,43DC0FF9D5015DCC_FFD1A8E5DDEC2ED8_6041_UN,7.2234955,00000000000000000000100000000000000000000000000010000000010000100000000000000000001101100101010110001110011011011000101011101010111011010110101000111001110111111111110,NXGGUDCEAJJIIF-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CCCC2N3CCOCC3)F,C99E23A6E59E772F_2AC5A5487B2B5986_7022_UN,7.902297,00000000000000000000000000000000000000000010000000000000010000100000000000110000101001110011010110101000000101010001001011100000110011110110001011011111010111101111110,LNGUVMPQGROEDX-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(C)C=CCCC3,39C43CC767AF6012_9F79F9AD303ACD4F_6041_UN,7.984125,00000000000000000000000000000000000000100000000000000000000000100110000000010100101101100011010010111000000010011001101011100000110001010110001001011111010110101111010,XIEYVGPTUCNMTL-ATNAJCNCSA-N
CC34CCC(C=CC1=C[N](C)N=C1C2=CC=C(C=C2)F)(CC3)CO4,E9E0BF49CED0BC10_EF7A3AE7E1C94A17_7019_UN,7.981863,00000000000000000000000000000000000000000010000000001000010000100110000000010000100100010000011010110000010101001001101011101100110010100100001011011110110011101111110,RZWLLJSQBPXJRY-UHFFFAOYSA-N
FC2=C(C=C1OC=CC1=C2)NCC3CCCN(C)C3C4=CC=CS4,A092FEA85421F97F_2B26CF6BEC5B5A3E_6041_UN,8.562379,00000000000000000000000000000000000010000010000000000000010000100000000000010000111101111011010011101100010110010001101011100100110001110110001011011011110110101111110,AOIFTCKLGJNTRG-UHFFFAOYSA-N
FC2=C1CCCC1=CC(=C2)NC3=CC=CC(=C3)CC4CCCN(C)C4,64EA2001F5AB4BC3_A10E389FDAB06933_6041_UN,7.5151734,00000000000000000000000000000000000000000010000000000000000000000000000000010000000001110001010010101100010110010001101001100100110001110110001011011001010110101111010,KUFORRXAKKGMJC-UHFFFAOYSA-N
FC1=CC(=CN=C1)C2=C5C(=CC(=C2)C=CC4=C3CCCC3=N[N]4C)OCO5,7BE6C7B8FBA74DAF_824B1C771BC6C8E1_7019_UN,8.212192,00000000000000000000000000001000000000000010000000001000010000100100000010010000100100010000011010110100010111010100001011111100010000100100001011011010110011111111110,ZETJFKLNJUZWOA-UHFFFAOYSA-N
FC2=C1C=CC=CC1=CC(=C2)NCCC4CCN(C3CCN(C)CC3)CC4,13820785D9103683_73FEBEE6706DB223_6041_UN,8.028114,00000000000000000000000000000000000000000010000000000000000000100000000000010000101001110001010000101100110100010001101011100100110001110110001001011001010110101111010,OLSPXLHCUKFMAA-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3=CSC=C3)C(=CC(=C4)F)F)C5,7BECF099E0D6E9F2_2F13BFE44345B2FF_6034_UN,8.591331,00000000000000000000000000000000000010000010000000000000000000100110000000110000101101111011000010001100010100011001101011100100110000100110001011011111010110101111010,ORYJTMXFJCXIMA-KXBFYZLASA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC5CCCN(CC4=C(C=CC=C4F)F)C5,E02B42BCD52521BB_AF095223924FF3D6_6041_DP,8.543915,00000000000000000000001000000000000000100010000000000000000000000100000000010101101101110011010010101000110110010000001011100100110101110110001011011011010110101111010,YMLISIZEQITFAT-GERGAVKQSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC5COC4=C(C=C(C=C4F)F)C5,75B9C225F985895C_8225AF3EE7FA7399_6041_DP,8.59706,00000000000000000001000001000000000000100010000000000000010000000100000000000100100101010011010110100100111101010100101011100100110101110100001011011001110011101111110,BYBYTUDZCKIQHB-VSDYLMMWSA-N
FC2=C(C=C1C(=CC=NC1=C2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4)F,E3D2FA54CDDB78CA_B7791C634D6F7A2F_6041_UN,8.685702,00000000000000000000000000000000000000000010000000000000010000100100000000010000101001110001010100101100010111010001101011100100110011110110001011011011110111101111110,MLJWRNBHLCNEIN-SFTDATJTSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NC[C@@H]3CC[C@@H](O3)C4CC4)C,F3DF04AD4D4AAF53_7880EE67A1FBD6B3_6041_UN,8.174844,00000000000000000000001000000000000000000000000000000100010000100100000000000000101100000011000110001100010000000000001011000100110111010100001010010111110111101111110,MPLRYVLRGUVJKA-MAUKXSAKSA-N
FC2=C1OC=CC1=C(C=C2)NCC4CC3(CCN3C)C4,9DC5D23BA437B7BA_500BCAFA874A14B2_6041_UN,8.211693,00000000100100000000000000000000000000000010000000000000010000000010000000010000001101110010010011001100010100011001101011100100110001110110001000011001110110101111110,TZWRLJPGOJJPHT-UHFFFAOYSA-N
COC1=C(C=CC(=C1)C(F)(F)F)NC2C3OCC4CC2CC34,E8F205FC117F395A_1C5A24AB17C82222_7022_UN,8.780172,00000000000000000001000000000000000000000010000000000000010000000000000000000000000100000011010110000100011101001100000000000011110001110100000111000011110011111111110,SIAWYTUKPZCFPX-UHFFFAOYSA-N
N1C4CCC1C(CNC(=O)C3=CC2=C(C=CC(=C2)F)OC3)C4,04F8E2B8D2FD1962_0E4D6D361D45F472_6038_DP,8.040749,00000000000000000000000000000000000000000010000000100100010000000000000000001000101100010111100011111100110101110100011011000000110100100110001011010001111111110111110,WSVACTMGMHEYBM-UHFFFAOYSA-N
FC1=C(C=C(C=C1)CC=C)NCC2N(C)CC3(CC2)CCC3,903AB487C5546D12_61A36D30476F5606_6041_UN,8.060318,00000000000100000000000000000000001000000010000000000000000000000010000000010001001001110011010000111000010110011001101001100000110001110110001011011011010110101111010,WDOQCPWILPNJGU-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2OCC3(C2)CCC3)F,D3FA85BFC6DA9EED_DCE2B9CA24C327AB_7022_UN,7.7080097,00000000000100000000000000000000000000000010000000000000010000000010000000100000001101110011010110001000010101001001001000100000110011110110001010011111110111101111110,ADWVIOUMSYJWJS-UHFFFAOYSA-N
C(C[C@]12C[C@H]1CCC2)=CC5=CC3=C([N](N=C3C)C4=CC=CC=C4)N=C5Cl,E48E710178CE86AF_48C538C8EC4E455A_7019_UN,7.8539205,00000000000000000000001000000000000000100000000000001000000000100110000000010101100100010000001010110101010100001000001011101100110001110100001011011010000110101111010,GXIMWSSNPWZTIY-VGSWGCGISA-N
FC2=C1C(=C[NH]C1=CC=C2)NCC4CC3(CCN3C)C4,8A0DEE02AB43D13F_0896ED32516A377F_6041_UN,8.311037,00000000100100000000000000000000000000000010000000000110000000000110000000010001101101110011010010001100010100011001101011100100110101110110001000011001010110101111010,UANNOVRVZPHCFA-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)C#N)F)NCC2CNCC(O2)(C)C,33EF1A7D1C375CD9_F1FA5D1645D3398C_6041_DP,8.562725,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110001011000111110111101111110,JZEJLBFHMQTVGO-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NC3CCN(C)C34CCCNC4,5E99A851E937F418_DD7A834D4FB8A7BD_7022_DP,7.789654,00000000000000000000001000000000000000000010000000000100000000100010000000010001101101110011010010101000110110011001101011100000110101110110001011011011010010101111010,FCFUQAMHILPOHN-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NC3CCN(C)C34CCCNC4,CFE66938E66EEB10_29BA714007FB0602_7022_DP,7.7896547,00000000000000000000001000000000000000000000000000000100000000100010000000010001101101110011010010101001110110011001101011100000110101110110001011011011010010101111010,YKDZUEVIEPASHP-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)COC2)[S](C4=C3[NH]C=CC3=C(C)C=C4)(=O)=O,222C29DAD1C95AF1_11406D4135E37FD1_6029_UN,9.055434,00000000000000000000000000000000110000000000000000010101011111001101010001000000110100101001001011000110011001001000010011001100011101011110001011101001010011111111110,NIWSLBGMSLNHBB-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)F)NC2CCN(C)C23CCCNC3)F,FF6CE1FE1A4B6633_447F3C00DE6A55AB_7022_DP,8.26297,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101110011010010101000110110011001101011100000110101110110001011011111010010101111010,OOHNWYGSFYOKTD-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3CC4(NCC3)CC4,7527488419039FEC_650D82FA2DEE064C_6041_DP,7.7278624,00000000000000000000001000000000000000100000000000001000000000100110000000010101101101000011011010101000110010011000001011101100110101010110001011011111010110101111010,SSIAULLMPSCZMG-UHFFFAOYSA-N
CCC1=C(C(=CC=C1)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,B5F1D6E4638D28DF_190B26103A01FE14_6041_UN,8.236336,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010010001011100100110001110110001011011111010110101111010,QDQLMLVBGLPWCJ-IERDGZPVSA-N
C[Si](C)(C)C1=C(C=CC=N1)N[C@H]2C4=C(OC3(C2)CCCC3)C=CC(=C4)F,8547A6DDF966A8ED_14B931BF2F4A931C_6041_UN,7.8621736,00000000000000000000100000000010000000000010000000000000010000000110000000100001000000110001010011100100110100011100001011000100110011110100011011011111100011101111110,JYGLTBJRCLUWAM-GOSISDBHSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3CCNC34CC4,2AD135975807A971_880EEE2305FADB85_6041_DP,7.6644387,00000000000000000000001000000000000000100000000000001100000000100110000000010101101101000011011010001000110010011000001011101100110101010110001010011111010110101111010,VXDSYPGVDDZKHI-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NC[C@H]4[C@H](C3=NC=C[N]3C)OCCC4,95FBC2A3021A833E_021EBC116B95EE0D_6041_UN,8.17743,00000000000000000000001000000000000000100010000000000000010000100100000000010101001101010011010111101000000101000000001011100100110011110110001011011011110111101111110,PSJFNSFSIVCNBJ-KBXCAEBGSA-N
CC1=C(C=C(C(=C1)NCC3O[C@@H]2CCCC[C@H]2C3)F)[N]4C=CC=C4,364015F2F91FFA97_6EA2D255A4A3809E_6041_UN,8.320259,00000000000000000000000000000000000000000010000000000000010000100100000000010000001101010010000110001100010100000000001011100100110011110100001011011011110111101111110,DIMALKRPVUGIGY-XNKIQEMOSA-N
CC1=C[N](N=C1)CC2=C(C=C(C=C2)NC(CC)C3CC4CCC3C4)F,299C7ABA8F0C0FB5_5595FA7148DF6C49_6041_UN,8.029539,00000000000000000000000000000000000000000010000000001000000000000100000000010000100100010011001010001000110110010010001011101100110001110100001011011111010110101111010,ZMHNUJKAPYJSCA-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4C(C)OC5=C4C=CC(=C5)F,DA4BA30338EAA19A_DF23621AE7ECB306_6041_DP,8.547568,00000000000000000001000000000000000000100010000000000000010000000100000000000101100101010011010111100100110100010100101011100100110101110100001011011111100011101111110,STHSECMIQDPHLY-RPWHCWMQSA-N
CN(C)CC1=C(C=C(C=C1)NC2CCOCC23CCCC3)F,0E0B4061B3B426D7_A206193A0F8C231D_7022_UN,7.708934,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110011010011101000110101011001001000100000110011110110001011011111010111101111110,IOLWMUDGJHEYOD-UHFFFAOYSA-N
C1(=C(C=CC=C1)C2CCC2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,5BBB5D2FC55A6051_80A6486C751BFE1D_7022_UN,8.525185,00000000000100000000000000000000000000000000000000000000000000100000000000010000101001110011010000101001000110010001101001100100110001110110001011011011010110101111010,ZTSYJZJGRFSXQI-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N=C(S2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,13887409F3E70628_C515F56D6ADDDC54_6041_UN,8.556321,00000000000000000000001000000000000010000010000100000000000000100100000000010101111101011011010010101100011100010000001011100100110001110110001011011011010110101111010,APSFFMCKLHESLG-YJYMSZOUSA-N
C(C1(CC1)C2CCCO2)=CC3=C[N](C)C4=C3C=C(C=C4)F,5D1BE208EB8DB5AC_31ED67A924D8E215_7019_UN,8.516889,00000000000000000000001000000000000000000010000000000000010000100110000000010000000101010000010010010100010101001000001011100100110010100100000000011000110011101111110,RDPQYXXKYSDJHR-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CCC(C)N(C)C)C3=CCNCC3)F,F952E068ECDBBBE4_4C64E2579C941949_6034_UN,8.293788,00000000000000000000000000000000000000000010000000100000000000100100000000111000101101110001010010111100110110010001101011100100110000100110011011011111010110101111010,ABFUTXHRUMLPOF-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@H]2CCCC[C@H]2C3=CC=N[N]3C)Cl)C4CC4,92A9C3AF0BB2F16A_13F469ACD64D4B6E_7022_UN,8.506057,00000000000000000000001000000000000000000000000000001000000000100100000000010000100100010011011010000001100110010000001011101100110001110100001011011111000010101111010,KYJYPIKINHVXAK-QAPCUYQASA-N
C1(=CC(=CC=C1)C2CCC2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,A91DBA25427F2D66_817EF171DA4B5BA6_7022_UN,8.486118,00000000000100000000000000000000000000000000000000000000000000100000000000010000101001110011010000101001000110010001101001100100110001110110001001011011010110101111010,RXEYHYRZEJHWHC-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)N[C@@H]2C4=C(OC3(C2)CCC3)C=CC(=C4)F,749BCB3C93B26DC6_14ADD85A674BD2E6_6041_UN,7.897947,00000000000100000000100000000010000000000010000000000000010000000110000000100001000000110001010001100100110100011100001011000100110011110100011011011111100011101111110,AAAJYDZMUMTVBX-KRWDZBQOSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCCC2CCCNCC2)F)CC3,B8C2C45B76883A63_4365C5FEFE8FEE39_6041_DP,8.048327,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010000001000100110010001101011100000110101110110001010011011010110101111010,PLMQTCWSMBBSDW-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NCC3=C2CCCCC2=CC=N3,2723C02769C2245B_9AFFA8D12FE637A9_6041_UN,8.218988,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100001010000101100010000011000001011000100110001010100011011011101010110101111010,GAMSLMMOMKNZNK-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2(CCCCC2)C3=CC(=CC=C3)F)C4CCCC4,35F1D2C4D4A5FF2F_B2E86268CCE6C7C5_6041_UN,8.081953,00000000000000000000000000000000000000100010000000001000000000100110000000010101100100010011011010000000100100011000001011101100110001110100001011011011000010101111010,WLXLAILITYXREA-UHFFFAOYSA-N
C(C1CC2CCC1O2)=CC3=C(CC)OC4=C3C=CC=C4,2B58C70BB2F7737D_C2DD1D75EEA7FAE2_7019_UN,9.047573,00000000000000000000000000000000000000000000000000000000010000000000000000000000000100000000000010010100010000000010001010000100110010000100000011010010100101011011110,INHRKVQAQJYAQL-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC[C@H]3[C@@H](C3)C4CCOCC4,44ACE01C06B96D85_906B658C5B50F2A5_6041_UN,7.6471863,00000000000000000000001000000000000000100000000000000000010000100100000000000100001000100011000000101100010011000000001011000100110011010110011011010111010111101111110,ROKWAVJAYUBMPT-HKUYNNGSSA-N
CN6CCC1=C(C5=C(N1C[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)C=CC(=C5)Cl)C6,94AB505879F3B64A_E051BA6BC1E26433_6034_UN,8.064413,00000000000000000000001000000000000000000000000000000000000000100100000000010101100101110000010010101101010100010001101011100100110001100110001011011110010110101111010,OCGHLEBIFKQNCQ-NSYGIPOTSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NCC3CC4(C3)C5CCC(C4)C5,2B9D2540BDB860E3_99C4A6329437AF46_6041_UN,7.770465,00000000000100000000000001000000000000000010000000000000000000000110000000010101001101010010010010001100011110001000001011100100110001110100001011011011010110101111010,JOTDMWULDSLOPS-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC4CCCN(CC3CC3)C4,8B46DE7C3934A384_4ABCD4D50233FDAB_6041_UN,7.9443197,00000000000000000000001000000000000000100010000000000000000000000100000000010100101001110011000000101100010110010000001011100100110001110110001011011111010110101111010,XWMLLHFWAHAVQG-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC3(COC3)C4=CC=C(C=C4)F,AD86AF0589223B40_E47B6E9025C7BDE4_6041_DP,7.9736414,00000000100100000000000000000000000000100010000000000000010000100110000000010101101101110011010110101000100111011000001011100100110101110110001011011011010011101111110,HUAUFJJSMIPBSL-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC3=CC2=C(CCNC2)C=C3,AC317BB2920320F9_0905C7EA95C6D46F_6041_DP,8.074369,00000000000000000000100000000010000000000000000000000000000000000100000000100001001000100001010000101100110000011000001011000100110101010110011011011111010010101111010,QPYBGNCIERJYCG-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC[C@@]23CCCN[C@H]2CCCC3)F,C6C60A7C7D426CC9_8F8952F3946DEA01_6041_DP,7.399208,00000000000000000000000000000000000000000010000000000100000000000010000000100000101001110011010000101100110100011001001001100000110101110110001011011111010110101111010,NQYJIWFUUMRSQC-RBUKOAKNSA-N
CCC(C#N)C1=CC=C(C=C1)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F,9769EE4D0D168CFF_E7407C15CAA01D64_6041_DP,8.144912,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010010001001000100110101110110001011010011010110101111010,TXZOSGVZEKZMFG-HGYXGMMLSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2C3(CCNC2)CCOCC3,B0D29375B1768EE9_2FE66F06A67A9B39_6041_DP,7.6653333,00000000000000000000100000000010000000000000000000000100010000000110000000100001101000100011010000101000110001011000001011000000110111010110011011011111010111101111110,HBQSZOWARBVNIG-UHFFFAOYSA-N
FC2=C(C=C1OC=CC1=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,BECDB5547FFAE4A4_D1B8706BC1D76160_6041_UN,8.873105,00000000000000000000001000000000000000000010000000000000010000100100000000010101101101010011010011101100010100010000001011100100110001110110001011011011110110101111110,OKUHQIPMRKCWMO-VFNWGFHPSA-N
C2(=C1C=CC=CC1=C(C=C2)Cl)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,DF8CDFD521BEAF26_3268198B69BE24CC_7022_UN,8.275062,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101101010100010000001011101100110001110110001011011011010110101111010,GJAFETDBAFLCFM-MWTRTKDXSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CC3(CN2)CCOCC3)F,0E75C5F557F7CBB4_7A8E21B5DC879DED_7022_DP,7.546339,00000000000000000000000000000000000000000010000000000010010000000010000000100001001101110011010010101000110101011001001011100000110111110110001011011111010111101111110,VTKLAYWUJLVQRK-UHFFFAOYSA-N
CC1=NC(=C(C(=C1)C)C#N)NCC(C2CCNCC2)F,DC9BE0ADD01F79B0_D3D9644E53FD2EE4_6041_DP,8.274914,00000000000000000000000000000000000000100110000000000000000000000100000000000100101000100001000000101000100100010000001011000000110101110110001011010111010110101111010,SXOPKMYPBDMXDA-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(=O)CC3=CC(=C(C=C3)F)Br,3304856A34515E63_A69E404FC2BF1A1B_6038_UN,7.757332,00000000000000000000000000000000000000000010001000000000000000000000000000000000001000010001100010001000110100110000011000000000110010100000000011010011011110100111110,IMWGNJBLXROLPM-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(=O)CC3=CC(=C(C=C3)Br)F,7EA44D386DAED32A_AF6C33970381DC0E_6038_UN,7.757312,00000000000000000000000000000000000000000010001000000000000000000000000000000000001000010001100010001000110100110000011000000000110010100000000011010011011110100111110,WOXLPVXQAJKNQG-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(=O)CC3=CC(=C(C=C3)F)Cl,2D54BC3BCE5A9308_AF2DF9E31D687D31_6038_UN,7.7573147,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010001100010001001110100110000011000000000110010100000000011010011011110100111110,DZWZRMOFUBLXNW-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(=O)CC3=CC(=C(C=C3)F)F,83E6137011B8E003_E270F71B76C19E72_6038_UN,7.7573094,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010001100010001000110100110000011000000000110010100000000011010011011110100111110,KPJYSYCKSQHGRG-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(=O)CC3=CC(=C(C=C3)Cl)Cl,C5FD493AD7C0D729_6AC36F4344564986_6038_UN,7.7573113,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010001100010001001110100110000011000000000110010100000000011010011011110100111110,IBXOBCAXFBFHNF-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(=O)CC3=CC(=C(C=C3)Cl)F,96FB1C92CF03DD36_CA212B9DA8A0180E_6038_UN,7.757309,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010001100010001001110100110000011000000000110010100000000011010011011110100111110,XKXXRUOMBCOEOG-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCCCN2CC3=CC=CC=C3)Cl)C4CC4,81B7CEDCB5E89A71_DCD5DE4A7A102759_7022_UN,8.325442,00000000000000000000001000000000000000000000000000000000000000100000000000010001001001110011000000101001000110010000001001100100110001110110001011011011010110101111010,VPLYWFKVBULXDP-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CC2C3CC3C)Cl)C4CC4,42A1A7EB672547A7_728A7AE97CBC1D57_7022_UN,8.301558,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010011000000001001000110000001100000000000110001110000000010010111010110101111010,IVAYHXVPWAMYHN-UHFFFAOYSA-N
FC2=C1CCCC1=CC(=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,EE406F690323E765_1D30B5BA74470665_6041_UN,8.174125,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,PNASFLCFNVPQNI-ZHRRBRCNSA-N
FC2=C1C=CC=NC1=C(C=C2)NCC3N(C)CC4(CC3)CC4,4F989D7F5467712B_1D7046CABB6537B4_6041_UN,8.33279,00000000000000000000001000000000000000000010000000000000000000000110000000010001001001110011010000101100010110011001101011100100110001110110001001011011010110101111010,IQICHNQBIADERX-UHFFFAOYSA-N
C1(=CC2=C(N=C1)[NH]C=C2C3CCC3)NCC4=CC=C([Si](C)(C)C)C=C4,83C7CEDC84543235_AC1D45233D82FDEF_6041_UN,7.728265,00000000000100000000100000000010000000100000000000000000000000100100000000100101001100100001010010101100010000001000001011000100000101010100011001011101010110101111010,VWHOPYKUCXUJKM-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)N[C@H]4[C@H](C3=NC=C[N]3C)OCCC4,A5FC1C7D0320CEA3_C58E1CEDE6508EF1_6041_UN,7.8480625,00000000000000000000000000000000000000100010000000000000010000100100000000010101100101010011010110100100110101010000001011100100110011110100001011011011110011101111110,SVSFFANOCSPRDP-NVXWUHKLSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NC3=C(C)[N](N=C3)C4CCOCC4)C5,A4CE69FCD42AAF25_90A07958513A0C27_6041_UN,7.7991705,00000000000000000000000000000000000000000000000000001000010000100100000000010001100101100011011011101100110011010001101011101100110111010110001011011111010011101111110,BKPKPSCREQIBIZ-UHFFFAOYSA-N
N(CC1CC2CCC(C1)S2)C(=O)C[N]3C=CC4=C3C=CC(=C4)F,81E150045B78A794_7C4B9558ABDE09D7_6038_UN,8.05339,00000000000000000001000000000000000010000010000000000000000000000100000000010001011101011010100110101100110100110000011011100100110010100110001001011001011110100111110,FZHSIRRBDNMCIB-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)F)NC2CCN(C)C23CCCNC3)F,7A8A3BB23380D61A_AC9336C47C18C551_7022_DP,8.197225,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101110011010010101000110110011001101011100000110101110110001011011111010010101111010,NCIXRMUSOFJOEY-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CCCC2N3CCOCC3)F,4F464919F4601BFB_328BC433E249CA10_7022_UN,7.692575,00000000000000000000000000000000000000000010000000000000010000100000000000110000101001110011010110101000000101010001001011100000110011110110001011011111010111101111110,JGQTUEKLRNMWFF-UHFFFAOYSA-N
BrC1=CN(C(=O)C2=C1C=CN=C2)CC3(N)CCCC4=C3C=CC=C4,9DF93B042EA3FCD9_1AD42F09F6676957_6034_UN,8.555233,00000000000000000000000000000000000000000000001000000000000000000110000000010001100011010011100001101100110100111100011011100101110001100100001111011011011110100111110,YAVWGRHETNVEDN-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)CCOC2)[S](C3=CC4=C(C=C3)[NH]C=C4)(=O)=O,CA6E9F8247A6082C_4B12BD1CF71AA06E_6029_UN,9.009186,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100101000001010101110011001001000011011001100111110001110001011111001010111110111110,RUAFYTSIWOSWRJ-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3(CC3)C4C5=C(CCC4)C=CC=C5,1BB9C54D29E81C0E_31F54656B9F663F5_6041_UN,8.249426,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010011011010000100110100011000001011101100110001110100001011011001000010101111010,IYSQZZDUBQURDZ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@H]2[C@@H](C2)C3CCOCC3)F)[N]4C=CC=C4,73557E7C17370408_6BB908F6B5ECB408_6041_UN,8.165128,00000000000000000000001000000000000000000010000000000000010000100100000000010000001101110011000010101000000101000000001011100100110011110110001011011011010111101111110,VPRJSYDNAXZTSY-IRXDYDNUSA-N
N(C1CC2CCC(C1)O2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,9AF1F36FFC64BE73_7460B159404A740E_6038_UN,8.404684,00000000000000000001000000000000000000000010000000000000010000000100000000000000100100010001100011100100110100110010011011000100110011100100001011010011101111111111110,BAWAIDNZAMAWJQ-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,80CF964F922DB0A0_A715682275F3DA19_6041_DP,8.735478,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100110101110110001011011111010010101111010,DMXXBUCOYFPTIF-HHBDYARMSA-N
C1(=C(C=C(C=C1)C2CC2)F)N[C@H]3CCCC[C@H]3C4=CC=N[N]4C,163471C12F7DD40C_3494EC18A3269A24_7022_UN,7.738079,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010011011010000000100110010000001011101100110001110100001011011011000010101111010,HFHUWBUMJKZFFL-WBVHZDCISA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NC3CN(C)C4(C3)CCOCC4,7572EE9F0E800112_9E4496D85869DA26_7022_UN,8.035127,00000000000000000000000000000000000000000010000000001000010000000110000000010001100101110001011011101000110111011001101011101100110011110110001011011011010111101111110,GECSOQOOOWPVAY-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)N[C@H]3CCCC[C@H]3C4=CC=N[N]4C,6D671CDCE30796DF_C0541E15EB653B9B_7022_UN,7.738062,00000000000000000000001000000000000000000000000000001000000000100100000000010000100100010011011010000001100110010000001011101100110001110100001011011011000010101111010,JJXNJBYGGMPZEG-WBVHZDCISA-N
CN3CCCN(CC1=C(C=C(C=C1)NCCC2CCCNC2)F)CC3,DD27D04664A5708F_50181FF11E0260A9_6041_DP,7.955301,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010000101000100110010001101011100000110101110110001011011011010110101111010,LDCMWEUJWGEAGO-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCCC23CCNC3)F)CC4,755BF3445310C648_FEEDB0EB7B8A1037_6041_DP,7.630198,00000000000000000001000000000000000000000010000000000100000000000010000000010001101101110011010010001000110110011001101011100000110101110110001010011011010110101111010,PZMVUSXSJTVIJS-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CCOCC3)C4=CC=C(C=C4)F,BB2D5CB6F5CC1686_32266EC0C22642D7_6041_UN,7.9370475,00000000000000000000000000000000000000100010000000000000010000100110000000010100101101110011010010101000000111011001101011100100110011110110001001011011010111101111110,WBWSNEDTWMOKFN-FQEVSTJZSA-N
FC2=C1C=NC=CC1=C(C=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,D872F605C2885E24_6750E31294AE1736_6041_UN,8.765609,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,COZYUEORJNZGJX-QRQCRPRQSA-N
N1CCC5(CC1)CCC2=C(C=CC(=C2)NCC4=C(N3CCCN(C)CC3)C=CC(=C4)F)O5,C5E96023ED6E6A2B_C37F3BC01783CAC9_6041_DP,7.736937,00000000000000000001000000000000000000000010000000000000010000100010000000010001101001110001010001101100110110011101101011100100110111110110001011011011110111101111110,RXDZOWONSBVSLF-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC3CCCN3CC4=C(C=CC=C4)Cl)C5CCNCC5,5D9E65A6632F55D0_EC0295A22363E9A6_6034_UN,8.551979,00000000000000000000000000000000000000000000000000000000000000100100000000010001001101110001000010101101110100010000001011100100110000100110001011011011010110101111010,JZZROIMSAPOCNJ-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2OCCO2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,5CBE270E9BA5AD65_07D719C7DAEEB098_6041_UN,7.6020775,00000000000000000000000000000000000000000010000000000000010000100000000010010001000101110000010010101000000101010001101011110100110011110110001011011011010111111111110,GOJRRHXKMJOROF-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C(=O)CC3=C[NH]C4=C3C=C(C=C4)F,533489BF3390A329_51BDDB28C282F418_6038_UN,8.264234,00000000000000000001000000000000000000000010000000000000010000000100000000010001001101110011100110101100110100110000011011100100110110100110001001011001111111110111110,NALRTHTYSSHKTE-UHFFFAOYSA-N
NCC1=CC2=C(C=C1)C(=O)C=CN2CC3NCCC4=C3C=CC=C4,A581B14F1287127A_45AEDE5DA7D6F5C1_6034_UN,9.036834,00000000000000000000000000000000000000000000000000000000000000000100000000010001001011000001000001101100110000010100001011100101110100000110001111011001111110100111110,NBKOOESINNBHHZ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCC3(CC2)OCCO3)F)CC4,B4CEA73D86B0E882_F768E90E30569636_6041_UN,7.1274652,00000000000000000001000000000000000000000010000000000000010000000000000010010001100101110010010010001000110111011001101011110000110011110110001011011011110111111111110,MGPSVDONIGLLMJ-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NCC2C3(CCNC2)CCOCC3,13EA7559FDB5A377_EC948AAC52972E8C_7022_DP,7.6062207,00000000000000000000100000000010000000000000000000000100010000000010000000100000101000100011010000101000110001011000001011000000110111010110011001011101010111101111110,VRHGLCGAZWWXIM-UHFFFAOYSA-N
CC(NC(=O)CC1CC2CCC1O2)CC3=C[NH]C4=C3C=C(C(=C4)F)F,7D5F4AA9EECFA326_E036888EDF89528E_6038_UN,8.020982,00000000000000000000000000000000000000000010000000000000010000000100000000000000000100010011100010000100110110110001011011000100110110100100001011010011101111111111110,OLANKUKSTBGGGN-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CCNC3CCN(C)CC3)Cl,F8642FC5B930F894_E2A0DC3EA445933F_6034_UN,8.368731,00000000000000000000000000000000000010000000000100000000000000000100000000010111111101111011010010101001101110010001101111100100110101110110001011011111010110101111010,CNOYSCZSMYSNTL-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3C2(CNC2)SCC3)F)CC4,2FADDC5B94D44530_FC5303E973EC5DFB_6041_DP,7.342433,00000000100100000001000000000000000010000010000000000100000000000010000000010001111101111011010010001000110110011001101011100000110101110110001010011011010110101111010,LZNQRQPTDVGQBQ-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2CC2)NC[C@H]4[C@H](C3=NC=C[N]3C)OCC4,7667845AC2B5B903_6E62A4BA6BF6871C_6041_UN,8.232094,00000000000000000000001000000000000000100010000000000000010000100100000000010101001101010011010111001000000101000000001011100100110011110110001010011011110111101111110,ISGPEAUFAPPMFS-WMLDXEAASA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)N[C@@H]3C[C@H]3C4CCNCC4,2AE07BBF409B02C0_83925767AD4EEA4C_6041_DP,8.658145,00000000000000000000001000000000000000000010000000000000000000100100000000100000101000110011000000101100110100010000001011000100110101110110011011010111010010101111010,ZBXVQLNIQZWPFR-FUHWJXTLSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CCCC3=C2N=CC=C3)F,E96201215420D489_264AA955D600D968_7022_UN,7.704418,00000000000000000000000000000000000000000010000000000000000000000100000000100000101001110011010000101100010100000001001001100100110001110110001011011111010110101111010,MXRXSKVODNRVFA-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC34CC(C)(CC3)CO4,328870EE96411780_1339455D02EC55A6_6041_UN,7.4461455,00000000000000000000000000000000000000000010000000001000010000000110000000010000101100010011011110101100010111001001101011101100110011110110001001011101110111101111110,BYIWYWASEQMDCB-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CC=N2)NCC(N3CCOCC3)C4=CC=C(C=C4)F,B9174558BFC9608B_381C2FF60824C8AC_6041_UN,7.801943,00000000000000000000000000000000000000000010000000000000010000000100000000010001101101110001010110101100010101010000001011100100110011110110001001011001010111101111110,NMKSASCMDMYELL-UHFFFAOYSA-N
N5CC1=C(C=C(C=C1)NCC(N2CCN(C)CC2)C3=CC=C(C=C3)F)C4(CC4)C5,ABF02CCCE8584C65_555F246319F4B685_6041_DP,7.925883,00000000000000000000001000000000000000000010000000000000000000000010000000010001001001110011010000101100010100011001101011100100110101110110001011011001010110101111010,ZGFHUCMCROKMBG-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(C3=C(C=CC(=C3)C4=C[NH]N=C4C)F)=O,D75A6A887E685878_CC0408630BA9155F_6038_UN,8.51109,00000000000000000001000000000000000000000010000000001000010000100100010000000000101100010010101010101000010100100000011011001100110110100100001011010011111111111111110,ZLSPWLKOCWQOIY-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCCC3CCSC3,ED38380DF8901D7A_485E01EB20784735_6041_UN,7.8736186,00000000000000000000000000000000000010100000000000000000000000000100000000000100001100101001000010101100110010010000001011000100110001010110011011010111010110101111010,BFKYBTMMKUVNMC-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC3CCCN(C)C3C4=CC=CS4,5E1DCA79D6ED7807_DCBD5FF216DC933C_6041_UN,8.1678095,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011111010110101111010,ILIWVKUWWXZQMU-UHFFFAOYSA-N
CC1(C)O[C@@H]2CC[C@H]1C[C@H]2OC4=C3C=C(C=C(C3=NC=C4)F)F,4757D04D7F72C59E_A9AAC6D470167F9A_6035_UN,8.20056,00000000000000000000000000000000000000000010000000000000010000000110000010100000000000010000000001100100010110001100101011000111110010100100000101010100100011011111110,NBGHJQMVZRDACL-AMKSKSKJSA-N
C2(=C1OCCCOC1=CC=C2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,FD78742689C91941_DF24A564423F5F5F_7022_UN,8.299561,00000000000000000001000000000000000000000000000000000000010000100000000010010000101001110111010101101101010111010101101011100100110011110110001011011011110111111111110,VUVIHFHRKOFLPI-UHFFFAOYSA-N
N1CCC2(C1)CCN(CC2)C3=NC(=CN=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,74AF6387F5BEEDC7_0383302E4DA43DE1_6041_DP,8.591931,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101110011010010101000110110011001101011100100110101110110001001011011010010101111010,GPERBERFERUKGM-KNQAVFIVSA-N
C[N]1C=C(C(=N1)C2CC2)NC4(CC3=CC(=C(C=C3)F)C)CC4,D31F540EE9E6BE16_343BF8019FC24AED_6041_UN,8.603513,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100110011000001011101100010001110100001010011111000110101111010,XBSBFNDPVHEHGF-UHFFFAOYSA-N
CO[C@@H]1C[C@H](NC1)C2=NC=CN2CC4(CC3=CC=C(C=C3)F)CC4,4FAAA6FA9BF151F0_DBE99972638FBBC9_6034_UN,8.478168,00000000000000000000001000000000000000100010000000000000000000100110000000010101001101010011010111001000100100011000100011100111110010100110001110011011110111101111110,FDKGHMRSZKACRF-SJORKVTESA-N
CO[C@@H]1C[C@H](NC1)C2=NC=CN2CC4(CC3=CC=C(C=C3)Cl)CC4,CA45655CB7C52493_28874513121F4942_6034_UN,8.478165,00000000000000000000001000000000000000100000000000000000000000100110000000010101001101010011010111001001100100011000100011100111110010100110001110011011110111101111110,PPGXZXRXVKQMKP-SJORKVTESA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=N3)NC45CC(C4)(F)C5,5931D0D2F4685D00_D13A7F38EDDAF6EF_6041_DP,8.051969,00000000000100000001000001000000000000000010000000000000000000000110000000000100100101010011010010100000111100011000101011100000110101110100001001011001000010101111010,UCWQHYKVFIOCDF-ZFWVMRARSA-N
FC1=C(C=CC(=C1)C2OCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,6FF054384308665B_EB9D4EF4AB9A0652_6041_UN,8.728897,00000000000000000000000000000000000000000010000000000000010000100000000010010001100101110011010010001000100111010001101011110100000011110110001011011011010011111111110,FZHVALBBSUQNLP-MOPGFXCFSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CCCCC3)C4=CC(=CC=C4)F,DE57AB9664287E3D_9D374461E133663C_6041_UN,7.4389753,00000000000000000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100110001110100001011011011010110101111010,NKHWMXWXCMFFKB-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC[C@H]2CNCC(O2)(C)C)F)CC3,1A8FA3E99AFC397E_C5400E8F6109DFED_6041_DP,7.9559946,00000000000000000001000000000000000000000010000000000100010000000010000000110001101001110010010100101000000110011001101011100000110111110110011011011111110111101111110,XFUJZZWETQXZJN-GOSISDBHSA-N
FC1=C(C=CC=C1)C2=CN(C(=N2)C3CCCN3)C[C@]45CNC[C@H]4CN(C)CC5,2F4E8C3604E20A5E_752DF8C15D79C8DB_6034_UN,8.444054,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101110011010010101100110110011001101011100100110100100110001011011011010110101111010,XCFCERRBSHCJQF-WFSJFSNBSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,8A8614EF8060AC37_FB4F00ADF9FBB21C_6041_UN,8.353092,00000000000000000000000000000000000000000010000000000000010000100100000000010001101001110001010100101100010111010001101011100100110011110110001011011111110111101111110,HFHKIYUXLLGXKA-UNMCSNQZSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3CNCC34CNC4)Cl,FF4ED1CAB826D052_4FC34237EF0D6EB1_6034_DP,7.7919927,00000000100100000000000000000000000010000000000100000100000000000110000000010110111101111011000010001001011110001000000111100100110101110110001010001011010110101111010,SCYXHXMGBMBHQY-UHFFFAOYSA-N
CN(C)CC1=C(C=CC=C1)NC3=C2OCCCC2=CC(=C3)F,EB1F5575096F3BD4_5E86D7F40A081B6B_6041_UN,7.331948,00000000000000000000000000000000000000000010000000000000010000000000000000100000100001110011010100101100010101000101001000100100100011110110001011011111110111101111110,XVANFRBDJBFIMX-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(C3=C(C=C(CC)C=C3)F)=O,5B9E843730054EAD_7BF160D22943C861_6038_UN,8.435711,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010001100010001000110100110010011000000000110000100000000011010011011110101111110,OOEMJHVEAUFZOO-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NCC2C3(CCNC2)CCOCC3,179F52EDDA39C365_BE56E81724D5471F_6041_DP,7.596699,00000000000000000000100000000010000000000000000000000100010000000010000000100000101000100011010000101000110001011000001011000000110111010110011001011101010111101111110,DUKNUVHNCTWEDV-UHFFFAOYSA-N
N(C1C2CCC(CC1)CO2)C(=O)CC3=C[NH]C4=C3C=CC(=C4)F,63C5A90CE34367CB_A60A45E1EEA1689D_6038_UN,7.8154974,00000000000000000001000000000000000000000010000000000000010000000100000000000000000100010011100110100100110101110000011011000100110111100100001001010001111111110111110,AQRNJXZMZHZYLI-UHFFFAOYSA-N
C[N]2C=C1N=CC(=CC1=N2)NCC3(CCOCC3)C4=CC=C(C=C4)F,3CEE771756824FF9_5EC49BBD62FDA3B3_6041_UN,7.571123,00000000000000000000000000000000000000000010000000001000010000100110000000010001101100110011011010101100010101001000001011101100110011110110001001011001010111101111110,BMSBNWSSJJSGAK-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC(CC)NCC3=C(C=C(C=C3)Cl)Cl)C4=CCNCC4,92FC8EA63DEA773F_F419C530FD8BE16C_6034_UN,8.3210945,00000000000000000000000000000000000000000000000000100000000000100100000000011001001101110001000010111101110110010010101011100100110100100110001011011111010110101111010,FQKLBMSYUSKPPQ-UHFFFAOYSA-N
C1(=NC(=CC=C1)C2OCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,32587CBB36070F4A_950D866FFA75DFF7_6041_UN,8.913676,00000000000000000000000000000000000000100010000000000000010000100100000010010101100101110011010110101000100111010001101011110100000011110110001011011011010011111111110,STYICPWVNACKQZ-QAPCUYQASA-N
C[Si](C)(C)C#CC1=NC=C(C=C1)NCC2=CC=CC3=C2CCCN3,8D32F8CE5318ACBB_4525F40F0F23A281_6041_DP,8.300858,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100011010000101100110000011000001011000100110101010110011011011101010110101111010,FQBJOAZNFLLDPM-UHFFFAOYSA-N
CN(C)C4CCN(CC1=CC=C(C=C1)NCC2(CCNCC2)C3=C(C=NC=C3)F)C4,F1DDB1C7A0A8CAC7_65DFB3503737B238_6041_DP,8.417079,00000000000000000000000000000000000000000010000000000000000000100110000000110001101101110011010010101000100110011000101011100100110101110110001011011111010110101111010,HETQKKXHDLWMGA-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCCC2N3CCOCC3)Cl)C4CC4,28BD25B826F1432E_8D1CEF7BD491F560_7022_UN,7.755921,00000000000000000000001000000000000000000000000000000000010000100000000000010000101001110011000110101001000111010000001011100000110011110110001011011011010111101111110,BOZTTZJWPFUGSN-UHFFFAOYSA-N
O[C@H](CCl)C1=CC(=CC=C1)NCC2CC3CCC2N(C)C3,EE2ED9C76F168FDD_5849EE584C330EDC_6041_UN,8.473233,00000000000000000000000000000000000000000000000000000000000000000000000000010000101001100011010000101001110010010001101001100000110111110111001001011001110111101111110,YMRLNXYVWUYDPH-DCOKWODLSA-N
O[C@H](CF)C1=CC(=CC=C1)NCC2CC3CCC2N(C)C3,FF0DF6A19526163A_15E732D97BE8A58B_6041_UN,8.47324,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001100011010000101000110010010001101001100000110111110111001001011001110111101111110,NROYNTXFLPLCNY-DCOKWODLSA-N
C[N]1N=C(C=C1F)NC2C4CCC2CC3=C(C=CC=C3)C4,5B67D8F673D7FD39_FAF38E2008E72ED1_6041_UN,8.000104,00000000000000000001000000000000000000100010000000001000000000000100000000010101100100010011011010000100010100000000001011101100110001110100001010011011000010101111010,ZIZGIVXRTIHZBH-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C(CC)CCCC2)Cl)C3CC3,0144EF1DBB39F2AC_56C48674BD2EC4AE_7022_UN,7.7490253,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010011000000001001000110000010101000000000110001110000000011010111010110101111010,MKULNRNDCURQSX-UHFFFAOYSA-N
C2(=CC1=C(C(=CC=C1)F)O2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,312F3598F188A094_B6C833FF3CF74712_7022_UN,8.635349,00000000000000000000001000000000000000000010000000000000010000100100000000010101101101010011110010101100010100110000011011100100110001110110001011011011110110101111110,XEWNVRDVUFWWOI-QRWLVFNGSA-N
C[N]1C=C(C(=N1)C2CC2)NC4(CC3=C(C=CC=C3)F)CCCCC4,FCF2E82432C5A08A_C89F04FC572767BC_6041_UN,8.003018,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100110001110100001011011011000110101111010,NDZFAMQTXJOGOT-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C(C)C=CC(=C3F)Br,DF71B37C75F0EAD3_283CC5E563EDB48A_7019_UN,9.026375,00000000000100000000000000000000000000000010001000000000000000000010000000000000000000010000000000010000010100001000001000000000110000100000000011010010000000001011010,QXGOEKCWYZQEFW-UHFFFAOYSA-N
N4CCC1(CCC1)C(C=CC3=CC2=CC=CC(=C2O3)CC)C4,183157EAE3F9F045_2374558FBFE95A18_7019_DP,7.9063215,00000000000100000000000000000000000000000000000000000000010000000010000000000000001100100001000010111100110000011010001011000100110000000110000001010001110100101111110,KTFCMRVQORZVJM-UHFFFAOYSA-N
C(C1CC2CCC1O2)=CC3=C[N](C)N=C3C4=CC(=CC=C4)F,4E937D6E46F689A6_92454D9A19E1EE81_7019_UN,7.9094205,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010000011010010000010100000000001011101100110010100100001011011010100011101111110,OXCLAPMRICHZCC-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CCCCC3(C2)OCCO3)F,BFAD79AE790835BE_F14B8962EB9B5492_7022_UN,7.760487,00000000000000000001000000000000000000000010000000000000010000000000000010100000001101110011010010001000010101001001001010110000110011110110001010011111110111111111110,IYTHKMHROYVRKW-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NC2CNCC23CCOCC3,69EFA8D308833A6D_9A46F98320D338F7_6041_DP,7.822567,00000000000000000000000000000000000000000110000000000110010000000010000000000001101100110011000010101000110101011000001011000000110111110110001011010011010011101111110,QROHLTMRBJUCIT-UHFFFAOYSA-N
[NH]1C=C(C2=C1C=CC=C2C#N)NC4=C3OCCC(C3=CC=C4)=O,C1D13E33FE149FB9_529494FB251EC7FA_6041_DP,8.540091,00000000000000000000000000000000000000000100000000000110010000000100000000000001100100000101000110100100010001000100001011000101000111010100001111010001111011110111110,QCGXBXLNTMJGOG-UHFFFAOYSA-N
O[C@H](CCl)C1=CC(=CC=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,1A8DF98521CCAB60_058A59C1FEC09F61_6041_UN,9.255196,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101100001011110101001100011010001101011101100110111110111001001011111110111111111110,ITWIFTUMVPZBKJ-SQNIBIBYSA-N
C(C1CC2CCC1C2)=CC3=C[N](C)N=C3C4=CC(=CC=C4)F,79D148830220828A_D3C601E7B9365774_7019_UN,7.9877625,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010000010100000000001011101100110000100100001011011010000010101111010,TUYDFRKSJPTGKQ-UHFFFAOYSA-N
FC1=C(C(=CC=C1)CC#N)NC(C2CNC2)C3=CC=C(C=C3)F,54003D1904B64426_BCB615F4ACA1A3A7_6041_DP,7.6055584,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110010000000001000000100010000000001000100000101110110001011000011010110100111010,QYCIXPBVXQFXGE-UHFFFAOYSA-N
FC2=C1N=CC=CC1=CC=C2NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,80AEB8036763D338_9FACC72D77A8634D_6041_UN,8.700374,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,ZSUHTEZWGRWCSI-ZHRRBRCNSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3C(CCN3)C4CC4,C352815F67EA202B_CF52960F7CF4566A_6041_DP,8.259854,00000000000000000000001000000000000000100010000000000010000000100100000000000101001100010011000010101100110110010000001011000100110101110110001011010111010110101111010,SMBPQSDTVJWHLL-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2OCCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,86E9241BE7F86031_22445D6D96399FAA_6041_UN,8.000628,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110111010010101000100111010001101011110100100011110110001001011011010011111111110,IQNBDHCMRIDLMP-UXHICEINSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3CC4(CN3)CCC4,B8563284B405BE2B_E2764FEADBE7AEA7_6041_DP,7.489414,00000000000100000000000000000000000000100000000000001010000000100110000000010101101101000011011010001000110010011000001011101100110101010110001010011111010110101111010,GYUFCFFVICZUSC-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(C3=C[N](C)C4=C3C=C(C=C4)F)=O,09E03355553B1F3C_C7F5EBB740A555E2_6038_UN,8.082635,00000000000000000001000000000000000000000010000000000000010000000100000000010000101101010010110011101100010100100000011011100100110010100100001001011001111111111111110,TUDARCWVTZNDKE-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3CNCCC3)C[C@H]4[C@@H](CNC4)C5=CC=C(C=C5)Cl,5D347F632FEE5431_CAE588E411657AD7_6034_UN,8.13793,00000000000000000000000000000000000000100000000000000000000000100100000000010101101101110011000010101101110100010000001011100100110100100110001011011011010110101111010,OAEMNZDXOVVZHI-ZDZADGERSA-N
C(CC2COC1(CCCC1)O2)=CC3=C[N](C)C4=C3C=C(C=C4)F,101E56941E12AA91_EBAB38DF00248469_7019_UN,8.245652,00000000000000000000000000000000000000000010000000000000010000000100000010010000000101010000010010010100010101001000001011110100110010100100000000011000110111111111110,GJYSYLDEXNUSAY-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2OCCCNC2)F)CC3,FC4D05E5860B5231_C24D250100083EBD_6041_DP,7.4416175,00000000000000000001000000000000000000000010000000000100010000000000000000010001101001110011010101001000100111010001101011100000110111110110001010011011110111101111110,HLKPTRARCQOKPG-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)F)F,0E8D42F7CDC08EF3_B9D380F7506D32A2_7022_UN,8.628648,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011111010110101111010,LHYLDYSIGSYJTP-VLIAUNLRSA-N
C[N]1N=CC(=C1F)NC2C4=C(C3CCC2C3)C=CC=C4,08DD61BEF591DD6F_9B763DB5D500797F_6041_UN,9.086778,00000000000000000001000000000000000000000010000000001000000000000100000000010001100100010011011010000100010100000000001011101100010001110100001011011011000010101111010,VPLZTWOATSTCLF-UHFFFAOYSA-N
N(C1=CC=C(C=C1)CCF)C(C2C3CCCC2CN3)=O,056C464E5FD18EBA_0F3B250A0914657E_6038_DP,8.399184,00000000000000000001000000000000000000000010000000000100000000000000000000000000101100000011100011001000110000110000011001000000110101110110001001010001011110100111110,WFEYCYRBOCDEPN-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCCC3(CC2)OCCO3)F)CC4,CB869AFEAACF9E0B_DFDAA8DCE8E9594E_6041_UN,7.0530834,00000000000000000001000000000000000000000010000000000000010000000000000010010001100101110011010010001000110111011001101011110000110011110110001010011011110111111111110,WDMJMOWSRMDKCD-UHFFFAOYSA-N
N(CC1CC2CCC(C1)S2)C(=O)C[N]3C=CC4=C3C=C(C=C4)F,A1CA93F47F0504D5_AE07EA8ABBA5B248_6038_UN,8.056096,00000000000000000001000000000000000010000010000000000000000000000100000000010001011101011010100110101100110100110000011011100100110010100110001001011001011110100111110,QVNAXYFZPMJSKY-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2C4(CC3=C2C=CC=C3)CCOCC4,BF649757595C4239_0E866E98440897DC_6041_UN,7.585996,00000000000000000000100000000010000000000000000000000000010000000110000000100001000000100011010010100100010001001000001011000100110011010110011011011111010011101111110,MJPIVODFJCENPB-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NC[C@H]3CNCC(O3)(C)C,E8515BCD83A50E68_AA9FA08CC7466DD7_7022_DP,8.180459,00000000000000000000000000000000000000000010000000001100010000000110000000110000101100110010001110101000000110011001000011101100100111110110001011001111110111101111110,OBETYAXJUJFZLP-OAHLLOKOSA-N
C[N]1C2=C(C=N1)N=CC(=C2)NC3=C(C=C(C=C3)C46CC5CC(CC(C4)C5)C6)Cl,5EE8E17C61E28B4E_DA0054B0D947C039_7022_UN,7.9178333,00000000000000000000000000000000000000000000000000001000000000100110000000010001100100010000011010100101010100001000000011101100100001110100001011001011000010101111010,MKNDESUQTDUXTO-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,CA9A729F87F8A9A0_B1B171951145549E_6041_UN,8.539365,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101100010110010001101011100100110001110110001011011011010110101111010,MOPKGRYJKQXBIU-YWZLYKJASA-N
C2(=CC1=C(C=CC=C1F)S2)NCCC3CC(C)CC(C3)(C)C,070CCB6D6124D035_913347C2179A7246_7022_UN,8.008987,00000000000000000000000000000000000010000010000100000000000000000010000000100000011100011001000010001100110110011001001000000100110001110100010001010101010110101111010,GJYMWTFYJOBWDM-UHFFFAOYSA-N
N4CCC1=C(C=C(S1)NC2=CC(=C(C=C2)N3CCCCCCC3)F)C4,89F0E0D480632A4F_EC4C25C926BCD133_6041_DP,7.5401583,00000000000000000000000000000000000010000010000100000000000000100000000000010000011101111001000010101100110100010000001011100100110101110110001011011011010010100111010,PCWPVOFHRCPOAP-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)OCCC2)C(C4=CC3=C(C=C[N]3C)C=C4)=O,436EE9C31FB78340_DB5BD4F048172969_6038_UN,9.003186,00000000000000000000000000000000000000000000000000000000010000000100000000010000000101000001110010100100010001100100011011100100100011010100001011011001111011111111110,VQUAWUCZXWOPTI-UHFFFAOYSA-N
CCC1=C(C(=CC=C1)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,C299913B5E5CF5D1_2EA4433773D47EF1_6041_UN,7.982068,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010010001011101100110001110110001011011111010110101111010,AUELZWJZCNTIPJ-IERDGZPVSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC4=CC(=C(C=C4)N5CCCCCCC5)F,666C5504FBC81B37_2DAE900BC07A4D4E_6041_DP,7.5936007,00000000000000000000000000000000000000100010000000000000000000100100000000010101100101110011000010101100110100010000001011100100110101110110001011011011010010100111010,GBSVIXLAADDUFP-JKSBSHDWSA-N
C2(=C1[N](N=CC1=CC=C2)C3CCCCO3)NC4=CN=C([Si](C)(C)C)C=C4,0E7E6DEE1706E738_29117D79688F6FB8_6041_UN,7.620419,00000000000000000000100000000010000000000000000000001000010000100100000000110001100100100000111110100100010001111000011011101100110011010100011001011101010011101111110,ACMZRXGVSZXLOR-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)N[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)F)F,31679CD8C7F9539F_1939C1D8D1DCEF17_6041_DP,8.573548,00000000000000000001000000000000000000100010000000000000010000100100000000000101100101010011010111100000110101010000101011100100110111110100001011011011110011101111110,WSIQDHNNTNQSGV-NVOMTMBPSA-N
CC1CCC2=C(C1)SC3=C2C(=NC(=N3)C)C4=CC=C(C=C4)CC5CC5,5468E50F281E8F89_E879A57D09529510_6006_UN,8.309949,00000000000000000000001000000000000010100000000100000000000000100100000000000100110100001000000010100100010000000001101011000100110000000100001011010100000110001111010,WDKKDAORTFPBDC-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CCC23CNC3)F,5CD44F24E7EA7FA7_FE26E1537927461C_7022_DP,7.7475147,00000000100100000000000000000000000000000010000000000000000000000010000000100000001001110011010000001000010100001001001001100000110101110110001010011111010110101111010,DUSQMSHKQDSURA-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)CCC2)N[C@H]4[C@H](C3=NC=C[N]3C)OCCC4,61606D3EE195B197_626B9858A3CEB9DF_6041_UN,7.9493814,00000000000000000000000000000000000000100010000000000000010000100100000000010101100101010011010110100100110101010000001011100100110011110100001011011011110011101111110,DGJTVUFCWCZIEM-NVXWUHKLSA-N
FC1=C(C=CC(=C1)CC#N)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F,2D6E1C31884B47DF_507806D755D3FF64_6041_DP,7.9293056,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,GETKFPHLWSFUCP-AUUYWEPGSA-N
O([C@@H]1COC[C@H]1N2CCOCC2)CCC3CCN(C)CC3,35A2F5EE773B0ABE_8EBE046763E75001_6039_UN,7.3500085,00000000000000000000000000000000000000000000000000000000010000100000000010010000000101100100010111101000000001010001101011100011110011000110001101111010110111111101110,VVLXPQUFCMHJHB-HZPDHXFCSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC3(COCC3)CC=C,BAB1C7830B69E70A_A523DB6BB0DE978F_6041_UN,8.368831,00000000000000000000000000000000001000100010000000000000010000000110000000000100000100110011000111110100110101011000001011000100110011110110001011010111010111101111110,ULMMYPSKIPCMFY-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)NC3=CC=CC(=C3)CC4CCCN(C)C4,FEBC10EF5A901293_01D8820E7AEDFB61_6041_UN,7.5203815,00000000000000000000000000000000000000000010000000000000000000000000000000010000000001110001010010101100010110010001101001100100110001110110001011011011010110101111010,YCVPLUSGBJTNNF-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC3CC2(CNC2)C3)F,D0B03E536E5B9FB7_4207407D681DA099_7022_DP,7.4279675,00000000100100000000000000000000000000000010000000000000000000000010000000100000001001110011010000001000010100001001000001100000100101110110001010001111010110101111010,QWTCCJRJYHQYND-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CC3)C4CCOCC4,88171A89D7CA5268_38F27743F8CE1210_6041_UN,8.0912895,00000000000000000000001000000000000000000010000000001000010000100110000000010000101100110011011010101100010101001000001011101100110011110110001001011001010111101111110,YONUCKUGDLREDO-UHFFFAOYSA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=N3)CC(C)(N)CC4=CC=C(C=C4)Cl,D3A7EFEF9C415D5F_C08EC0D3CAC72BEE_6034_UN,7.9245677,00000000000000000000000000000000000000100000000000000000000000100110000000010101001111110011000010101101110100011001001011100100110100100110001001011001010110101111010,JALLFQKORIAJNX-UHFFFAOYSA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=N3)CC(C)(N)CC4=CC=C(C=C4)F,F6250D49954DF174_D1A34E2E06206DCE_6034_UN,7.924565,00000000000000000000000000000000000000100010000000000000000000100110000000010101001111110011000010101100110100011001001011100100110100100110001001011001010110101111010,INFBMCIHLXUBSQ-UHFFFAOYSA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=N3)CC(C)(N)CC4=CC=C(C=C4)Br,AC82DB659FA0FB94_30157E26110680BA_6034_UN,7.924547,00000000000000000000000000000000000000100000001000000000000000100110000000010101001111110011000010101100110100011001001011100100110100100110001001011001010110101111010,YOZPDLICMNHUKJ-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CCOCC3)C4=CC=C(C=C4)F,8BFBFA1897772C45_ADE708F42FDE917A_6041_UN,7.9663877,00000000000000000000000000000000000000100010000000000000010000100110000000010100101101110011010010101000000111011001101011100100110011110110001011011011010111101111110,HEDITGIAGHVJNF-FQEVSTJZSA-N
FC1=C(C=CC(=C1)NC[C@H]3[C@H](C2=CC=N[N]2C)C3)OC4CCOCC4,C160B7EECE004C20_3749EFB088918BCD_6041_UN,8.223616,00000000000000000000001000000000000000000010000000001000010000100100000000010000101100110111011010101000000111000100001011101111110011110110001111011011110111111111110,IJGUVVKXGHWGON-XJKSGUPXSA-N
FC1=C(C(=C(C=C1)C2OCCO2)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F)C#N,7BA816F87D76124D_3E56DD1607B81B3F_6041_DP,8.016483,00000000000000000000000000000000000000000110000000000010010000100000000010000001101100110011000011101000100101010000001011010100110111110110001011010011010011110111110,ILLHWMASSFYROH-BFUOFWGJSA-N
CC1=C(C=C(C(=C1)NCCC2CC(C)CC2)Cl)C3CC3,5D3F6CC3C1A4B2A2_BD68D9BF2FBDBAFA_7022_UN,7.9806404,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010001000010001001100110010001101000000000110001110000000010010111010110101111010,YQLBQXKZVIWJRR-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCNC(C3)(C)C,0EC7145FFF6D9EDA_8881EDE9B185D530_6041_DP,8.273911,00000000000000000000000000000000000000100010000000000000000000000110000000100100001000010011000000101100110110011001101011000100110101110110011011010111010110101111010,VQDPSOVHQKDFDP-UHFFFAOYSA-N
N4CC1=C(C=C(C=C1)NC2=CN=C([Si](C)(C)C)C=C2)C3(CC3)C4,7973F9F52C91ED54_6B4AE10D7016ED62_6041_DP,7.0747876,00000000000000000000101000000010000000000000000000000000000000000110000000100001001000100011010000101100010000001000000011000100110101010110011011011101010010101111010,RMTLHMVFARLGJL-UHFFFAOYSA-N
N(CC1CC2CCC(C1)S2)C(=O)CC3=C[NH]C4=C3C=CC(=C4)F,E95BA6265F7DCA3C_7055AAB5EE10EA8B_6038_UN,7.967351,00000000000000000001000000000000000010000010000000000000000000000100000000000000011100011011100010101100110100110000011011000100110110100100001001010001011110100111110,IKJKCBTZDKJFDA-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C(Cl)[N](C(=N3)N(C)C)C4=CC=C(C=C4)C,1D14DD2DF8EB393C_4D19DA2045FA125D_7019_UN,7.418006,00000000000100000000000001000000000000000000000000000000000000100110000000110101000101110000010010010001011100001000001011100100110001110100011011011110000010101111010,HYROFJCKLBWPSC-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,DF9ED5455D0AE3F9_B4861BBF1D701395_6038_UN,7.749091,00000000000000000000000000000000000000000010000000000000010000100000000000000000001100010111100011011000010101100000011000000000110010100110000011010011111111110111110,VEHQWIPDRQGBPV-RULJEDMHSA-N
C(=CC1=CC(=CC(=C1)F)F)NCC23COC(C)(CC2)C3,C9B458E16FB62A38_57B0B74FECBFD6C2_7022_UN,7.4338155,00000000000000000000000000000000000000000010010000000000010000000010000000000000001100010011000011111000010111001001101000000000110010100110000001010001110101101111110,NHMKBPVBRCUXKO-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)Cl)F,E9CF9B10F08B3637_D713FA9D1895EA10_6038_UN,7.749071,00000000000000000000000000000000000000000010000000000000010000100000000000000000001100010111100011011001010101100000011000000000110010100110000011010011111111110111110,SSQGPTLHEYLLQI-RULJEDMHSA-N
C1(=CC2=C(N=C1)C(=CC=C2)F)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,1606310A6E7FE956_1E986B56C4231904_7022_UN,8.74508,00000000000000000000000000000000000000000010000000000000000000100100000000010001101001110011010000101101010110010001101011100100110001110110001001011011010110101111010,FCGUPMQREWPQGP-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F,1052A6CB72A38E18_6A49C93B8010CFF0_7022_DP,8.256662,00000000000000000000001000000000000000000110000000000010000000100010000000000001001000110011000000101000100100011000001001000100110101110110001011010011010010100111010,SJKIAYHVNWGWHY-FOIQADDNSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3=C(C=CC(=C3)C4CC4)F,AAC263B3F5B4D635_12A3E37BE6EBA736_6041_UN,7.759427,00000000000000000000001000000000000000100010000000000000000000100100000000010100101101110000010010101000000110010001101011100100010001110110001011011011010110101111010,DXQMJVDWGCOZGU-IBGZPJMESA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC4=C(C=C(C=C4)N5CCCCC5)F,FE88B9C8A92FBD5A_2779144A7BAD7EC8_6041_DP,7.4695206,00000000000000000000000000000000000000100010000000000000000000100100000000010101100101110011000010101000110100010000001011100100110101110110001011011011010010100111010,BVFNRRQPRPBGNV-MDOVXXIYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC3CC4(CN3)CC4,0C61DCF3BCE03EF7_9416E194853607B4_6041_DP,7.93532,00000000000000000000001000000000000000100000000000001010000000100110000000010101101100000011011010001000110010011000000011101100110101010110001010011111010110101111010,KDGLKBDAILZYIZ-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4,3E0251B02DBCE2EB_F31482E9ED626378_6041_UN,8.357043,00000000000000000000000000000000000000000010000000000000000000100100000000010001101001110011010000101100010110010001101011100100110001110110001011011111010110101111010,AIGOYXIJGCOWJP-CVDCTZTESA-N
N1CC3(C1)OC4(COC2=C(C(=CC=C2)C(F)F)F)CC3(N)C4,5228015D972744B4_F7B2DFE739E5A13E_6035_DP,8.340239,00000000100100000000000000000000000000000010000000000100010000000010000010000000101110110011000111001000110101011100000011000011110111100110001110000011110111110111110,HVOQTGNPENHQPS-UHFFFAOYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC5=CC(=C(C4=CC=N[N]4C)C=C5)F,4BDF74D985EA840F_DD5C40308A04F7CD_6041_DP,8.092504,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011011010100000110100010000001011101100010101110100001011011011000010101111010,CVMATFVNROGWSV-QUJCMNEKSA-N
O(C3CCN(CC1CCCC2=C1C=CC=C2)CC3)CC4=N[N](C(CC)CC)C=C4,483F17936618F3AC_A53796456CD492F9_6039_UN,8.149036,00000000000000000000000000000000000000000000000000001000000000000100000000010000100101100000001111101100010001010010101011101111110010000110001111011100110111101111110,NGIJCPKVERHXPM-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CC2(CCCN(C)C2)C)C=CC(=C3)Cl)C4,E9EC000C43924A56_7577E07A0F3CFFFF_6034_UN,7.541502,00000000000000000000000000000000000000000000000000000000000000000110000000010000101101110010010010101101110110011011101011100100110001100110011011011101010110101111010,UYTGUOVBSORYFI-UHFFFAOYSA-N
CC1=NC(=C(C)[N]1C)NCC2(CCCCC2)N3CCCCC3,4D7F920E0AD86DE8_C1BE529ED511C3BC_6041_UN,7.2083764,00000000000000000000000000000000000000100000000000000000000000100110000000010101101101100011010010101000000010011000001011100000110001010110011011011111010110101111010,OBGMRLVBQGWZFG-UHFFFAOYSA-N
CC1=C(C=CC=C1NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)[N+]#[C-],224F79DB7B3F0A4E_69E73391251AF414_6041_DP,7.3681335,00000000000000000000000000000000000000000110000001000100000000100000000000000000101000110011000000101000100110010000001001000100110101110110001011010011010110101111010,OBDGBSHBQOGHCD-FUHWJXTLSA-N
C4CC1=C(C3=C(N1CC2(C)CCCNC2)C=CC=C3)C4,9BE90E19E0CE2407_7770EDE3C684E527_6034_UN,8.268254,00000000000000000000000000000000000000000000000000000000000000000110000000010000101101100011000010101100110010011001101011100100110000000110001011011001010110101111010,VLOYAJONZQTUNJ-UHFFFAOYSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F)C5,0B9F89BB2E28A4D4_BC6EF81FCA0D7B8A_6041_UN,7.317645,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011010011101100110101010001101011100100110111110110001011011011110111101111110,QCYPXPHYIOJXTM-HJPURHCSSA-N
CC1=CC(=C(C=C1)Cl)NCC2=NC=C[N]2C[C@@H]3C[C@H]3C4CCNC4,429F568D71692DDC_F9055D3B130355EC_6034_DP,8.451981,00000000000000000000001000000000000000100000000000000000000000100100000000010101001101110011000010001001100100010000001011100100110101110110001010011011010110101111010,QYWBHMYIUXHAJB-YVZMLIKISA-N
CN(CC1=NC=C(N=C1)N[C@@H]2C3=C(OCC2)C(=CC=C3F)F)[C@H]4C[C@@H]5CC[C@H](C4)N5,475CD16AC39D4F95_B7B0D7DBAD941BD0_6041_DP,8.429745,00000000000000000001000000000000000000100010000000000000010000000100000000000101100101110011010011101100110101010101101011100100110111110110001011011001110111101111110,CVDXVUQKHMKFQK-MVWRLGRASA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3C(CCC3)C4CC4,63BA5EF4EFF0A222_9571C48575DB3D56_6041_UN,8.150173,00000000000000000000001000000000000000100000000000000000000000100100000000000100001000000011000010101100010010000000001001000100110001010100011011010111010110101111010,VTEKLGPBHCGWSR-UHFFFAOYSA-N
N1CC(C1)(C#N)C2=NC=C(C=C2)N[C@H]3[C@@H](C3)C4=CC(=C(C=C4)F)F,FB50B024A92922B8_609E56A0682A08E3_6041_DP,7.680369,00000000100100000000001000000000000000000110000000000000000000100110000000000001101000110010000000101000100100011000000011000100000101110110001011000011010010100111010,AGGCKZLHKLMVOS-XJKSGUPXSA-N
N1CCC(CC1)C2=C[N](C3=C2N=CC=C3)CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,DD2081DAB68BB73C_2E00D6F1856787C6_6034_DP,8.895991,00000000000000000000000000000000000000000000000000000000000000100100000000010001101101110001000010101101110110010010101011100100110100100110001011011011010110101111010,MBHNALDZWOUZLI-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,0701C7F795B5C07F_6B7055525248734B_6041_UN,7.7194986,00000000000000000000000000000000000000000010000000000000010000100000000010010001000101110000010010101000000101010001101011110100110011110110001011011011010111111111110,HDOLWYGEMAPSCV-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4C(C)OC5=C4C=CC(=C5)F,982538C2A0622B76_C7060F92C88EF49D_6041_DP,8.473159,00000000000000000001000001000000000000100010000000000000010000000100000000000100100101010011010111100100111100010100101011100100110101110100001011011111100011101111110,IEDFOXZGCBNOKH-OSPAXJJLSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NCC(C3CCNCC3)F)C,8B4B353908FF478C_2EA98CDD1BBE7861_6041_DP,8.771,00000000000000000000000000000000000000000010000000000100000000000100000000000000101100100001000010101100110100010000001011000100110101110110001011010111010110101111010,MDURGIKAESHWBM-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3C(CCC3)C4=CC=CC=C4,AB26724F66A3D74C_404D939E1DF1CAB2_6041_UN,7.9484115,00000000000000000000000000000000000000000010000000001000000000100100000000010000101100010011011010001100010100000000001011101100110001110100001001011011010110101111010,KVRMCISZSSLHQZ-UHFFFAOYSA-N
FC1=C(C(=CN=C1)NCC[C@@H]2CC[C@H]3C[C@@H]2C3(C)C)F,363F77A837221BE8_5BD62033E4033045_6041_UN,8.667592,00000000000100000000000000000000000000000010000000000000000000000110000000100001001000010001000000101000110110011000101001000000110001110100001011010111010110101111010,GSNGQFIPLCVAGX-SRVKXCTJSA-N
C(=CC1=CC(=CC(=C1)F)F)NCC(CC)C2CCOCC2,3F1724B6FD674E81_B07C4C5838EFA4CE_7022_UN,8.467521,00000000000000000000000000000000000000000010010000000000010000000000000000000000001000110011000000111000000111000010101000000000110010100110000001010001010101101111110,QRFGMPWYTWNARD-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,848A28D2F87BFFFE_53689ACE3EBEBE35_6041_UN,8.290246,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011111010110101111010,QNABXBVVUSQHFI-HXOBKFHXSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3C(CCN3)C4CC4)Cl,CFB22AFFABD296C8_100A68D010981D5D_6034_DP,7.659852,00000000000000000000001000000000000010000000000100000000000000100100000000010111011101011011000010001001101100010000001111100100110101110110001010011011010110101111010,YHJZBLBYKYIAGR-UHFFFAOYSA-N
CN5CCCN(CC1=C(C=C(C=C1)NC2CC3CC2C4CCCC34)F)CC5,FE6561B36BD0065C_DAC75A5D7664F0DA_6041_UN,8.218079,00000000000000000001000000000000000000000010000000000000000000000000000000010001100001110011010010001100110110010001101011100000110001110110001011011011010110101111010,DGIGOCNWRQOEJL-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,B407BA20E4DC5CEA_696C8F58ECF5737A_7022_DP,8.008485,00000000000000000000000000000000000000000110000000000100000000100100000000010101101101110011010010001001000110000000000011100100110101110110001010001011010110101111010,XFYFCGSXSNMAAZ-CMPLNLGQSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC4C(C)OC5=C4C=CC(=C5)F,B6BFA7F46ECD7207_B92FA4971F09A998_6041_DP,8.561201,00000000000000000001000000000000000000100010000000000000010000000100000000000101100101010011010111100100110100010100101011100100110101110100001011011111100011101111110,YHXJSLNYXWCHHS-RPWHCWMQSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2(C)CCC3(CC2)OCCO3)F)CC4,1E77E9955B6BC4EC_0877724E1C12836C_6041_UN,7.3007784,00000000000000000001000000000000000000000010000000000000010000000010000010010001100101110010010010001000110111011001101011110000110011110110001011011111110111111111110,WNJOWGNCVNMUQD-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CC=N2)NCC(N3CCOCC3)C4=C(C=CC=C4)F,964CB85EA772F746_A037F46972310F90_6041_UN,7.8875723,00000000000000000000000000000000000000000010000000000000010000000100000000010001101101110001010110101100010101010000001011100100110011110110001011011011010111101111110,MNOCOUFWHJPYIS-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CC=N2)NCC3(C)CCC4(CC3)CC4,CBB9A37444C5BF21_C403B5CBAD2BE763_6041_UN,7.421148,00000000000000000000001000000000000000000000000000000000000000000110000000010001101101000011010010101100010000001001101011100100110001010100001001011101010110101111010,PBZQFCVYQVRUIA-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCCC2CCCC(C)C2)F)CC3,E1DC98A4BFF3935F_0B951E87E4A01485_6041_UN,7.9923124,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110001010000001000100110010001101011100000110001110110001011011111010110101111010,DSGVSERQJQLMKO-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)F)NCC23COC(C)(C2)CCC3)F,72C8DBE10B05729F_083E8084F39E42FC_6041_UN,8.4712105,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100010011000011001000010111001001101000000000110011110110000011010111110111101111110,UIEQSRZNIRSYQE-UHFFFAOYSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3(C)CCC4(CC3)CC4)C5,943780F16229C674_A7B492EFCD6C74C0_6041_UN,7.684554,00000000000000000000001000000000000000000000000000000000000000000110000000010000101101100011010010101100110000011001101011100100110101010110001011011101010110101111010,WVUAWQUGPQOQAC-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC=C2NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,CEDA62FE407A82A6_946721F0122D51EF_6041_UN,8.702261,00000000000000000000001000000000000000000010000000000100000000100100000000010101101101010011010010101100010100010000001011100100110101110110001011011011010110101111010,DFDLZNGBYTZBMG-VFNWGFHPSA-N
FC2=C1SC=C(C1=CC=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,67C4B24419EB7F67_CF582393D1959B4F_6041_UN,8.6533,00000000000000000000001000000000000010000010000000000000000000100100000000010101111101011011010010101100010100010000001011100100110001110110001011011011010110101111010,GDFSDFZHTXTKGR-VLIAUNLRSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CCNCC3)C4=C(C=NC=C4)F,50A3C5F65BBEA2B2_54113B4C15B4627D_6041_DP,8.349832,00000000000000000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000100110011001101011100100110101110110001011011011010110101111010,VEMXVGROAJGIHM-IBGZPJMESA-N
CC1=C(C=C(C(=C1)NCC2(C)CCC3(CC2)CC3)Cl)C4CC4,C060FF67C679274C_9B5765E8361AE379_7022_UN,7.8537416,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010011000000001001010110001001101000000000110001110000000011010111010110101111010,QXUVMJSHAQINIU-UHFFFAOYSA-N
FC2=C(C=C1C=COC1=C2)NCCC4CCN(C3CCN(C)CC3)CC4,7822C737845CBBDA_C990655B56529BE9_6041_UN,7.7210884,00000000000000000000000000000000000000000010000000000000010000100000000000010000101101110001010010101100110100010001101011100100110001110110001011011011110110101111110,YJTOXVOVRQMFJL-UHFFFAOYSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)N[C@@H]4CCN(C)[C@H]4C5=CC=CC=C5,AB8BC03C95CB9598_70625C582F907629_6041_UN,7.9543886,00000000000000000000000000000000000000100010000000000000010000100100000000010101100101110011010010101100110111010001101011100100110011110110001001011011010011101111110,TXNXPDVJLGDWAL-IRLDBZIGSA-N
CC1=C(C=C(C(=C1)NCC2N(C)CC3(CC2)CCC3)F)[N]4C=CC=C4,28080512A8278908_611CE608B5222995_6041_UN,7.7602816,00000000000100000000000000000000000000000010000000000000000000100110000000010001001101110011010010101000010110011001101011100100110001110110001011011111010110101111010,TVKXLJONTXBSGV-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@H]2[C@H](CCCC2)N3CCOCC3)F)[N]4C=CC=C4,77B67091ED5B7539_AC8C61C04B307D57_6041_UN,8.055963,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011000110101000000101010000001011100100110011110110001011011011010111101111110,ONGTZKUWJQXPQD-RXVVDRJESA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CCC2(CCCN2)C3)F)CC4,2027E4CB41B0DE7D_1D42FF3BEFFDA596_6041_DP,7.5404134,00000000000000000001000000000000000000000010000000000100000000000010000000010001101101110011010010001000110110011001101011100000110101110110001010011011010110101111010,XDRTZAHPXRTQJS-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)N[C@H]2[C@@H](OCC2)C3=CC=N[N]3CC4CC4,66D122A5A29F42FA_294BC41417A959B6_7022_UN,8.440854,00000000000000000000001000000000000000000000000000001000010000100100000000010000100100010011001111001001100101010000001011101100010011110110001010011011110111101111110,VGWRVQMMUXZWQU-SJLPKXTDSA-N
CC1=C(C=CC=C1Br)N[C@H]2[C@@H](OCC2)C3=CC=N[N]3CC4CC4,8A5FA05E89951096_F5489608BEE7CD84_7022_UN,8.440855,00000000000000000000001000000000000000000000001000001000010000100100000000010000100100010011001111001000100101010000001011101100010011110110001010011011110111101111110,GQBGVSZVAYUPFJ-SJLPKXTDSA-N
CC1=C(C=CC=C1F)N[C@H]2[C@@H](OCC2)C3=CC=N[N]3CC4CC4,AD183A67E9A21578_F8E0CFBF0175A794_6041_UN,8.440832,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011001111001000100101010000001011101100010011110110001010011011110111101111110,KGEMJSCKWHAXGX-SJLPKXTDSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CCNC3CCN(C)CC3)Cl,9F9AB43309459975_07817D9036EA0194_6034_UN,8.28076,00000000000000000000000000000000000010000000000100000000000000000100000000010111111101111011010010101001101100010001101111100100110101110110001011011111010110101111010,WCSGJNFLEKRGCV-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC[C@@]2(CCCN2)C)F)CC3,0665C4B61908B8C4_DA47852C3CA6DEB5_6041_DP,7.714783,00000000000000000001000000000000000000000010000000000010000000000010000000010001101101110011010010001000100110011001101011100000110101110110001010011111010110101111010,AZMISENWDGSORX-IBGZPJMESA-N
BrC1=CC2=C(C=C1)N(C=C2C3CC3)CC4(CC)CCCN4,4AF48E2589DE5CC0_EC5B2FE995274E8C_6034_UN,8.3982,00000000000000000000001000000000000000000000001000000000000000100110000000010001001101010011000010001100110110011010101011100100110000100110001000011001010110101111010,KQTDMFWIWUJWEK-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3C4CCCC3CCC4,F998CC702B13BD24_60DE176F7B7E1E7B_6041_UN,8.522554,00000000000000000000000000000000000000000010000000001000000000000100000000010000100100010011011010000100010100000000001011101100110001110100001001011001000010101111010,RFXFUIWVBBCGDD-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)N[C@H]4[C@H](C3=CC=N[N]3C)OCC4,04C285A116A88768_94765ECEF9577510_6041_UN,8.21349,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111000100110101010000001011101100010011110100001010011011110011101111110,KSIJCRNGHSVXPW-RHSMWYFYSA-N
CC4=NC1=C(C=C(C(=C1)NCC2CCCN(C)C2C3=CC=CS3)F)[NH]4,7B7B42E1DC5FD77C_2E906E75F0DEEAAB_6041_UN,8.408696,00000000000000000000000000000000000010100010000000000000000000100100000000010101111101111011010010101100010110010001101011100100110101110110001011011111010110101111010,CPOCRZXOLCPRJY-UHFFFAOYSA-N
CCC4CCC1=C(C3=C([N]1CCC2CCCNCC2)C=CC(=C3)C)C4,CF38FFA490A4585B_74545ED0410D4442_6034_DP,8.820865,00000000000000000001000000000000000000000000000000000000000000000100000000010000001101100011000010001100110010010010101011100100110000000110001011011101010110101111010,HEUZNBRCDVLQNW-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CCC2CCCNCC2)C=CC(=C3)C)C4,CF38FFA490A4585B_BDA44203D9FBB5D8_6034_UN,8.820859,00000000000000000001000000000000000000000000000000000000000000000100000000010000001101100011000010001100110010010010101011100100110000000110001011011101010110101111010,HEUZNBRCDVLQNW-UHFFFAOYSA-N
FC2=C(C=C1C=CC=NC1=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,5AF83F7823FCB7B5_A850B70C19E3E9AB_6041_UN,8.550191,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,JBYVWIHSBYGPSL-ZHRRBRCNSA-N
CC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]4N[C@@H]5CC[C@H]4C5,0EA39E072D083DC1_FDA88D6497E8AD83_6034_UN,8.341076,00000000000000000000000000000000000000100000000000000000000000100100000000010101001101000011000010101000110000010000001011100100110100000110001011011011010110101111010,MPXFNSQAZSVVIB-GISIPNDBSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC3CC4(SCC3)CCC4,72A2581CB62B582E_3CFC31F77128921F_6041_UN,8.0246525,00000000000100000000000000000000000010000010000000000000000000000110000000100000110000011011000000100100110100011000001011000100110001110100011011010111010010101111010,GTTDTPVAFVKWFU-UHFFFAOYSA-N
C1CNCC(C1)C3=CC2=C(C=CC=C2)N3CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,0BD074D06959C208_F6CA0653D135D029_6034_UN,8.659316,00000000000000000000000000000000000000000000000000000000000000100100000000010001101101110011000010101101110110010010101011100100110100100110001011011011010110101111010,IQGNLINTRARQIH-UHFFFAOYSA-N
N1CC2CCC1CN2C3=CC=C(C=C3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,3FF5E6C023599D3E_48A62F3EBA94E820_6041_DP,8.1495,00000000000000000000000000000000000000000010000000000000000000100000000000010001101101110011010010101000110110010001101011100100110101110110001011011011010010101111010,PLEGKFXLCUBLCV-KHNWJHPOSA-N
N1CC2CCCC1C2C=CC3=C[N](C)N=C3C4=C(C=CC=C4)Cl,F2AD6698ADE70964_27EB7305DC79346F_7019_DP,8.041419,00000000000000000001000000000000000000000000000000001000000000100100000000010000101100010011011010011001110100010000001011101100110000100100001011011011010010101111010,XTLGSUPMEUSSLS-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC(=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,6702BFDAEE5F6882_2B86C923BB575C68_6041_UN,8.458305,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110101110110001011011011010110101111010,PQNBWPRODRPONM-VFNWGFHPSA-N
CN4CCC1=C(C=CC=C1NC2=C(C)[N](N=C2)C3CCOCC3)C4,629A06F23F61BBB9_D2338A6F8D3C7A69_6041_UN,7.48339,00000000000000000000000000000000000000000000000000001000010000100100000000010001100101100011011011101100010011010001101011101100110011010110001011011111010011101111110,XIDGKFYHTHVYIA-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC3CC2(CNC2)C3)F,EDED6F41B778DDCA_5A492106F17F330F_7022_DP,7.687679,00000000100100000000000000000000000000000010000000000000000000000010000000100000001001110010010000001000010100001001000001100000100101110110001010001111010110101111010,ZAULYYFXAGOWFB-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC(CC)C2CCCOC2)Cl)C3CC3,B1B45C33DE2C8D53_CC0512A1AB925B7B_7022_UN,7.6981544,00000000000000000000001000000000000000000000000000000000010000100000000000000000000000110011000001100001100111010010001000000000110011110110000011010111010111101111110,UTWFGBHTVVJYRS-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C3=C2C=CC=CC2=C(N=N3)NCC6C4(C5=C(C(C)(CC4)C)C=CC=C5)C6)F,1FED4396D0933D82_FB30CB2EBC82370A_6041_UN,8.318315,00000000000000000000001000000000000000100010000000001000000000100110000000100101001000010011001000101100010100001001101011001100110001110100001011010111010110101111010,XRDRMZJXGXWNBG-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC3CCOC(C2=CN=C[N]2C)C3)Cl)C4CC4,10309667F798B5B9_538579C506356D2A_7022_UN,8.233745,00000000000000000000001000000000000000000000000000000000010000100100000000010101000101010010010111100001100111010000001011100100110011110100001011011111110011101111110,NRUFMVYZNYBAEF-UHFFFAOYSA-N
CN3CCN(CCOCC2COC1(CCCC1)O2)CC3,CB9C2DAB37F25F80_0BFBA336F900D4C7_6039_UN,7.0181227,00000000000000000000000000000000000000000000000000000000010000000000000010010001000101100100010110101000010001011001101011110010110010000110001000111000110101111101110,BPCPAYQAHXPYKI-UHFFFAOYSA-N
C1(=CC(=C(C(=C1)F)F)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,C168E2135A208D99_B8D51454BA496A3D_7022_UN,9.083298,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,UKJJBQUTIFBRNU-HOCLYGCPSA-N
N(CC1C2CCC(C1)C=C2)C(C3=C(CC)C=CC(=C3)F)=O,BAD56FE26B737637_A51D4C3DBB38D917_6038_UN,8.533645,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011000010100100010011000000000110000100000000011010011011110101111110,FXHFKOIUFUHBPG-UHFFFAOYSA-N
C1(=CC2=C(N=C1)[NH]C=C2C3CC3)NCCC[Si](C)(C)C,665D704022045CA9_C12717E56A4B9DB9_6041_UN,7.66003,00000000000000000000101000000010000000100000000000000000000000100100000000100101001100100011010010101100110010011001101011000100000101010110011000011101010110101111010,VEOCNIRWGSAACT-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2OCC3(CC2)CCC3)F)CC4,514009B13472B5C9_4C293387C40FE86D_6041_UN,7.1407566,00000000000100000001000000000000000000000010000000000000010000000010000000010001101001110011010100101000010111011001101011100000110011110110001011011011110111101111110,DDZDKSQJIRHPBE-UHFFFAOYSA-N
C(C1CC2CCC1O2)=CC3=C[N](C)N=C3C4=CC=C(C=C4)F,22CB153EB49B9E88_2C501F4FDAA31EA8_7019_UN,7.943588,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010000011010010000010100000000001011101100110010100100001011011010100011101111110,ISCHHRRHPRCWDF-UHFFFAOYSA-N
NCCCC(OC1=C2C(=CC=C1)NCC2)C3=CC=C(C=C3)F,9881D6B29FED3275_BA95C3D6D7585F78_6035_UN,8.162182,00000000000000000000000000000000000000000010000000000000000000000000000000000000001110010011000011001100110100010100001001000111000110110110001111010001110111100111110,HMSVJZNBTQSBMD-UHFFFAOYSA-N
COC1=CC=C(C=C1)C3=CC2=C(C=CC(=C2)Cl)N3C[C@H]5[C@H]4CNC[C@H]4OC5,DC26BF3C99B42D40_09520A5EC89C2D5D_6034_UN,8.416608,00000000000000000000000000000000000000000000000000000000010000100100000000010000001101110001010111001101010101000100000011100111110010100110001111001011110111111111110,ARASBROAZAWSKP-ZWDAVXSWSA-N
CC2=C1C=CN(C1=NC=C2)CC3CCCN3CC4CCCN4,D5A2F4E738DAAD9E_F89186F2DFDA90F6_6034_UN,8.379295,00000000000000000000000000000000000000100000000000000000000000000100000000010101001101100011000010101100110000010000001011100100110000000110001000011011010110101111010,GUVADFGVAIVAKK-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@H]3[C@H](C2=NC=C[N]2C)OCC3)Cl)C4CC4,10C19C214B9DE661_DA9C0C56D93B22E1_7022_UN,8.427248,00000000000000000000001000000000000000100000000000000000010000100100000000010101001101010011010111001001000111000000001011100100110011110110001010011111110111101111110,HVBCSFOQCVIRMA-KBXCAEBGSA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=N3)CC(C)(N)CC4=C(C=CC=C4)F,8729C26F71D44CA3_992404080CF18C45_6034_UN,8.009043,00000000000000000000000000000000000000100010000000000000000000100110000000010101001111110011000010101100110100011001001011100100110100100110001011011011010110101111010,MJOJYWYWHKYMRW-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3C(CCCC3)C4CC4,F61AFEB4A282832B_47603246C1D10DB6_6041_UN,8.058307,00000000000000000000001000000000000000100000000000000000000000100100000000000100001000000011000000101100010010000000001001000100110001010100011011010111010110101111010,QJEMMZRGZYUYRL-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2(CCOCC2)C#N)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F,511EBF9282180759_64D3AFA5C068BBC0_6041_DP,8.181647,00000000000000000000000000000000000000000110000000000010010000100010000000000001001000110011000000101000100101011000001011000100110111110110001011010011010011100111110,MGWMCCZDSDQCJO-DENIHFKCSA-N
CC1=C(C=C(C(=C1)N[C@H]2[C@H](CCC2)C3=CC=CC=C3)Cl)C4CC4,F847A17B49C483BE_2229CFB423C60D28_7022_UN,8.592997,00000000000000000000001000000000000000000000000000000000000000100000000000000000000000010011000010000001100110010000001000000100010001110000000011010011000010101111010,MHPHSZPTQYATFQ-YLJYHZDGSA-N
CCNC4CCC1=C(C3=C([N]1CC2C(CCNC2)(C)C)C=CC(=C3)Cl)C4,2B73A7ED05C01C56_1D8D7689193776D6_6034_DP,8.068424,00000000000000000000000000000000000000000000000000000000000000000110000000110000101101110011000010101101110110011011101011100100110101100110011011011111010110101111010,PGQJQIGWMLNOJT-UHFFFAOYSA-N
CC1=C(N=C(S1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)C5=CC=C(C=C5)F,A8CB5EC68F6652C7_817B4244A48BC561_6041_UN,8.104818,00000000000000000000001000000000000010000010000100001000000000100100000000010101111101011011011010101000001100010000001011101100110001110110001011011111010110101111010,KKVASQQAIACJQJ-VGSWGCGISA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2C(COCC2)N3CCCC3)F)CC4,2804FE62298014DF_E9E13B8332DC2C93_6041_UN,7.5356717,00000000000000000001000000000000000000000010000000000000010000100000000000010001100101110011010111101000100111010001101011100000110011110110001011011011010111101111110,RGLHRTCAYQTHIF-UHFFFAOYSA-N
CC1=C(C=CC(=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)F,4717FE98E227F63E_58F21AF320A4955E_6041_UN,8.280962,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110011011011111110111101111110,OYENCRRAXGEVRT-IRXDYDNUSA-N
CC1=C(C=CC(=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)Cl,F745566E5D287035_D4DF3A5B63A3298A_7022_UN,8.280959,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110011011011111110111101111110,FWYCYADUBXRLCY-IRXDYDNUSA-N
C1(=CC(=CC=C1)C2=CC=C(C=C2)Cl)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,FF56C5D0370064EC_85C2D7A802AC3775_7022_UN,8.276067,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101001000100010000001011101100110001110110001011011011010110101111010,YBQORFPZTGOSJK-NLFFAJNJSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CC(C3)C4CCC4,555C7D28841D4446_8A94599CE762E134_6041_UN,8.230655,00000000000100000000000000000000000000100010000000000000000000100100000000000100001000010010000000101100010110000000001001000100110001110100001011010111010110101111010,JGNOFAWGXMHUFG-UHFFFAOYSA-N
CC1=C[N](N=C1)CC2=C(C=C(C=C2)NC[C@@H]3CNCC(O3)(C)C)F,17D887B22B1CA47A_3C152BEEF85124C2_6041_DP,8.501613,00000000000000000000000000000000000000000010000000001100010000000110000000110000101100110010001110101000000110011001000011101100100111110110011011001111110111101111110,FVFWWOJKSYYDFD-INIZCTEOSA-N
CN(C)CC1=C(C=C(C=C1)NCC2OCC3(CC2)CCC3)F,E6A9422E7551763F_A00EC29565EC3A40_7022_UN,7.540461,00000000000100000000000000000000000000000010000000000000010000000010000000100000001001110011010100101000010101001001001000100000110011110110001011011111110111101111110,IOZGCBGDPWIFAG-UHFFFAOYSA-N
FC2=C1CCCC1=CC(=C2)NC4CCOC(C3=CN=C[N]3C)C4,1A2BACD542D96DBC_8A7C6EC9F7C7414F_6041_UN,7.2088704,00000000000000000000000000000000000000000010000000000000010000100100000000010101000101010011010111100100110111010000001011100100110011110100001011011011110011101111110,DWSTWAKWLXXBPF-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=C1)NC3=C2CCCCC2=NC4=C(C)C=CC=C34,58B6FD1F420B5348_F5C0FDF2A9C7C2B5_6041_UN,8.131026,00000000000000000000100000000010000000000000000000000000000000000100000000100000100000100011010000100100010000011000001001000100110001010100011011011111000010101111010,KQCVSLZRQJYCIB-UHFFFAOYSA-N
NCCCC(OC1=CC=C(C=C1)C2CNCCC2)C3=CC=C(C=C3)F,52ECB14F179ECEE1_D0E06256595058E9_6035_UN,8.664627,00000000000000000000000000000000000000000010000000000000000000100000000000000000001010110011000000101000100100010100001001000111110110100110001101010001110101100111110,GXLXCZQQHCEZFB-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3(C)CCOC2(CCC2)C3)F)CC4,1A8A5BEAA4E9301E_A674195B96EC6539_6041_UN,7.2564044,00000000000100000001000000000000000000000010000000000000010000000010000000010001101001110011010000101000010111011001101011100000110011110110001011011111110111101111110,OYQNDWLCOYWQLJ-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)C#N)F)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,FFF56F699408242D_A69E5770DE1CD4BC_7022_DP,8.01405,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110100111010,QRICVXLYFFFRTR-GOEBONIOSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC3=CC=C(C=C3)C4CNCC4,286A698A8796A4BD_8A3D7A993B3F25A5_6035_UN,8.536504,00000000000000000000001000000000000000000010000000000000000000100010000000000000001110110011000011001000100101011100001001000111010100100110001101010011110101100111110,RTJUKQKPMNMMSO-UHFFFAOYSA-N
C[N]1C=CN=C1C(NC(=O)C2CC3CC2C4CC34)C5=CC(=C(C=C5)F)F,77D1B0E1E0A975C5_2EACDB9B731118CE_6038_UN,8.48783,00000000000000000001001000000000000000100010000000000000000000000100000000010101000101010011110010000000010100100000010011100100110000100100001011001011001010101111110,CTJASNJVLQSUHE-UHFFFAOYSA-N
C[N]1C=CN=C1C(NC(=O)CC2CC3CC2C4CC34)C5=CC(=C(C=C5)F)F,6D8E2ACB62ECEE51_95FC4F062E1D4120_6038_UN,8.417849,00000000000000000001001000000000000000100010000000000000000000000100000000010101000101010001110010000000110100110000010011100100110010100100001011001011001110101111110,PYRQMAVKANJDCX-UHFFFAOYSA-N
CC1=C(N(C(=N1)C2CNCCC2)C[C@H]3C[C@H](F)CN3CC4=CC=CC=C4)C,3473424969267E8B_6F1803B446DBEBA5_6034_UN,8.678267,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101000100110010000101011100100110000100110001011011111010110101111010,MZZBJNRCTYVWST-GJGLBJJNSA-N
CC1=C(C=C(C(=C1)NCCC2CCCN(C)C2)Cl)C3CC3,4ED272E3C5B8DE17_FF0DA31166B5862B_7022_UN,8.060181,00000000000000000000001000000000000000000000000000000000000000100000000000010000001001110001010000101001100110010001101001100000110001110110001011011111010110101111010,NSBXMLWXRYXAJF-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NC4CC(C3=NC=C[N]3C)OCC4,D3DCCD365C6C5813_D1E3587769CFCA50_7022_UN,8.424328,00000000000000000000000000000000000000100010000000001000010000100100000000010101100101010010011111101000100111010000001011101100110011110110001011011011110111101111110,WACXKANUSJSMIV-UHFFFAOYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC(C#N)C4=CC(=C(C=C4)F)F,93FBF8B7C2941F75_CB2A37A6AEDC1EF1_6041_DP,7.6518025,00000000000000000000000000000000000000100110000000000000000000100100000000000101100100010011000010100000110100010000001011000100010101110100001011010011000010100111010,IHLQJQFOWYOSRV-GJZMFAHQSA-N
CCC(C)[N]1C=C(C=N1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,709E88A904FD3CDB_AC1BE7929837C1D1_6041_DP,7.9288764,00000000000000000000000000000000000000000010000000001100000000100100000000010001101100110011001010101000100100010011001011101100110101110110001001011111010110101111010,KSOWFKPSBUDLJX-WHJCRDCLSA-N
CCNC4CCC1=C(C3=C(N1CC2CNCCC2(C)C)C=CC(=C3)Cl)C4,2B73A7ED05C01C56_BB2290E86D14CD78_6034_UN,8.1112585,00000000000000000000000000000000000000000000000000000000000000000110000000110000101101110011000010101101110110011011101011100100110101100110011011011111010110101111010,PGQJQIGWMLNOJT-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CCC3N(C)CCOC3)C4CCNCC4,6BD8C157655E6E72_5DC10E63D905A79F_6034_UN,8.275844,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110001010110101100110111010001101011100100110010100110001001011011010111101111110,MKHMXSKTCULBSB-UHFFFAOYSA-N
CC1=C(N=C(S1)NCCC2CC(C)CC(C2)(C)C)C3=CC=C(C=C3)F,907D953352DBE5BC_2254CB9ECE1CD699_6041_UN,8.39355,00000000000000000000000000000000000010000010000100000000000000100110000000100100011100011001000010001000101110011001001011000100110001110100011011010111010110101111010,PLMQINUMSNDAMI-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NCC2CCCC3CCCN23,EE8865E77D58931B_0E94F217E191818F_6041_UN,8.2537,00000000000000000100100000000010000000000000000000000000000000000100000000100001001101100011010010101100010000011000001011100000110001010110011001011101010110101111010,OGNZFQVKESZTSY-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C3CCOCC23)Cl)C4CC4,92EB4AC631FC9309_C6D7BE7B4D2B408B_7022_UN,7.9079247,00000000000000000001001000000000000000000000000000000000010000100000000000000000001000110001000000101001010111000000001000000000110011110110000011010011010111101111110,FEJJDSVBUFOVER-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC[C@@]23CCN[C@@H]2CCC3)F)CC4,796700CF9F9F846F_56447B5A0EBA021B_6041_DP,7.690096,00000000000000000001000000000000000000000010000000000100000000000010000000010001101101110011010010001100110110011001101011100000110101110110001010011011010110101111010,AUENCKNDTWCYKX-NHCUHLMSSA-N
CC1=C(C4=C(N1C[C@H]2N[C@@H]3CC[C@H]2C3)C=CC=C4)C5CCNCC5,CD83D880D4EADA12_A84A706932135A8C_6034_UN,8.446796,00000000000000000000000000000000000000000000000000000000000000100100000000010001001101100011000010101100110010010000101011100100110100000110001011011011010110101111010,INUYISUFYUECGA-YQVWRLOYSA-N
CC1=C(C3=C(N1CC(CC)NCC2=C(C=C(C=C2)Cl)Cl)C=CC=C3)C4CCNCC4,F263915A49BA107F_3A4E4080D6EAD368_6034_UN,8.56422,00000000000000000000000000000000000000000000000000000000000000100100000000010001001101110001000010101101110110010010101011100100110100100110001011011111010110101111010,RRSQCLMCXCFLFV-UHFFFAOYSA-N
N1C4CCC1C(CNC(=O)C[N]2C=CC3=C2C=CC(=C3)F)C4,E9D8115985271665_72E9168CBFE54F11_6038_DP,8.177445,00000000000000000000000000000000000000000010000000000100000000000100000000010001101101010011100110001100110100110000011011100100110110100110001001011001011110100111110,APTPVEOUCRWUNK-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=C(C(=CC=C2)C3CNCCC3)F)C4,8D59177AC23600E0_6A33AF6540A5E669_6035_UN,8.378626,00000000000000000000000000000000000000000010000000000000000000100000000000100000001001110011010011101000110100010101001001100011110000100110001111011111110101101111110,QBVCIMKAHJOXQL-UEMFNXARSA-N
C(CC1CCCO1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,C009F983CC81DDA1_F57CB0679AC3B8E9_7019_UN,8.121923,00000000000000000000000000000000000000000010000000000000010000000000000000000000000101010000010010010000000111010000101000100000110011110100000010011010110111101111110,YOHCLAKTHGVZPF-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CC3(CN2)CCOCC3)F,4BC00E663C39D0A7_62C040CE45E50E7B_7022_DP,7.3424234,00000000000000000000000000000000000000000010000000000010010000000010000000100001001101110011010010101000110101011001001011100000110111110110001011011111010111101111110,WGDRSWMKPHSGNQ-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)C#N)F)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,FFF56F699408242D_62E6A2A09FB13F19_6041_DP,8.106612,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110100111010,QRICVXLYFFFRTR-GOEBONIOSA-N
N1CCCC2=C1C=C(C(=C2)N[C@@]45[C@@H]3OC(C)(O[C@@H]3[C@@H](CC4)C5)C)F,65CBC55B65018A63_114B84A31E7920FB_6041_DP,7.733213,00000000000000000000000000000000000000000010000000000000010000000010000010100000001100010011000111101100110100011000001011010000110101110100001011010111110011111111110,ACLZVFXEVKDINL-CLOTWAHHSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(C)CCC4(CC3)CC4,4BF6A251B478C394_6419C45DA4F530C7_6041_UN,7.449892,00000000000000000000001000000000000000000010000000001000000000000110000000010000101100010011011010001100010100001001101011101100110001110100001001011101010110101111010,ARCJXGMEHYNLPN-UHFFFAOYSA-N
C2(=C1[NH]C3=C(C1=CC=C2)CSCC3)NC4=CN=C([Si](C)(C)C)C=C4,4CBADB8F9ECB6C15_E0B79EC57A0F29C8_6041_UN,7.636549,00000000000000000000100000000010000010000000000000000010000000000100000000100001000100101011010010100100110000011000001011000100110101010110011011011101010010101111010,NUHOMQLFGKPULN-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NCC3N(C)CC4(CC3)CC4,7B772848E90078AD_3F35B2D05C25ACAE_7022_UN,8.196966,00000000000000000000001000000000000000000000000000000000000000000010000000010001001001110011010000101101010110011001101001100100110001110110001011011011010110101111010,XQGUSKUXISXHOJ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC(C)[CH]3C[C]4(C3)C[CH2]C4,C8638063A30D60D4_642884AD8FEE6FF2_6041_UN,7.9310627,00000000000100000000000000000000000000100010000000000000000000000110000000000100000000010010000000100100010100001000101001000100110001110100011011010111000010101111010,RROBHDMDQDYWSR-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Br)NCC3N(C)CC4(CC3)CC4,39A2E4ABAE8F766C_6FD5FAE6B7AEC8D8_7022_UN,8.196954,00000000000000000000001000000000000000000000001000000000000000000010000000010001001001110011010000101100010110011001101001100100110001110110001011011011010110101111010,DRORGAITZAQRFX-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2C3(CC2)OCCC3)F)CC4,AFC7049321CA833F_3DD1141590BA0C35_6041_UN,7.1011376,00000000000100000001000000000000000000000010000000000000010000000010000000010001101101110011010011001000010111011001101011100000110011110110001010011011110111101111110,DKNFTACANHMNTI-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3=C(C=C(C=C3)C4CC4)F,D87F4E4D25AA1DCC_15007C747BBB79C1_6041_UN,7.862123,00000000000000000000001000000000000000100010000000000000000000100100000000010100101101110000010010101000000110010001101011100100010001110110001011011011010110101111010,SSMQMNCSBYZLKT-IBGZPJMESA-N
NCCCC(OC1=CC=C(C=C1)C2NCCCC2)C3=CC=C(C=C3)F,3C918CAC8F7EBDE5_77FB33CC1B1AF62D_6035_UN,8.551445,00000000000000000000000000000000000000000010000000000000000000100000000000000000001010010011000000101000100100010100001001000111110110100110001101010001110111100111110,DAVNDLFIAYTJCL-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)N[C@@H]2CNC[C@H]2C3=CC=CC=C3,5E74AC10A4036B56_127B9A986A549F1D_6041_DP,7.882531,00000000000000000000000000000000000000000110000000000110000000100000000000000001101100110011000010001000100100010000000001000100010101110110001011000011010010101111010,MSYOFTYFTKDJGY-DOTOQJQBSA-N
CN(C)CC1=C(C=C(C=C1)NCC2C3(CCNC2)CCOCC3)F,EA1D10FA35BC64EC_BA118710E244B745_7022_DP,7.439374,00000000000000000000000000000000000000000010000000000100010000000010000000100000101001110011010000101000110101011001001011100000110111110110001011011111010111101111110,GMBDDSIKTHCNMR-UHFFFAOYSA-N
FC2=C1C=CC=CC1=C(C=C2)NCCC4CCN(C3CCN(C)CC3)CC4,7D18F06CFCAE5B79_BF0DAE8ADFA64BC0_6041_UN,8.102225,00000000000000000000000000000000000000000010000000000000000000100000000000010000101001110001010000101100110100010001101011100100110001110110001001011001010110101111010,NKDUIMJPTGFTIU-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CC3(NC2)CCC3)F)CC4,AB418A3C3367C7E9_3BFEFFEEB41AFA5C_6041_DP,7.5936756,00000000000100000001000000000000000000000010000000000100000000000010000000010001101101110011010010001000110110011001101011100000110101110110001010011011010110101111010,MCIXIRWLMKTJRZ-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)N[C@H]3[C@@H](CCC3)C4=CC=C(C=C4)F,03E658B284EF13F8_FFB7FF063B655CD9_6041_DP,7.919266,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101010011010010101000100110010000001011100100110101110100001011011011010010101111010,UKBIRNYCORDJNH-MYFVLZFPSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3NC2CCOC2C3)F)CC4,7FF04CB5F4FAA044_58576C9ED094FA94_6041_DP,7.778455,00000000000000000001000000000000000000000010000000000010010000000000000000010001101101110011010111001100110111010001101011100000110111110110001010011011110111101111110,SBYSGYWARWKRLF-UHFFFAOYSA-N
C(C1CCCC12CCOCC2)=CC5=CC3=C([N](N=C3C)C4=CC=CC=C4)N=C5Cl,96A3A4A805CC9A19_74EED759AC37EB52_7019_UN,8.229141,00000000000000000000000000000000000000100000000000001000010000100110000000010101100100110000001010110101010101001000001011101100110011110110001011011010010011101111110,LSFJTFWHXTWVIX-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2CCOCC23CCC3)F,9DD93E7F33D4DF70_9AD27079957D102D_7022_UN,7.676556,00000000000100000000000000000000000000000010000000000000010000000010000000100000000001110011010001101000110101011001001000100000110011110110001011011111010111101111110,UOZFAKPRIVHWGZ-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C[N](C)N=C3C4=C(C=CC=C4)Cl,3695A6E6787DB6B0_3A49F43AE8A96887_7019_UN,7.7137895,00000000000100000000000000000000000000000000000000001000000000100110000000010000100100010000011010010001010100001000001011101100110000100100001011011010000010101111010,LOTHRPGDOUHYQT-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NCC3=CC=C(CN2CCN(C)CC2)C=C3)C4OCCO4,0481F4D55BA7952E_B09A294E347AC93F_6041_UN,7.732546,00000000000000000000000000000000000000000010000000000000010000100000000010010001001101110000010010101000000101010001101011110100110011110110001011011011010111111111110,AHVDPOPEJPZFDP-UHFFFAOYSA-N
ClC1=C(C=C(C=C1)CCC=CCC2(CCNCC2)C#N)Cl,940C1EB1EC167C24_C3E4E93B0D456830_7019_DP,9.113308,00000000000000000000000000000000000000000100000000000000000000000010000000000000001000110001000000111001100100011000001001000000110000100110001011010011010100100111010,RDVPFLXLWQJSIG-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)COCC2)[S](C4=C3[NH]C=CC3=C(C)C=C4)(=O)=O,6CF62E6FCFABDFDA_3E72D67C3779E066_6029_UN,8.963734,00000000000000000000000000000000110000000000000000010101011111001101010001000000111100101000001011101110011001001000011011001100111110001110001011111001010111111111110,GNCUSZNCFRSNLQ-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)NCCC3CNCC(C)O3,D832AD0D0E7E1E1E_E907BDFCFC43AAE2_7022_DP,8.337483,00000000000000000000001000000000000000000110000000000000010000100010000000000000001000110011000101101000100110011001001011000000110111110110001011010011110111101111110,VNWIJSMBJJJMGF-UHFFFAOYSA-N
C(CC1CCCOC1)=CC2=C[N](C)N=C2C3=C(C=C(C=C3)F)F,AF5768343697741A_88F35DD35AA3E370_7019_UN,8.279528,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100110000011010110000000101000000001011101100110010100110001011011010010111101111110,FQWOFJAHUPTIFP-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(=O)C3=C[NH]C4=C3C=CC(=C4)F,6A3F968BE834CCCE_3DB0814FCFC3C600_6038_UN,7.725278,00000000000000000000000000000000000000000010000000000100010000000100000000000000101100010001100011001100110100110000011011000100110110100100001001010001111111110111110,QXFYPOLUTIUXLL-UHFFFAOYSA-N
C(CCCCN1CCCCC1)=CCC2(C)CCOCC2,527DC3CE1856DFD7_6C5D8C340CBA3441_7019_UN,7.765986,00000000000000000000000000000000000000000000000000000000010000000010000000010000000001100000000000111000000001011001101011100000110010000110000001011000010101101101110,VANGXMHHAMPQPG-UHFFFAOYSA-N
N1CC(C1)(C#N)C2=NC=C(C=C2)N[C@H]3[C@@H](C3)C4=C(C(=CC=C4)F)F,EEBF1833C844934B_9C28C5EB00C8CCD4_6041_DP,7.6468024,00000000100100000000001000000000000000000110000000000000000000100110000000000001101000110010000000101000100100011000000011000100000101110110001011000011010010100111010,DRIVZTHZMJZBTA-DZGCQCFKSA-N
FC2=C1N(C=CC1=CC=C2Cl)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,821138F1B5B95566_8C1CCE2AAD0C8865_6034_UN,8.96077,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101101010100010000001011100100110001100110001011011010010110101111010,DGWSTLLGTQGARA-QRWLVFNGSA-N
CC1(CCO1)C2=CC=C(S2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,5F7124F03A9BB639_00EABCABE5B6756D_6041_UN,7.7859354,00000000100100000000000000000000000010000010000100000000010000100010000000010001010101111000010010101000000101011001101011100100110011110110001011011111110111101111110,RZAWUSOQGHZBRD-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC3CC4(C3)C5CCC(C4)C5,743B0456122563C0_34BFDA1CB8EDF6B3_6041_UN,7.7012825,00000000000100000000000000000000000000100010000000001000000000100110000000010101101100010010011010101000010100001000001011101100110001110100001011011011010110101111010,KGQUVHHFNZNVNF-UHFFFAOYSA-N
NC1(C2CCC(C1)CC2)COC3=C(C=CC(=C3)C4CNCCC4)F,02C5375AF099BF02_43550B88D02675D6_6035_UN,8.360712,00000000000000000000000000000000000000000010000000000000000000100010000000000000001010110011000100101000110101011100001001000011110101100110001111010011110111100111110,DLPUACFUGFIZIP-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC(CC)(C)C=C)C3=CCNCC3,133632DB7A72F456_E599CEB39880D81D_6034_UN,8.855051,00000000000000000000000000000000001000000010000000100000000000100110000000011000001101110001000010111100110100011011101011100100110000100110001001011101010110101111010,AGEZXOSVDWTFLL-UHFFFAOYSA-N
CC1=C(SC=N1)C5=NC2=C(C=C(C=N2)NC3CCN(C)C34CCCNC4)[NH]5,50EDF7465CA99DB7_F8F391956599E0D6_6041_DP,8.3301325,00000000000000000000000000000000000010100000000100000100000000100110000000010101111101101011010010101100110010011001101011100100110101010110001011011111010010101111010,JZLUTTHHKLOKBD-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2CCOCC23CCCCC3)F,60EB15E7CB4B720C_EBC330EF07C62A71_7022_UN,7.684157,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110011010001101000110101011001001000100000110011110110001011011111010111101111110,RKCOZLGFJOMJSK-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2CC(CC2)C3=C(C=CC=C3)F)C4CCCC4,AFD9FE99C03E4229_EE0A910F877630D4_6041_UN,8.10118,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011011010000000100100010000001011101100010001110100001010011011000010101111010,SSBJRQIGYMAQKL-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3CCC2(CCNCC2)CO3)F)CC4,BDC9240B0F07B751_05B9FD5B2EDEAA49_6041_DP,7.4784317,00000000000000000001000000000000000000000010000000000000010000000010000000010001101001110011010100101000110111011001101011100000110111110110001011011011110111101111110,VXUONLOJVSEMJL-UHFFFAOYSA-N
CC2=C1N(C=CC1=CC=C2F)C[C@H]3[C@@H](CNC3)C4CCOCC4,BCC76CA929D0343B_C7A8226DF2DCBE0E_6034_UN,9.097466,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011000010101100010111000000001011100100110010100110001011011011010111101111110,IIQWYEIOOWXXKK-IRXDYDNUSA-N
N(C1=CC(=C(C=C1)F)F)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,29E77DC1BA3E81F9_430C47AF769DB936_6038_DP,7.6615515,00000000000100000000000000000000000000000010000000000010000000100010000000000001001100010011100110001000110100111000010001000000010101110100001010000011011010100111110,ZJCBQWDVGYDFMK-LNVNLZDRSA-N
N(C1=CC(=C(C=C1)Br)F)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,38A9478B2A67499F_7842EBDF0760BA9F_6038_DP,7.6615524,00000000000100000000000000000000000000000010001000000010000000100010000000000001001100010011100110001000110100111000010001000000010101110100001010000011011010100111110,ORPQKJRVUYLFTE-LNVNLZDRSA-N
N(C1=CC(=C(C=C1)Br)Br)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,4DBC6A6B1D539487_1CBD17D7F317DED5_6038_DP,7.661549,00000000000100000000000000000000000000000000001000000010000000100010000000000001001100010011100110001000110100111000010001000000010101110100001010000011011010100111110,JCPAKSQNZBSPCW-LNVNLZDRSA-N
N(C1=CC(=C(C=C1)Cl)Cl)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,1DABF4FD8EEA1C28_DF2F5BF44E964D90_6038_DP,7.6615515,00000000000100000000000000000000000000000000000000000010000000100010000000000001001100010011100110001001110100111000010001000000010101110100001010000011011010100111110,BPTKCQZCGBIGLE-LNVNLZDRSA-N
N(C1=CC(=C(C=C1)F)Cl)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,88FDB487C290BDB2_129386D08762E983_6038_DP,7.6615477,00000000000100000000000000000000000000000010000000000010000000100010000000000001001100010011100110001001110100111000010001000000010101110100001010000011011010100111110,YTGLBCGFDIBNBZ-LNVNLZDRSA-N
N(C1=CC(=C(C=C1)I)Cl)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,9C0480327F7B3109_AF15912394FE445E_6038_DP,7.6615534,00000000000100000000000000010000000000000000000000000010000000100010000000000001001100010011100110001001110100111000010001000000010101110100001010000011011010100111110,OYMRXZJVQXDXCG-LNVNLZDRSA-N
N(C1=CC(=C(C=C1)Br)Cl)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,56FDA3F2F4A3E18A_E02D6043BF73DDE1_6038_DP,7.661548,00000000000100000000000000000000000000000000001000000010000000100010000000000001001100010011100110001001110100111000010001000000010101110100001010000011011010100111110,KCJXBGJKVBNIRX-LNVNLZDRSA-N
N(C1=CC(=C(C=C1)F)Br)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,3E7726787B1CCD45_F197C7458E76270B_6038_DP,7.66155,00000000000100000000000000000000000000000010001000000010000000100010000000000001001100010011100110001000110100111000010001000000010101110100001010000011011010100111110,YMXRJHKNBLGXIT-LNVNLZDRSA-N
N(C1=CC(=C(C=C1)Cl)F)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,1A21DCCDABE6EB3E_C7C81153FFEC8869_6038_DP,7.66154,00000000000100000000000000000000000000000010000000000010000000100010000000000001001100010011100110001001110100111000010001000000010101110100001010000011011010100111110,NYVXUFOPDCGWTB-LNVNLZDRSA-N
N(C1=CC(=C(C=C1)I)Br)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,FEE435173B8EC28C_C939EAF4E0C8EFB1_6038_DP,7.6615424,00000000000100000000000000010000000000000000001000000010000000100010000000000001001100010011100110001000110100111000010001000000010101110100001010000011011010100111110,RJYBYVOTDGZWGW-LNVNLZDRSA-N
N(C1=CC(=C(C=C1)I)F)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,9C0FCA4A28F353A6_6AC5E14A03BB357B_6038_DP,7.6615396,00000000000100000000000000010000000000000010000000000010000000100010000000000001001100010011100110001000110100111000010001000000010101110100001010000011011010100111110,NQKWWSBFNDYNLZ-LNVNLZDRSA-N
N(C1=CC(=C(C=C1)Br)I)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,745F51AB6E8627BD_D0E170E49EA437E4_6038_DP,7.6615486,00000000000100000000000000010000000000000000001000000010000000100010000000000001001100010011100110001000110100111000010001000000010101110100001010000011011010100111110,NHORPEQYWCDLKZ-LNVNLZDRSA-N
N(C1=CC(=C(C=C1)Cl)I)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,AB2FC869F7566C44_5CFDF2A777612B82_6038_DP,7.6615305,00000000000100000000000000010000000000000000000000000010000000100010000000000001001100010011100110001001110100111000010001000000010101110100001010000011011010100111110,KEOQSDAQPDYPNA-LNVNLZDRSA-N
N(C1=CC(=C(C=C1)Cl)Br)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,E5FFA1B027BC686A_768EF22D7B5DE012_6038_DP,7.661539,00000000000100000000000000000000000000000000001000000010000000100010000000000001001100010011100110001001110100111000010001000000010101110100001010000011011010100111110,DXKWGKIBGHTMJU-LNVNLZDRSA-N
C(C1CCCC12CCOCC2)=CC3=C([N](C)C4=C3C=CC=C4)Cl,5CE188AAA2D6ED27_C71F6FB571F06163_7019_UN,8.515577,00000000000000000000000000000000000000000000000000000000010000000110000000010000000101110000010010110101010101001000001011100100110010100110000011011010010011101111110,RROLZPCFMGCZMX-UHFFFAOYSA-N
C[N]1N=C(N=C1N[C@@H]2C3=C(OC(C)(C2)C)C=CC(=C3)F)C4CCOCC4,4B5D4C90A20029AC_E020A41FA75F76BF_6041_UN,8.479119,00000000000000000000000001000000000000100010000000001000010000100110000000110101100100110000011011100100111101011101001011101100110011110110011011011111110011111111110,OQBXZTLFRPKYGP-HNNXBMFYSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC3=CC(=CC=C3)C4CNCC4,05522974F466C93C_E5FD9C14C95902F2_6035_UN,8.547783,00000000000000000000001000000000000000000010000000000000000000100010000000000000001110110011000011001000100101011100001001000111010100100110001101010011110101100111110,OMFAEZDJJYVJMQ-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,8D8A6FB15A783019_E75924D76738D8FD_6041_UN,8.192332,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,GIRXKWACZGZZJJ-QRQCRPRQSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CNCCC2C)F)CC3,06370064F980F5C4_246777F42B6C21EE_6041_DP,8.097636,00000000000000000001000000000000000000000010000000000100000000000000000000010001101001110011010000101000100110010001101011100000110101110110001011011111010110101111010,HZZQXWADIJUAAZ-UHFFFAOYSA-N
ClC1=CC(=C(C=C1)C2=NOC(=C2)C=CC3CCCCC3CC)Cl,365BA2B826D11707_9ECD371C50214BD4_7019_UN,9.734632,00000000000000000000000000000000000000000000000000000000010000100100000100000000000100010000001011010011000110000010101011001100110000100100000011010010100110001111110,YAUJAICNZJVXRO-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)NCC2N(C)CC3(CC2)CCC3,E9E2B5E7A4869633_7791F5A30223CF6D_6041_UN,7.537711,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011111010110101111010,NVUOOAUJBVBUSB-UHFFFAOYSA-N
CC1=C(C=C(C=C1)Cl)NCC2N(C)CC3(CC2)CCC3,2978CBA6D28B694E_6C198B4B78B48B1A_7022_UN,7.5377007,00000000000100000000000000000000000000000000000000000000000000000010000000010001001001110011010000101001010110011001101001100000110001110110001011011111010110101111010,KQXDLYGIAOQNGU-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NCCN(C)CC2COCCC2)F)F,60BB76C9E70B1411_2FBBDD93B8E5476A_7022_UN,7.71877,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001011011111010111101111110,VHNXBYYPSVVZNN-UHFFFAOYSA-N
[NH]1C=CC2=C1C(N(C=C2)CC3(N)CC4=C(CC3)C=C(C=C4)Br)=O,E1A73314F09C05E3_9FA20D776E4C8742_6034_DP,8.586264,00000000000000000000000000000000000000000000001000000000000000000110000000010001000111010011100110101100110100111100011011100101110101100100001111011011011110100111110,YYGUHRNRYMGING-UHFFFAOYSA-N
FC2=C(C=C1OCC(C1=C2)=O)NC3=CC5=C(C=C3)OC4(CCC4)C=C5,4640BCB5980908DC_1AD0620003CE4175_6041_UN,9.225818,00000000000100000000000000000000000000000010000000000000010000000010000010000000000100010100000011110100010101001100001010000101000011110100000111110011111011110111110,ZFBDRUIDSCBTPL-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)C#N)F,3E76EA29235E3EEF_7F27A7E3899C142F_6041_DP,8.489745,00000000000000000000000000000000000000000110000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001011010110101111010,DUDBPSVQBANTQR-NWDGAFQWSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC3=C2OCCCC2=CC(=C3)F,1FF747CA8304E3C4_6398D8F35BA085AF_6041_UN,7.3054314,00000000000000000000100000000010000000000010000000000000010000000100000000100001000000110001010100100100010101001100001011000100100011110100011011011111110011101111110,KUXITXGEHWGKRC-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CCC3CCCN(C)C3)Cl,1BF6B01394ED5646_F70EE4FC9B97F291_6034_UN,7.9195075,00000000000000000000000000000000000010000000000100000000000000000100000000010110010101111011010010101001001110010001101111100100110001110110001011011111010110101111010,UVUYQRBNHMTPIP-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CCCC3)C4=C(C=CC=C4)F,11C072E0BEE10089_1E800AAFDCBF1DE3_6041_UN,7.8571944,00000000000000000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,UDWYZBIJZSFWEK-FQEVSTJZSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NC[C@H]3[C@H](CCCC3)N4CCOCC4,9A331AB73F71C4E2_7A179F49F0A5DA68_6041_UN,7.7886868,00000000000000000000000001000000000000000010000000000000010000100100000000010101101101110011010110101100011111010000001011100100110011110110001011011011010111101111110,LGPRGAVJLRNTTG-YOEHRIQHSA-N
FC1=CC(=C(C=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)C5CC5,63334710FB0DAC49_9A669535AF72B7E3_6041_UN,8.675897,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,JHMRZICLIGTUDB-ZHRRBRCNSA-N
CC1=C(C(=C(C=C1)F)NCC2CCCN(C)C2C3=CC=CS3)F,FD782929671B30E3_68DE2D8BEEF2A2F8_7022_UN,8.344115,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101000000110010001101011100100110001110110001011011111010110101111010,VVRMQVOPRWTYHN-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC3CCCC4CN(CC2=CC=CC=C2)CC34)Cl)C5CC5,654447377BFA344F_376C1180FBBA55EE_7022_UN,8.428663,00000000000000000000001000000000000000000000000000000000000000100000000000010000100101110011000010001101110110010000001001100100110001110110001011011011010110101111010,RPPLQEMKMVMCRD-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(=O)CC3=C[NH]C4=C3C=CC(=C4)F,1A5E3FD9D6185948_7F5F76283351741E_6038_UN,7.9560723,00000000000000000000000000000000000000000010000000000000010000000100000000000000001100010011100010001100110100110000011011000100110110100100001001010001111111110111110,UEXRPXVBZIIRHA-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NCC2N(C)CC3(CC2)CC3)C=C,32CD9398ED109F5D_58E10DB698759B78_6041_UN,8.00317,00000000000000000000001000000000001000000010000000000000000000000010000000010001001001110011010000111000010110011001101001100000110001110110001011011011010110101111010,CSUGLICBXHRFED-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)C#N)F)NC[C@@H]2CNCC(O2)(C)C,84DD18893D218403_BB3995F0FDE7B2C8_6041_DP,8.731864,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110001011000111110111101111110,JZEJLBFHMQTVGO-JTQLQIEISA-N
C1(=CC2=C(C=C1)OC(C2)C3OCCO3)NC5=C(C=C(CN4CCN(C)CC4)C=C5)F,855A84DC9DEB3EDA_9FE59A340B440A94_6041_UN,7.9585996,00000000000000000000000000000000000000000010000000000000010000100000000010010001000101110001010010101100010101010101101011110100110011110110001011111011110111111111110,QQWADEMICZDULH-UHFFFAOYSA-N
CC1=CC(=C(C=C1)F)NCC2CC3(C2)C4CCC(C3)C4,3086C7EE3B5FFC46_416585A2355A5E52_6041_UN,8.122242,00000000000100000000000000000000000000000010000000000000000000000010000000000000001000010010000010001000010100001000001000000000110001110000000011010011010110101111010,GHMPJRGOARPTIC-UHFFFAOYSA-N
ClC2=C1C(=CN(C1=NC=C2)CC4[C@@H]3C[C@@H](C3(C)C)CC4)CC5=CC=CC=C5,6FE8F2CBEAE8EB56_1527F4D082C946F2_6034_UN,8.166323,00000000000100000000000000000000000000100000000000000000000000000110000000110100000101010000000010101101010110001000101011100100110000100100001001011100010110101111010,NZSGFLNNWRWTTG-MFUMQWNRSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC3=C([N](N=C3C)C)C4CNC4,05A8347F856EAF76_D5B53DFA24D5EF6E_6041_DP,7.5909843,00000000100100000000000000000000000000000010000000001000010000100100000010010001101100110011011010001000000111000000001011111100000111110110001010011111010011111111110,BHZWBTUXJFGBKL-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=C(C=C(C=C2)C3=CN=CC=C3)Cl)C4,19064F5644E9465A_3E61A0993E07FC7E_6035_UN,8.639362,00000000000000000000000000000000000000000000000000000000000000100100000000100000000001110000010011101001010100000101001001100111110000100100001111011110110101101111110,JIMNFZGQIQUBAC-ONFYXGJMSA-N
CC1=CC=C(C=C1)C2=CN(C(=N2)C3NCCCC3)C[C@H]4N[C@@H]5CC[C@H]4C5,653A2BC0240AA0C7_6EA5EA01FCFF3B7F_6034_UN,8.217323,00000000000000000000000000000000000000100000000000000000000000100100000000010101001101000011000010101000110000010000001011100100110100000110001011011011010110101111010,YWRJHZBMXLOYRB-GPXSZDCPSA-N
CC1=C(C=CC(=C1)F)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,49FB0A9D54A67BE3_17906412FD860610_6041_DP,8.139704,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001111010110101111010,XTBJTGUOHMPUML-GXTWGEPZSA-N
FC1=C(C=C(C=C1)C#C)NC2CN(C)C3(C2)CCOCC3,4325F1E6A459A09F_350FA15B0A4F42AC_6041_UN,7.2290235,00000000000000000100000000000000000000000010000000000000010000000010000000010001100101110001010011101000110111011001101011100000110011110110001011011011010011101111110,RPIXGTZTXDPWDL-UHFFFAOYSA-N
C2(=C1OC=CC1=CC(=C2)F)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,F59E0B7FA78D5832_854B3427890E1940_7022_UN,8.200619,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101100010111010001101011101100110011110110001001011111110111111111110,JANRTBVLWQFGRX-IRXDYDNUSA-N
N(CC1CC2CCC(C1)O2)C(C3=CC=C([N]3C)C4=CC=C(C=C4)F)=O,D0F2D0F1E3833966_2AC61369ED29AFC9_6038_UN,8.035624,00000000000000000001000000000000000000000010000000000000010000100100000000010001001101010010110110101000010100100000011011100100110010100100001011011011111111111111110,YKBFIXHMZVGOEO-UHFFFAOYSA-N
C(C1CCC2(CC1)OCCO2)=CC5=CC3=C([N](N=C3C)C4=CC=CC=C4)N=C5Cl,B2EB150F6C7FFF18_626ECF4410E3A2C2_7019_UN,8.312567,00000000000000000000000000000000000000100000000000001000010000100100000010010101100100010000001010110101010101001000001011111100110011110110001011011010110011111111110,WOOUFVNMAMTXFO-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC2(COCCNC2)F,F41CD7DAFA5DC9A8_C4C4AAD6A3FEC566_6041_DP,7.7249737,00000000000000000001000000000000000000000110000000000100010000000010000000000000101000110011000101001000100111011000001011000000110111110110001010010011010111101111110,WLWSBTDGARFHNW-UHFFFAOYSA-N
FC1(CCOCC1)C2=CC=C(C=C2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,76B7838557562C75_A391F883302324EB_6041_UN,8.459845,00000000000000000000000000000000000000000010000000000000010000100010000000010001100101110011010010101000100111011001101011100100110011110110001011011011010011101111110,RVIGATBEYHPSQT-RTWAWAEBSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCN2C3CCOCC3)F)CC4,F8115B588F895BC9_ADA36566E087A854_6041_UN,7.6372724,00000000100100000001000000000000000000000010000000000000010000100000000000010001101001110011010001101000000111010001101011100000110011110110001011011011010111101111110,LECCUWMXADBICR-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=N[N]4C)F,730D06394A40D8A7_03E4AEBF3D522A10_6041_DP,7.726117,00000000000000000000000000000000000000000010000000001000000000100100000000010001101101110011011010101100110110010001101011101100110101110110001011011111010110101111010,HCERLLWOXIKCTF-MGPUTAFESA-N
CC1=C(C=CC(=C1F)C#N)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F,3B3ABEA355A504A0_1568A5295F9EE36F_6041_DP,7.624531,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010101111010,KMCIGZSDPUZSTL-SJLPKXTDSA-N
CC(NC(=O)CC1CC2CCC1O2)CC3=C[NH]C4=C3C=C(C=C4)F,744E9EEB80320023_485100762E3B0A43_6038_UN,7.833728,00000000000000000000000000000000000000000010000000000000010000000100000000000000000100010011100010000100110110110001011011000100110110100100001001010001101111111111110,FOLZVTGMCUHFNC-UHFFFAOYSA-N
C(C1CC12CCOC2)=CC3=CC(=C(C(C)(C)C)C=C3F)F,DD163D5EE55E8507_EBE1D2A791FE8082_7019_UN,8.668273,00000000000000000000001000000000000000000010000000000000010000000010000000100000000100110000000010010000010101001000001000000000110010100110010010010110010001001011110,PQPXPMBBRCYCEF-UHFFFAOYSA-N
C(CC1CCCCO1)=CC2=C[N](C)C3=C2C=C(C=C3)F,5FAB31362B681B7B_63F838676E716049_7019_UN,8.608795,00000000000000000000000000000000000000000010000000000000010000000100000000010000000101010000010010110100010101000000001011100100110010100100000001011000110111101111110,NLKZIRAHKGRQBH-UHFFFAOYSA-N
NC2=NC1=C(C=C(C=C1)F)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,80792EB85DE71717_69AF1009DA52C1CD_6034_UN,7.792251,00000000000100000000000001000000000000000010000000000000000000000110000000110101000111010010000010001100011110001000101011100100110001110100001011011111010110101111010,FNOZHSIPCCGIDF-KUNJKIHDSA-N
NC2=NC1=C(C=C(C=C1)Cl)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,FA14FAB3613DA9C8_B08D0FDE42FDE741_6034_UN,7.792242,00000000000100000000000001000000000000000000000000000000000000000110000000110101000111010010000010001101011110001000101011100100110001110100001011011111010110101111010,PLHJUWOSMRGWKZ-KUNJKIHDSA-N
FC2=C1CCCC1=CC(=C2)NCC3=C(C=N[N]3C)C4CCC4,59D9F1D145FB8363_D1152330F4768B4D_6041_UN,7.7474256,00000000000100000000000000000000000000000010000000001000000000100100000000010001101100010001011010001100010100010000101011101100110001110100001010011011010110101111010,YDJWEJMGKVGIEL-UHFFFAOYSA-N
C1(=CC2=C(C=C1)CC=C2)NC3=C[N](C[Si](C)(C)C)N=C3,E2BA0EFDE3715472_E7EBBD12FCAFBC5E_6041_UN,8.059366,00000000000000000000100000001010000000000000000000001000000000000100000000110001100100100001011010011100010000011001000011101100000001010100011010001101010110101111010,JRCGIKJSGXUCLI-UHFFFAOYSA-N
FC1=CN=C(C=C1)C2=N[NH]C=C2NC4C[C@H]3CCC[C@H](N3C)C4,974B151063C421A7_2460004421CE6C61_6041_UN,8.489468,00000000000000000000000000000000000000000010000000001110000000100100010000010001100101010001011010100100110110010000101011101100110101110100001011011011000010101111010,LDPCDJFHGPFHKG-AGUYFDCRSA-N
CN(C)CC1=C(C=CC(=C1)NC3=NC=C(CC2COCC2)S3)F,7D61A144F4CDFD19_FE8D447D989E87D2_7022_UN,8.217085,00000000000000000000000000000000000010000010000100000000010000000100000000100100010101111001010010001000001101000001001011100100110011110110001010011111010111101111110,PZBZWCBDTCKBMD-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4(CCCC4)C5=C(C=CC=C5F)F,281948255732FDA5_CB2C1A47A6068BC4_6041_DP,8.37202,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010010101111010,YFQVFJWEVOFXFV-RAKKMVLPSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2CC(CC)C3=CC4=C(C=C3)CCCC4,37531B4C1B6D1BE9_ECB33FBDE13A0D7C_6034_UN,8.177412,00000000000000000000000000000000000000000000001000000000000000000100000000010000000101010000000010001100010100000010101001100100110000100100010011011110010110101111010,ZWLXDDOVCCWRES-UHFFFAOYSA-N
C2(=C1CCCCC1=CC=C2)NC3=C[N](C[Si](C)(C)C)N=C3,D04129AF50479DF4_DDF591A075339659_7022_UN,7.6150637,00000000000000000000100000001010000000000000000000001000000000000100000000110001100100100011011010001100010000011001001011101100110001010100011011011101010110101111010,REDOCSHUIUHMMW-UHFFFAOYSA-N
FC2=C(C=C1C=COC1=C2)NCC4CC3(CCN3C)C4,A14AD4670B439944_E594B930160D4953_6041_UN,8.130949,00000000100100000000000000000000000000000010000000000000010000000010000000010000001101110010010010001100010100011001101011100100110001110110001010011011110110101111110,MBAOQTGVYFIPOT-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[NH]C3=C2CCCC3)NC4=CN=C([Si](C)(C)C)C=C4,DD8BC44F5083B645_296F307823F41718_6041_UN,7.4411955,00000000000000000000100000000010000000000000000000000000000000000100000000100001000100100011010010100100110000011000001011000100110101010100011011011101000010101111010,YWVIHJSKKGUGJD-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)Cl,8A08772D792804A4_EF363BCCC21231BF_6038_UN,7.7310743,00000000000100000001000000000000000000000000000000000000010000100010000000010001001101110011100110101001110100111000011011100000110010100110001011011011111111110111110,RLKWSQPGTGHVLH-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)F,B52277D22A8CEA73_20D361C419244899_6038_UN,7.7310767,00000000000100000001000000000000000000000010000000000000010000100010000000010001001101110011100110101001110100111000011011100000110010100110001011011011111111110111110,VPGVUKDCHXOSBO-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3C(C)(CNC3)C)Cl,8808E42B695EE78E_002A3E1E648FA0EC_6034_UN,8.6057415,00000000000000000000000000000000000010000000000100000000000000000110000000110110111101111011000010001001001110001001100111100100110101110110011010001111010110101111010,FFAWASGVEQLUMM-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC(CC)C2CCCOC2)F)CC3,AD9BE2B33F86A24A_87FBA980A5CB25B0_6041_UN,7.5869412,00000000000000000001000000000000000000000010000000000000010000000000000000010001100001110011010001101000100111010011101011100000110011110110001011011111010111101111110,WBDLINZAINJKRQ-UHFFFAOYSA-N
C(C#CC1=C(C(=CC=C1)Cl)Cl)=CC(C)CC2CCOCC2,C0DDB9B5B26EF20C_10475B3E410FF62A_7019_UN,8.269503,00000000000000000100000000000000000000000000000000000000010000000000000000000000000000110000000000110001000111000001001000000000110010100110000011010010010101001011110,HYZIGYTZXIIGOA-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C(CCCC2)F)Cl)C3CC3,514438EF0B5AB646_D2A32A61B1BE2864_7022_UN,8.164566,00000000000000000000001000000000000000000010000000000000000000100000000000000000001000010011000000001001000110000000001000000000110001110000000011010011010110101111010,CWXFWDYHGZKIAN-UHFFFAOYSA-N
C2(=CC1=C(C(=CC=C1)F)O2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,C27B77CA75FFEFA5_816756D87522C7F7_7022_UN,8.490132,00000000000000000000001000000000000000000010000000001000010000100100000000010001101101010011111010101100010100110000011011101100110001110110001011011011110110101111110,HNFXMLJKASOJAV-QRWLVFNGSA-N
CC1=C(C=C(C(=C1)NCC2C(CCCC2)Cl)Cl)C3CC3,0856D3044951ECB0_D9F329391DE563EF_7022_UN,8.164561,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010011000000001001000110000000001000000000110001110000000011010011010110101111010,IUHZJHYINHPRQK-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CC3(NCC2)CC3)F)CC4,8F41FC5F77B4DA24_A8195E6BCCE48038_6041_DP,7.676305,00000000000000000001001000000000000000000010000000000000000000000010000000010001101001110011010000101000110110011001101011100000110101110110001011011011010110101111010,SATJCKQPYBZEEU-UHFFFAOYSA-N
FC1=CC(=CC(=C1)NCC[C@@H]2CC[C@H]3C[C@@H]2C3(C)C)C[N]4C=CN=C4,BC6C298952D47D9B_B54EB5C739BAEC3F_6041_UN,8.324551,00000000000100000000000000000000000000000010000000000000000000000110000000110101001101010001000010001000110110011000101011100100110001110110001001011101010110101111010,ZCJCCHPLWNCJKP-ZWOKBUDYSA-N
FC1=C(C=C(C=C1)NCC3=CC2=C(CN(C)C2)C=C3)C4OCCO4,67E095903FFABD17_20AE204033A1DA04_6041_UN,7.6508813,00000000000000000000000000000000000000000010000000000000010000100000000010010000001101110000010010001100010101000001001011110100110011110110001011011011010111111111110,SREDNKBBVVOBQV-UHFFFAOYSA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CC4=C[NH]C5=C4C=C(C=C5)F,9D9EB17A787E914A_83BC30C27A1D5EFC_6038_UN,7.5526195,00000000000000000000000000000000000000000010000000000000000000000100000000000000000100010011100010000100110100110000010001000100100111100100001001000001001110100111110,FKKNGPYPLBNTAL-UHFFFAOYSA-N
N1C4CCC1C(CNC(=O)CC2=C[NH]C3=C2C=C(C=C3)F)C4,0E268691BB9F3A14_6014D558EAEEAF05_6038_DP,8.053547,00000000000000000000000000000000000000000010000000000100000000000100000000000000101100010011100010001100110100110000011011000100110110100100001001010001011110100111110,QHSUSGAFRCYCIX-UHFFFAOYSA-N
C(C1(CC1)C2CCCCO2)=CC3=C([N](C)C4=C3C=CC=C4)Cl,6A689255276F579C_7F45281ABE6BD63C_7019_UN,8.516396,00000000000000000000001000000000000000000000000000000000010000100110000000010000000101010000010010110101010101001000001011100100110010100100000011011010110011101111110,OSNHVRFUSMDNTJ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NCCC3CCCN(C)C3,715658C8DE047B77_BF44D54AF3FCF9C9_6041_UN,8.476082,00000000000000000000000000000000000000100011000000000000000000000100000000010100001101110011010010101100110110010001101011100100110101110110001001011001010110101111010,AHOTYHZMOPECPY-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)N[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,E33D40AB36820F08_29D1ADDF5AA8FABB_6041_UN,8.405561,00000000000000000000000000000000000000100010000000000000010000100100000000010100100101110011010111101000100111010001101011100100010011110110001011011011110011101111110,IPIZALUVRSNYJX-HBFSDRIKSA-N
N(CC1C2CCC(C1)C2)C(C3=C(CC)[N](N=C3)C4=CC=C(C=C4)F)=O,D737353B7F53C7AF_122F9821FC43F90C_6038_UN,8.577408,00000000000000000000000000000000000000000010000000001000000000100100000000010000101100010011101011001000010100110010011011101100110001110100001011011011011110101111110,WVSAYERDRVTZAW-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CC23CC3)F)CC4,084E86DB5496323D_5934DD4C7ECDBD81_6041_UN,7.588764,00000000000000000001001000000000000000000010000000000000000000000010000000010001101001110011010000001000010110011001101011100000110001110110001010011011010110101111010,NHTJTAYJSBIBGF-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)N[C@H]4[C@H](C3=C(C)[N](N=C3)C)OCC4,7BD5B75CD539E5E6_5F4E94C781A80CA9_7022_UN,8.467139,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011011111000000100101010000001011101100000011110100001010011111110011101111110,JQYFQEUEMPRQHT-MSOLQXFVSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)N[C@H]4[C@H](C3=C(C)[N](N=C3)C)OCC4,B2BE0E085BBCC2AD_AB8E66CAC9EBAD16_7022_UN,8.4671335,00000000000000000000001000000000000000000000000000001000010000100100000000010000100100010011011111000001100101010000001011101100000011110100001010011111110011101111110,INZQYWOVPBKMSR-MSOLQXFVSA-N
CC1=C(C=C(C(=C1)NCCC2CCCN2C)Cl)C3CC3,5355ED23CC2A9197_DB36509471BEE21A_7022_UN,8.106243,00000000000000000000001000000000000000000000000000000000000000100000000000010000101101110001010010001001100110010001101001100000110001110110001010011111010110101111010,CEOJPTUWIMDZFC-UHFFFAOYSA-N
CC2=C1[NH]C=CC1=CC(=C2)NCC3CCCN(C)C3C4=CC=CS4,3D4E0F3E08C2C695_3BD1460B891EC0F5_6041_UN,8.552225,00000000000000000000000000000000000010000000000000000000000000100100000000010000111101101011010010101100010010010001101011100100110101010110001001011111010110101111010,HKMQLZGYNLVFGO-UHFFFAOYSA-N
CC1=CSC2=C1N=C(N=C2N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F)C5CC5,D0434FF828252FCB_9C33A095F361F4F1_6041_UN,8.821039,00000000000000000000001000000000000010100010000000000000000000100100000000010101110101111011010010101100110110010001101011100100000001110100001011011111010010101111010,YWGGFTKSHXJFIX-AEFFLSMTSA-N
CC1=C(C=CC(=C1F)C#N)NC2C3(CCNC2)CCOCC3,B7359C2A8788AD17_3BFD46A7F2CAF67D_6041_DP,7.7865696,00000000000000000000000000000000000000000110000000000010010000000010000000000001001000110011000000101000110101011000001011000000110111110110001011010011010011101111110,YTHOUPOORPUSLL-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)N[C@H]4[C@H](C3=NC=C[N]3C)OCCC4,8AF25477855EA067_9F3137115572C23B_6041_UN,7.770756,00000000000000000000000000000000000000100010000000000000010000100100000000010101100101010011010110100100110101010000001011100100110011110100001011011011110011101111110,MKHPNZOPBNIYJI-IAGOWNOFSA-N
N1CCCCC1C2=NC=C(C=N2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,A0D7B452D1493AEE_99168315E0AB6F29_6041_DP,8.401226,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100110101110110001001011011010010101111010,NVQFSOYPLJDADT-KGNCLDLBSA-N
CN(CC1CCNC1)C2=NC(=CN=C2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,349490FE9EC4C7D2_D3C0E2946C32772D_6041_DP,8.208752,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000100110010001001011100100110101110110001011011011010110101111010,LAIDFZKUDMDZJV-NOYMGPGASA-N
C[N]1C=C(C2=C1C=CC=N2)NCC3(CCC3)C4=C(C=NC=C4)F,10A64D8487D2BC53_4F5C02B15927AA71_6041_UN,7.922377,00000000000100000000000000000000000000000010000000000000000000100110000000010001101101010011010010101100010100001000001011100100110001110100001011011011010110101111010,CMEUWBAWHQGOHO-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NC[CH]3C[C]2(C[C](C)(C2)C)C3)F)F,DEE2BBEAC2FE7A94_A8B02C4643DAE173_7022_UN,8.536101,00000000000100000000000000000000000000000010000000000000000000000010000000100000001000010010000000001000010110001001000000000000100001110000010010000111010110101111010,UXQLLYLIAVEPTL-UHFFFAOYSA-N
C2(=C1CCCCC1=CC=C2)NCC3=CC(=C(C=C3)F)CN(C)C,69748388D287C2EB_BF0D900640BA01FF_6041_UN,7.9259806,00000000000000000000000000000000000000000010000000000000000000000000000000100000001001110011010000001100010100000001001000100100110001110010001011011111010110101111010,ZEDBTJLJLASGEZ-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2OCC=CC2)F)CC3,4CFCE70229A6602B_0C92533D8B291895_6041_UN,7.682968,00000000000000000001000000000000000000000010000000000000010000000000000000010001101001110011010100111000000111010001101011100000110011110110001011011011110111101111110,JMMANRFEBZBWRL-UHFFFAOYSA-N
C1(=C(C=C(C=C1)F)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,9A4C7C00670CA51C_F201E6A6454C42BD_7022_UN,8.51766,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,UGMHEXZVRBQKHH-YJYMSZOUSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC(OC)C2CCCOC2)F)CC3,73BA6ACD22DE5546_3D730CBD7DDCD828_6041_UN,7.423195,00000000000000000001000000000000000000000010000000000000010000000000000000010001101001110101010100101000000111010001101011100010110011110110001011011111110111111111110,PNYTYBRPHGHOCJ-UHFFFAOYSA-N
C1(=C(C=C(C=C1)F)Cl)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,81ABDF1252810882_67C0E15A2FFD0C5C_7022_UN,8.517642,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,NGUKMIFBLIGNCN-YJYMSZOUSA-N
C1(=C(C=C(C=C1)Cl)Cl)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,041715AEF5F957EA_7DA55468C0434C73_7022_UN,8.517645,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,LMBWYWACXXDSHQ-YJYMSZOUSA-N
C1(=C(C=C(C=C1)Cl)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,AF07446873E0BA48_9059E0DA17C6E7ED_7022_UN,8.517621,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,VZVWNHKUMSOEJJ-YJYMSZOUSA-N
C[N]6C=C(CC2CCC3=C(C1=CC=CC(=C1)C)C4=C(N=C23)SC5=C4CCCC5)C=N6,527C370978FEE247_17E1AE5EB130FB91_2201_UN,8.436029,00000000000000000000000000000000000010000000000100001000000000100100000000010000110100001000011010100100010010000000001011101100110000000100001011011100000110101111010,PXQSZOZMJGVLLR-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2CC2)NCC3C(CC)CCCC3,D630675C061C7498_E23A2E980FE36153_6041_UN,7.4489684,00000000000000000000001000000000000000000010000000000000000000100000000000000000001000010011000000001000000110000010101000000000110001110000000011010011010110101111010,OOKPOQFYRBDIMK-UHFFFAOYSA-N
C(C1(CC1)C2CCCO2)=CC3=C[N](C)N=C3C4=C(C=CC(=C4)F)F,098C9B38616EB833_BF1E351F369D8215_7019_UN,8.201764,00000000000000000000001000000000000000000010000000001000010000100110000000010000100100010000011010010000000101001000001011101100110010100100001010011010110011101111110,QPRKDKIRJVMSSL-UHFFFAOYSA-N
FC2=C1N=CC=CC1=CC(=C2)NC4C[C@H]3CCC[C@H](N3C)C4,749E9E3FDFC7400D_A24C656ED1D56DC8_6041_UN,8.321146,00000000000000000000000000000000000000000010000000000000000000000100000000010000100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,YLHYZGWAVADWAO-MQVJKMGUSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2N=CC=C(C2=CC=C3)Br)C4,847C9AD3ED71284B_1CBD41B932EFD80D_6035_UN,8.271904,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000010111101100010100000101001001100111110000100100001101011110110111101111110,MAALWVSDDWTHJP-QRDCCXFBSA-N
CC1=C(C=CC(=C1F)C#N)NC2CNCC3(C2)CCOCC3,0888E784C4376FA5_D9AB51964449D58D_6041_DP,7.765189,00000000000000000000000000000000000000000110000000000010010000000010000000000001001000110011000000101000110101011000001011000000110111110110001011010011010011101111110,FMFBEUILFBXQDV-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC(CC)C3CCOCC3,E15FCB7EE1F8D77C_DF16B80B0DE51452_6041_UN,8.02381,00000000000000000000000000000000000000100010000000000000010000000100000000000100000000110011000000100100110111010010001011000100110011110110011011010111010111101111110,IFBFQBWUDJKYDE-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NCC2C(CCNC2)(C)C,AD92CA4047E4B104_73C24C9AD31D4969_7022_DP,8.526104,00000000000000000000000000000000000000000110000000000100000000000010000000100000101000110011000000101001100100011001101001000000110101110110001011010111010110101111010,NMUHDDWNMCRBPW-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCNC(C2)(C)C)F)CC3,FEE5AD6BD2A9D708_42C46EC70E31659A_6041_DP,7.9523854,00000000000000000001000000000000000000000010000000000000000000000010000000110001101001110011010000101000100110011001101011100000110101110110011011011111010110101111010,UGKUBLBWWKPTKF-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC3CCN(C)C4=C3C=CC=C4)F,CAE948005BDA35C6_E1ED02061B5BCF0B_6041_DP,7.632778,00000000000000000000000000000000000000000010000000000000000000000000000000010000001001110011010000101100110100010001101011100100110101110110001011011011010110101111010,LTKAXYALAYCCQW-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3C(CCN3)C4CC4)Cl,FCE7582437147233_F52BC97E82378FF6_6034_DP,7.726548,00000000000000000000001000000000000010000000000100000000000000100100000000010111011101011011000010001001101110010000001111100100110101110110001010011011010110101111010,QXNWYMBIGVWUBG-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3CCNC(C)(C3)C)Cl,C591BEB62595BBAA_6FD657D8B7CA59E0_6034_UN,8.346949,00000000000000000000000000000000000010000000000100000000000000000110000000110110011101011011000010101001101110011001101111100100110101110110011011011111010110101111010,RMFBGXIORZRXNY-UHFFFAOYSA-N
C1(=C(C=CC=C1)Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,75DD73817F75EDE6_757BCEA2ED69D6C7_7022_UN,7.92128,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101001000100010000001011101100110001110110001011011011010110101111010,MXKHSMMBXTUBCV-KUHUBIRLSA-N
CN(CC1CCNCC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=CC(=C(C=C4)F)F,F8B259BE4B474529_7BC9DD1E28C46D79_6041_DP,8.518446,00000000000000000000001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010001001011100100110101110110001011011011010110101111010,PEDOCTJYHCMUBL-MAUKXSAKSA-N
C1(=C(C=CC=C1)Br)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,01CFEF51E0C5AD98_FDF687BA91B8764A_7022_UN,7.9212704,00000000000000000000001000000000000000000000001000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,URMOCFZNRXTQHP-KUHUBIRLSA-N
N1CCOCC1C2=NC=C(C=N2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,256D7BD3DB23D12F_4090EBA1613E5EFE_6041_DP,8.428947,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101110011010111101000100111010001101011100100110111110110001001011011010011101111110,UWRZXDLEQCAZJE-BLAYRMRBSA-N
CC1=C(C=CC=C1Br)NCC3(C2CCNCC2)CCOCC3,C7B33D6A4E59A01A_F27B184A0F900941_7022_DP,8.309755,00000000000000000000000000000000000000000000001000000000010000100010000000000000001000110011000000101000100111011000001011000000110111110110001011010011010111101111110,QKSRMFGHZJXALO-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC3(C2CCNCC2)CCOCC3,E1B600903EE3A38B_2E784A56A6DE9D73_7022_DP,8.309743,00000000000000000000000000000000000000000000000000000000010000100010000000000000001000110011000000101001100111011000001011000000110111110110001011010011010111101111110,UWRFEKRHHWMCAV-UHFFFAOYSA-N
N1C4CCC1C(CNC(=O)C[N]2C=CC3=C2C=C(C=C3)F)C4,E243EBA346E17CE2_A0A5695EAF9EF48E_6038_DP,8.130754,00000000000000000000000000000000000000000010000000000100000000000100000000010001101101010011100110001100110100110000011011100100110110100110001001011001011110100111110,MQSHVTIBIWOHEV-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCNCC2C)F)CC3,2C5A3F64D9B67D19_285981278760E8AC_6041_DP,8.096113,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010000101000100110010001101011100000110101110110001011011111010110101111010,XPEQDCIFWXYYAX-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCCCC3C4=CC=CC=C4,8422257A6A5C6469_33E48F1C0248384A_6041_UN,7.885994,00000000000000000000000000000000000000000010000000001000000000100100000000010000101100010011011010001100010100000000001011101100110001110100001001011011010110101111010,KCIDPDPZNQQBBK-UHFFFAOYSA-N
N4CC1=C(C=C(C=C1)NC2=C[N](C[Si](C)(C)C)N=C2)C3(CC3)C4,8B67E297CCE45F4A_F223CA389E00319C_6041_DP,6.9074793,00000000000000000000101000001010000000000000000000001000000000000110000000110001101100100011011010101100010000011001000011101100110101010110011011011101010110101111010,LRCSPQVXUZBCTQ-UHFFFAOYSA-N
NCC1(C(CCC1)OC2=C(C=CC(=C2)C3CNCCC3)F)CC4=CC=C(C=C4)F,5DC1AA5D3CEC3FFD_6E710E31384683D3_6035_UN,8.07126,00000000000000000000000000000000000000000010000000000000000000100010000000000000001010110011000011101000100100011100001001000111110110100110001111010011110101100111110,ZDAJBVRABOIDOL-UHFFFAOYSA-N
FC2=C1C=NC=CC1=CC=C2NCC3CCCN(C)C3C4=CC=CS4,5F6780DE6A903BA2_54FF5095178EF6FD_6041_UN,8.735499,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,IVHPWAYNJXLEMK-UHFFFAOYSA-N
FC2=C(C=C1C=CN=CC1=C2)NCC3CCCN(C)C3C4=CC=CS4,E28FB3C5B2E9D092_738C626F5D24DE2A_6041_UN,8.808826,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,QVSFECYWYTVSHI-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@H]3[C@@H]2N(CC[C@@H]2CC3)CC4=CC=CC=C4)Cl)C5CC5,442F5AD05716A66F_E279D9E2C9AEEB08_7022_UN,8.46469,00000000000000000000001000000000000000000000000000000000000000100000000000010001000101110011000010001101110110010000001001100100110001110110001011011011010110101111010,XMEPTCCPSOHKOH-BPUDTRNYSA-N
C[Si](C)(C)C#CC1=CC(=NC=C1)NCC2=CC=CC3=C2CCCN3,E7069C1BA2C8E4A1_DF0FBC0DD1B995CD_6041_DP,8.219777,00000000000000000100100000000010000000100000000000000000000000000100000000100100001000100011010000101100110000011000001011000100110101010110011011011101010110101111010,LGZZGMOLDIJFCO-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CC=N2)NC(CC)C3CCCCC3,A293267BDCFAA508_9137CC893C00D070_6041_UN,8.000448,00000000000000000000000000000000000000000010000000000000000000000100000000000000100000010011000000100100110110010010001001000100110001110100001001010001000110101111010,WJUZIWMYQDNDJO-UHFFFAOYSA-N
CC(C)C2=C1N=C(C=C(C1=CC=C2)C)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,000C112DF015B6F7_EA4660F8C81DAE8D_6041_UN,8.124257,00000000000000000000000000000000000000100010000000000000010000100100000000100100001100010011000011101100010101000000001011000100110011110110011001010111110111101111110,OTYYAYJIGMYUMC-UUOWRZLLSA-N
NCC23CCCC(CN(CC1=CC=CC=C1)C2)C3OC4=C(C(=CC=C4)C5CNCCC5)F,176266E5C0C969DE_084C1589D1576D55_6035_UN,8.22134,00000000000000000000000000000000000000000010000000000000000000100010000000010000101011110011000001101100110100011100001011100111110100100110001111011011110101100111110,DJSCABXGCYHTCS-UHFFFAOYSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC3=CC2=C(CCCN2)C=C3,62843325B763613E_FBC683CE32064087_6041_DP,7.8761253,00000000000000000000100000000010000000000000000000000100000000000000000000100000101000100011010000101100110000011001001001000100100101010110011011011111010110101111010,NVYONEFVJIHUNF-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C3=C2CCCCCC3)CC4=NN=C([N]4C)C5CNCCC5,97DAE1E8400F73AB_03A79AE26166B72B_6034_UN,8.1959305,00000000000000000000000000000000000000100000001000001000000000100100000000010101101101110011011010101100110110010000101011101100110000100110001011011011010110101111010,RTAYRLPDSBLDDI-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CNC3CC23)F)CC4,6A64741B8A364441_C894DE737719F93A_6041_DP,7.943671,00000000000000000001001000000000000000000010000000000100000000000000000000010001101101110011010010101000110110010001101011100000110101110110001011011011010110101111010,ODIBKRMKUBLXRD-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCCC3C2CC2CCC3)F)CC4,75F91CA32540940B_1549D60D3FE94FF5_6041_UN,8.197947,00000000000000000001001000000000000000000010000000000000000000000000000000010001101001110001010000001000110110010001101011100000110001110110001011011011010110101111010,JMFYLUXWQMCOID-UHFFFAOYSA-N
CN6CCC(CNC(=O)C1C4C2CC5C3CC(C1C23)C45)C6C7=CC(=C(C=C7)Cl)F,21C72A1A0C46E3D5_9DFEE36E27BAEA4E_6038_UN,8.662478,00000000000000000001000000000000000000000010000000000000000000100000000000010000101101110011110010001101010110110001111001100000110000100110001011011011011110101111110,RZWPBRDPEMZZOB-UHFFFAOYSA-N
CC1=C(C3=C(C=C1)N=C2CCCCC2=C3NC[C@H]4[C@H](CCNC4)C5=CC=C(C=C5)F)F,0FB3F945D51383C7_B881DCB2B6576829_6041_DP,7.814465,00000000000000000000000000000000000000000010000000000100000000100100000000000000101000110011000000101100110100010000001011000100110101110110001011010011010110101111010,DSTZAENZAOWIOJ-AZUAARDMSA-N
FC2=C1CCCC1=C(C=C2)NCC3N(C)CC4(CC3)CCC4,678C61FA04C2754D_829633A95417B1F8_6041_UN,7.06505,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010010101100010110011001101001100000110001110110001011011011010110101111010,UKJGURJYUBXGJL-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2CCCC3=C2C=CC=C3,2F835AD8C8BE7A48_33AABF9C611A0864_6041_UN,8.036244,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100011010000100100110000011000001001000100100001010100011011011111000010101111010,VPKJRZKXYUGFQV-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC[C@H]2OC[C@H](C)CC2)F)CC3,CA258B72808E27DD_2EC826171896E927_6041_UN,7.493823,00000000000000000001000000000000000000000010000000000000010000000000000000010001101001110011010100101000000111010001101011100000110011110110001011011111110111101111110,FFZRCCIYCVKSFX-APWZRJJASA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CCCC3)C4=C(C=C(C=C4)F)F,AF2C3662B1F516D3_F426EC2742E1CA24_6041_UN,7.831793,00000000000000000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100110001110100001010011011010110101111010,BNEVXIKOGFADKU-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC3(C)C4CCC(C3)O4,1C312A6602DB7AA7_BB5B40B1D3D430D2_6041_UN,8.238411,00000000000000000000000000000000000000100010000000001000010000100110000000010101101100010011011011101000010110001001101011101100110011110100001011011111110111101111110,QJIUFICMOORYCC-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC4(C3CCNCC3)CCOCC4,4CCDE6D4892B4D0C_47ACA39E753D133C_6041_DP,8.309432,00000000000000000000000000000000000000000010000000001000010000100110000000010000101100110011011010101100110101011000001011101100110111110110001001011001010111101111110,VXCXHADZZPHZFE-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@H]2[C@@H](OCCC2)C3=CC=C(C=C3)Cl)Cl)C4CC4,52BB2A8ADD8D68A6_F4D37123F7EF6C40_7022_UN,8.772236,00000000000000000000001000000000000000000000000000000000010000100000000000000000000000010011000100100001100111010000001000000100100011110100000011010011110011101111110,KMHZWMVVEPPYPU-CTNGQTDRSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC3N(C)CC4(CC3)CCC4,B062CF152B7D6E4C_8527A0EA1E8C8FF4_7022_UN,8.030692,00000000000100000000000000000000000000000010000000001000000000000110000000010001101101110011011010101000010110011001101011101100110001110110001011011011010110101111010,GLXDJTVYOYMPBH-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCCC2(CNC2)C)F)CC3,579D343DCEAD01ED_4F4D50AFA5F0A0DC_6041_DP,8.00934,00000000100100000001000000000000000000000010000000000000000000000010000000010001101001110011010000001000100110011001101011100000110101110110001010011111010110101111010,LCLMMYRHHFULAI-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CC3=C[NH]C4=C3C=CC(=C4)F,E9A6CB04D9FBF679_8BEE11FAD5CC263E_6038_UN,8.064116,00000000000000000000000000000000000000000010000000000000000000000100000000000000001100010011100010001100110100110000011001000100110110100100001001010001011110100111110,DDIQBZOEHQYLSC-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CCOCC3)C4=CC(=CC=C4)F,5DD2D21D9DBEA181_C5B211B9A7058DE9_6041_UN,7.86759,00000000000000000000000000000000000000100010000000000000010000100110000000010100101101110011010010101000000111011001101011100100110011110110001001011011010111101111110,ZHUPKIOVQAPHRH-FQEVSTJZSA-N
CC1=C(C3=C(C=C1)N=C2CCCCC2=C3NCC(C4CCNCC4)C5=CC=CC=C5)F,8E8E1E2F180A263E_7B92666A8A7B1638_6041_DP,7.7254143,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000110011000000101100110100010000001011000100110101110110001011010011010110101111010,HNIINLDANVYXIN-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CNCC23CC3)F)CC4,0D555EDB57AB7098_8AD87C43E693B3F2_6041_DP,7.508808,00000000000000000001001000000000000000000010000000000110000000000010000000010001101101110011010010001000110110011001101011100000110101110110001010011011010110101111010,AXOKVKPCCXCBHM-UHFFFAOYSA-N
CCC3(COC2=CC=C([C@@H]1[C@H](C)CCNC1)C=C2)COC(CI)C3,99DC6C39A941073B_2CB8F704DAB22B4E_6035_UN,8.582728,00000000000000000000000000010000000000000000000000000000010000100010000000000000001100100101000010101000100001011111101011000011110010100110000101010111110101111111110,GZQAAWAPBRJWAW-CIILZPPKSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)N[C@@H]3CNC[C@@H]3CC4=CC=CC=C4,9B21A54495B54E9F_9921EB07A5C78A3A_7022_DP,7.7070494,00000000000000000000001000000000000000000110000000000110000000100010000000000001101100110011000010001000100100011000000001000100110101110110001011010011010110100111010,LZYBVJOFDKJLAI-OXJNMPFZSA-N
C(C1CC2CCC1O2)=CC3=C[N](C)N=C3C4=C(C=CC=C4)Cl,21FBE3862DCC358D_674A548C14A4038A_7019_UN,7.9287186,00000000000000000000000000000000000000000000000000001000010000100100000000010000100100010000011010010001010100000000001011101100110010100100001011011010100011101111110,CFXRYPVOBVWGTQ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NCC2C(N(C)CC2)C3=CC=CC=C3)C4OCCO4,7C991D259EDD405E_7E660EFD571D388A_6041_UN,7.840044,00000000000000000000000000000000000000000010000000000000010000100000000010010000101101110011010010001000000111010001101011110100110011110110001011011011010111111111110,PRVFTMANMYDJLV-UHFFFAOYSA-N
FC1=CC(=C(C=C1)CCC#N)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F,039F4383288561D0_00569869D5754084_6041_DP,8.136679,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,IHXRUGQELCERSK-OXQOHEQNSA-N
OC(CF)C1=CC(=CC=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,20BD5E3C5DE298DD_CC4DF67855BA11CF_6041_UN,8.7108755,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101000011010010101000100000010000001011100100110111110111001011011011110111101111110,NMIDJXYVVWIYEG-GSZILNDISA-N
FC1=CC(=C(C=C1)NCC2C(N(C)CC2)C3=CC=CC=C3)C4CC4,5F2421A5170527BA_F528F245745BEA86_6041_UN,8.251485,00000000000000000000001000000000000000000010000000000000000000100000000000010000101101110011010010001000000110010001101001100100110001110110001011011011010110101111010,MSMSGLYBUPJFLM-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC[CH]2C[C]3(C2)C[CH2]C3)F)CC4,606D61820B3EE9DD_25F1322C79B7C68F_6041_UN,7.394867,00000000000100000001000000000000000000000010000000000000000000000010000000010001101001110010010000001000010110011001101011100000110001110110001010011011010110101111010,UHADOGRDPQPAAO-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)F)F,57E066314F246FB3_B4128724B99FB2E0_7022_UN,8.757295,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110011011011111110111101111110,RXRDAWKTRSNZHM-YOEHRIQHSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC23N(CCOC2)CCOC3)F)CC4,4E5838788F911CA9_BD97B090FDF3CAF2_6041_UN,7.026667,00000000000000000001000000000000000000000010000000000000010000000010000000010001101001110111010101101100010111011001101011100000110011110110001011011011010111111111110,SJCMWFDKTAHIGJ-UHFFFAOYSA-N
FC1=C(C=CC=C1)C2=CC=C(C=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,8963E47DE777D50D_6D52007C5CBED27B_6041_UN,8.575418,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,IQFPUPHNTAUGJT-CLOONOSVSA-N
FC2=C(C=C1C=COC1=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,62C04F20F0747BB6_1AB6C6161B5BE129_6041_UN,8.553135,00000000000000000000001000000000000000000010000000001000010000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011110110101111110,FYMMVWVUCUZHAS-VFNWGFHPSA-N
C1(=CC(=CC(=C1)F)COC2CCCCC2)NC[C@@H]3COC[C@H]3N(C)C,C9D4EB127C235362_06D8D916B6F50CD3_7022_UN,8.221242,00000000000000000000000000000000000000000010000000000000010000000000000000100000101101110011010111001000000111010000101000100011110011110110001101011111110111111111110,FXSHPNJLTYFUIG-OXQOHEQNSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@@H]2COC[C@H]2N3CCOCC3)F)CC4,CF4EE227E12AC1D0_253E45F29A0B3DF5_6041_UN,7.467802,00000000000000000001000000000000000000000010000000000000010000100000000000010001100101110011010111101000100111010001101011100000110011110110001011011011010111111111110,IXJRLUSHOCWKBF-NHCUHLMSSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC[C@@H]4CCN(C)[C@H]4C5=CN=CC=C5,2B3ECD092590261C_DF650208B02880A6_6041_UN,8.267198,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101110011010010101100010111010001101011100100110011110110001001011011010111101111110,ZEKNTFHVCZZOOH-AVRDEDQJSA-N
N(CCC12CC(C1)CO2)C(=O)C3(CCCC3)C4=C(C=C(C=C4)F)F,A56F9AD6A1484EC0_4756FC244299734A_6038_UN,8.04566,00000000000100000000000000000000000000000010000000000000010000100010000000000000001100010011100011001000110101111000011000000000110010100110000010010011111111110111110,UJKPLEUZZDSUCX-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2CCOCC23CCCC3)F,C88049DF8F6C606D_BA48784196EEB08B_7022_UN,7.4769278,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110011010011101000110101011001001000100000110011110110001011011111010111101111110,UFCKFCSQSKNZGT-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NCC(CC)N3CCCC3,22B69889903F2A82_2DA7F31265370C96_6041_UN,7.368747,00000000000000000000000000000000000000000010000000000000000000000000000000010001001101110011000010001100010110010010101001100000110001110110001010011001010110101111010,ZQCGNSFMXWBWOT-UHFFFAOYSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C([C@H]4CNC[C@@H]4C5=C(C=C(C=C5)F)F)=O,0EDDD9C869AC8AF0_652C7297C3D4DD93_6038_DP,7.7056203,00000000000000000000000000000000000000000010000000000100010000100000000000000000101100110011100011001100010100100000011011000100010111110110001011010011111011110111110,CVFQQVPSPXYEQY-OMGLFLRBSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCOCC23CCC3)F)CC4,9C0F2D597FDEF355_76F5816B349EC200_6041_UN,7.115893,00000000000100000001000000000000000000000010000000000000010000000010000000010001100001110011010001101000110111011001101011100000110011110110001011011011010111101111110,QROXSVWHDBREJM-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)N[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,EFB626BAA0645E40_B610CBEBB7502916_6041_UN,8.417014,00000000000000000000000000000000000000100010000000000000010000100100000000010100100101110011010111101000100111010001101011100100010011110110001011011011110011101111110,CXPXRHPJPPBOLV-QYZOEREBSA-N
FC2=C1CCCC1=CC(=C2)NCC3CCCN(C)C3C4=CC=CS4,3DC10E13F448A605_E7AE0ABA59CB3D3B_6041_UN,7.9165664,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,OXSIOHMHNPZNRM-UHFFFAOYSA-N
FC1=C(C=C(C=C1)CC#N)N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,5E1EE6F591C09FB2_1B66C3D900BD548E_6041_DP,7.495702,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,SAHNBEFNDDXWKE-VQIMIIECSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=C[NH]C4=C3C=CC(=C4)F,EE753ADBAC8A3549_75417B5A501E48B0_6038_UN,7.7929115,00000000000000000000000000000000000000000010000000000000000000000100000000000000001100010011100010011100110100110000011001000100110110100100001001010001011110100111110,FVSCCOHPLQRWLW-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)F,316B48CBD087710E_8581B7B5D74110EF_6041_UN,9.054146,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,GNVVJXIOGNYHMC-HOCLYGCPSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2C3=C(CC2)C=CC=N3,2243F97F6FAB1101_8851727C93C6D16E_6041_UN,7.9848843,00000000000000000000100000000010000000000000000000000000000000000100000000100001101000100011010010101100010000001000001011000100110001010100011011011111010110101111010,PRUAINJBDIPGCZ-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)NC3CCN(C)C34CCCNC4,E0EC1654EAD990DF_8335AB646B7CC8C0_6041_DP,7.5782013,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101110011010010101100110110011001101011100000110101110110001011011011010010101111010,CFPRXNXSZPIMKC-UHFFFAOYSA-N
N(CC2=NC1=C(C=CC(=C1)F)O2)C(C3CC4CNC3C=C4)=O,34C962C4EE1FA425_016181D65D6D0B20_6038_DP,8.04343,00000000000000000000000000000000000000000010000000000100010000000100000000000001101100010010100111111100010100110000010011000100100110100110001001000001111110110111110,TZBQWGRRBQOJEN-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)SC=C2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,25946C0F234C0425_A7144C3737803BFD_6041_UN,8.486253,00000000000000000000001000000000000010000010000000000000000000000010000000100000011100011011000010001100010100001001101000000100110001110100000011010111010110101111010,BPHRCKSYZCFDMV-UHFFFAOYSA-N
CC1=C(C3=C(C=C1)N=C2CCCCC2=C3NC[C@@H]4CCN(C)[C@H]4C5=CN=CC=C5)F,DDDCB28699FE9B5E_15A64CF693EB5EBA_6041_UN,7.857421,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101100010110010001101011100100110001110110001011011111010110101111010,WVLLKKMYWFARDH-BVZFJXPGSA-N
CC2=C1N=CC=C(C1=C(C=C2)NC4=C(C=C3OCCOC3=C4)[N](=O)=O)F,9E7610AE1856117E_8EA78B8BFC4D7E22_6041_UN,8.403976,00000000000000000000000010000000000000000010000001000000110000010100001110000001100000010000001001100110010101000100001111101100001011110110101011111011110011111111110,LTHYATCOCOFWHG-UHFFFAOYSA-N
FC2=C1C=NC=CC1=CC(=C2)NCC3CCCN(C)C3C4=CC=CS4,5CD7007C9C36C962_E9AF27E327F6CECF_6041_UN,8.783482,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,MUOHPJMXLPNDQN-UHFFFAOYSA-N
NC2=NC1=C(C=CC=C1Cl)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,CF1B52BE8D5B5298_479C78C52E4B08D6_6034_UN,7.935195,00000000000100000000000001000000000000000000000000000000000000000110000000110101000111010010000010001101011110001000101011100100110001110100001011011111010110101111010,KEGQXJILRHFVQZ-RAMGSTBQSA-N
NC2=NC1=C(C=CC=C1Br)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,244D079AA68352D2_09297A9296466E84_6034_UN,7.935191,00000000000100000000000001000000000000000000001000000000000000000110000000110101000111010010000010001100011110001000101011100100110001110100001011011111010110101111010,NIMBDCMSFAXFNP-RAMGSTBQSA-N
CC1=C[N](N=C1)CC2=C(C=C(C=C2)NCC3C(C)(SCC3)C)F,EC8186654CD83141_3A8FFA2571B9C678_6041_UN,8.726478,00000000000000000000000000000000000010000010000000001000000000000110000000110000111100011011001010001000000110011000101011101100110001110110011010011111010110101111010,YLSPJIHMSDAQMO-UHFFFAOYSA-N
CC1=C(C=CC=C1Br)NCC2N(C)CC3(CC2)CCC3,B26F33BD370BE390_EB9FAFA95ED88AC6_7022_UN,7.4180636,00000000000100000000000000000000000000000000001000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011111010110101111010,BOTSSVWMHOQABM-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC2N(C)CC3(CC2)CCC3,F1D97CADEFDD188C_379CFDB5F7961EF4_7022_UN,7.4180565,00000000000100000000000000000000000000000000000000000000000000000010000000010001001001110011010000101001010110011001101001100000110001110110001011011111010110101111010,RMPOMYVURPKXKL-UHFFFAOYSA-N
NC2=NC1=C(C=CC=C1F)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,B66A91EA6B13D968_94F3FE5046FA4962_6034_UN,7.935159,00000000000100000000000001000000000000000010000000000000000000000110000000110101000111010010000010001100011110001000101011100100110001110100001011011111010110101111010,SFDFJWIXYQFFEL-RAMGSTBQSA-N
CC1=C(C=CC=C1F)NCC2N(C)CC3(CC2)CCC3,B5678FBF8CA8CF71_D9BD2A87AB477AEC_6041_UN,7.418048,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011111010110101111010,MOBFZIVYGSKARD-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=CC2=O)C[C@H]4N[C@H]3CCCC[C@H]3C4,CFE4425C2E04A46A_780935C6F8001B0C_6034_UN,8.92176,00000000000000000000000000000000000000000000001000000000000000000100000000010001000101010011000011101100110100010100001011100101110000100100001101011001111110100111110,TVXLJUKXKOYBMN-NOLJZWGESA-N
CC1=C(C=C(C(=C1)NCC2CCCN(C)C2C3=CC=CS3)Cl)C4CC4,6147E64B6C3BBB51_3E571DB6A839115E_7022_UN,8.110469,00000000000000000000001000000000000010000000000000000000000000100000000000010000111101111011010010101001000110010001101011100100110001110110001011011111010110101111010,URAYXJXKSPHXJH-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)Cl)C4CC4,3238DB678B812102_3F0667B0D67490F0_7022_DP,8.816949,00000000000000000000001000000000000000000010000000000100000000100000000000000000101000110011000000101001100110010000001001000100110101110110001011010011010110101111010,IAKFDZVBYBTEFZ-PKOBYXMFSA-N
C(CC2C1CC3CC(C1)CC2C3)=CC4=C[N](C)N=C4C5=CC(=CC=C5)F,26F013F9BC200133_A9CD24D317F883DF_7019_UN,8.131531,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010100010100000000000011101100110000100100001011001010000110101111010,WZQIANDOLCTTJC-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCCC3CC(C)CC3,52E31D225B5AA4ED_4226780ABD526944_6041_UN,8.159628,00000000000000000000000000000000000000000010000000001000000000000100000000010000101100010001011010001100110110010001101011101100110001110100001000011101010110101111010,XBCULIOYSMCGEK-UHFFFAOYSA-N
FC2=C1C=CC=C(C1=CC=C2)NCC3CCCN(C)C3C4=CC=CS4,9A0F2EA6CC2EEBF9_1D77C12EFE464066_6041_UN,8.6467705,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,SPYPGJNBYHECHG-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CN(CCO3)C4CC4,DA81E9CCE9455968_8F175CEB00A951C9_6041_UN,7.8434405,00000000000000000000001000000000000000100000000000000000010000100100000000010100101001100011000100101100010011010000001011100100110011010110011011011111110111101111110,SRBKHIWJMYHHTL-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C=N[N]2C3CCCCO3)NC4=CN=C([Si](C)(C)C)C=C4,96E4905BA87F5B0A_A173BE9BB8B53020_6041_UN,7.7018957,00000000000000000000100000000010000000000000000000001000010000100100000000110001100100100000111110100100010001111000011011101100110011010100011001011101010011101111110,HOPXEBVYNWPCMB-UHFFFAOYSA-N
N(C1C2CCC(CC1)O2)C(=O)CC3=C[NH]C4=C3C=CC(=C4)F,B42B85DC95D49F2A_F22FE19530225B9D_6038_UN,7.7632036,00000000000000000001000000000000000000000010000000000000010000000100000000000000000100010011100110100100110100110000011011000100110111100100001001010001101111110111110,LCRKEUKTPUDKLF-UHFFFAOYSA-N
FC2=C(C=C1C=CC=NC1=C2)NC4C[C@H]3CCC[C@H](N3C)C4,367211904ED4157F_9A969D7649400C00_6041_UN,8.44575,00000000000000000000000000000000000000000010000000000000000000000100000000010000100001010001010000100100110110010000101011100100110001110100001011011011000010101111010,LJZVHVRPLXMRLR-GOOCMWNKSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)C[C@]34CNC[C@H]3CN(C)CC4)Cl,A35AA0932E55AD1D_1F4B41924E5E0862_6034_UN,8.16494,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101111011010010101101011110011001101111100100110101110110001011011111010110101111010,CCIVMEROTVNFAP-JXFKEZNVSA-N
C1(=NC(=CC=C1)C2OCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,91A1D376B94ACBE9_73EA324AB79AE4BF_6041_UN,8.284052,00000000000000000000000000000000000000100010000000000000010000100100000010010101100101110011010110101000100111010001101011110100000011110110001001011011010011111111110,DRAKUZOWUTVJIT-QAPCUYQASA-N
FC1=C(C(=CC=C1)C2CC2)NCC3C(N(C)CC3)C4=CC=CC=C4,B7D41B1D0D7EBA29_7AEE5942A51CDC55_6041_UN,8.480476,00000000000000000000001000000000000000000010000000000000000000100000000000010000101101110011010010001000000110010001101001100100110001110110001011011011010110101111010,FMQYNXIQMAIQON-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)F)NCC2CC3CCC2N(C)C3)F,0A972FF0974A93B8_B757645D729CBAC3_6041_UN,8.325537,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001110011010000101000010110010001101001100000110001110110001011011111010110101111010,HIZOLPCNTKDBID-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCSCCC3,6EABF898D6AA1F1A_F719AFD2BA8CE757_6041_UN,7.550986,00000000000000000001000000000000000010100010000000000000000000000100000000000100001000111011000000101100010110000000001011000100110001110110001011010111010110101111010,ZSVVHWGRDLEJHW-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3CC2CCOCC2CC3)F)CC4,86209D0743102DA2_8FD8C6DA9AD80D3C_6041_UN,7.7906957,00000000000000000001000000000000000000000010000000000000010000000000000000010001101001110011010000101100010111010001101011100000110011110110001011011011010111101111110,VNCHUGBAJIKQRX-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3C4CCC(C3)CC4,C10BF08DD8B8399B_EEC9FC73795F189F_6041_UN,8.533677,00000000000000000000000000000000000000000010000000001000000000000100000000010000101100010011011010001100010100000000001011101100110001110100001001011001010110101111010,VKRMEWJFLZNBRO-UHFFFAOYSA-N
CN(C)C1=C2C(=CC=N1)C(=CC=C2)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F,82610445102E7E30_A560113E9FED6935_6041_DP,8.409313,00000000000000000000000000000000000000100010000000000010000000100100000000100101001001110011010000101100110100010000001011100100110101110110001011011111010010101111010,GIADUHVKPOZWGI-QVKFZJNVSA-N
C(C1(CC1)C2CCCO2)=CC3=C([N](C)C4=C3C=CC=C4)Cl,24328E042983F341_CEFD1A5AA4A8676B_7019_UN,8.563864,00000000000000000000001000000000000000000000000000000000010000100110000000010000000101010000010010010101010101001000001011100100110010100100000010011010110011101111110,FUXBCWLDUVNMRG-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCC2N3CCOCC3)F)CC4,BD1D703F0B286C52_1133BA24B99111DB_6041_UN,7.6170754,00000000000100000001000000000000000000000010000000000000010000100000000000010001100001110011010100101000100111010001101011100000110011110110001011011011010111101111110,IVYOEMNREPFGAQ-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CCC2CCCN2C)C=CC(=C3)Br)C4,8FE349EA274AFD3D_9B7709379C71801A_6034_UN,7.7868757,00000000000000000000000000000000000000000000001000000000000000000110000000110000100101110000010010001100010110011001101011100100110000100110011011011110010110101111010,NVBIZWDMWLRNFD-UHFFFAOYSA-N
C2(=C1OCCC1=CC=C2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,0A0ABA983F192881_AC49C71DB476D212_7022_UN,8.534467,00000000000000000000000000000000000000000000000000000000010000100000000000010000101101110011010110101101010111010101101011100100110011110110001011011011110111101111110,RUNXBAHKIRWZJV-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NCC4(C3CCNCC3)CCOCC4,16B85FA875092569_5A63EABE5CE3DF64_6041_DP,8.399796,00000000000000000000000001000000000000000010000000000000010000100110000000010101001101110011010010101100111111011000001011100100110111110110001011011011010111101111110,LGDUZOZAGCGPNY-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3CNCCC3)C[C@@H]4C[C@H](C)CCN4,C249D3A299013B01_9D6FCCFE65D718F3_6034_UN,8.44747,00000000000000000000000000000000000000100000000000000000000000100100000000010101101101100011000010101100110010010001101011100100110100000110001011011111010110101111010,CHKGSIHQGWUDSV-SKQWJGTPSA-N
C(C2=NC1=C(C=CC=C1)[N]2C35CC4CC(CC(C3)C4)C5)=CC6=C[N](C)C7=C6C=C(C=C7)F,CCF04E257D049CE0_9781E5B560D19FF6_7019_UN,8.487736,00000000000000000000000000000000000000100010000000000000000000100110000000010101000101010000010010010100010100011000000011100100100001100100001011001010000010101111010,SZHGPEDQSOFRAI-UHFFFAOYSA-N
CC1=C(C=C(C=C1)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)CC=C,D86DD8C0114B7ACE_64CFF890070BAC4C_6041_DP,9.111863,00000000000000000000000000000000001000000010000000000010000000100000000000000001001000110011000000111000100100010000101001000100110101110110001011010011010110101111010,JOXDEMKWHJXJAB-WIYYLYMNSA-N
FC1=C(C=CC(=C1)C2CC2)NC[C@H]4[C@H](C3=NC=C[N]3C)OCCC4,C0928560B4BAE507_6789887922D8E0C0_6041_UN,8.048043,00000000000000000000001000000000000000100010000000000000010000100100000000010101001101010011010111101000000101000000001011100100110011110110001011011011110111101111110,QHGRKJPGISCELM-MAUKXSAKSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC3=CC=C(C=C3)C4CNC4,B4A212B286E75B97_D87AACC738F1288B_6035_UN,8.444187,00000000100100000000001000000000000000000010000000000000000000100010000000000000001010110011000001001000000101001100000001000111010100100110001101000011110101100111110,CXXNXIKNXXPMEW-UHFFFAOYSA-N
CC1=NC(=NC(=C1)NCC23OC(C)(C)C(C2)C3)[N]4C=CC=N4,D59A7E5AA479E64B_739F116144BC52BB_6041_UN,8.037138,00000000000100000000000001000000000000100000000000001000010000100110000000110101101100000010001110101000011010001000100011101100100011010100011000001101110111101111110,QURUPZCBRDQPIV-UHFFFAOYSA-N
C(C12CC(C1)OC2)=CC3=C[N](C)N=C3C4=CC=C(C=C4)F,0724C814344D5DA1_C191BAD14F6678B1_7019_UN,7.2654085,00000000000100000000000000000000000000000010000000001000010000100110000000010000100100010000011010010000010101001000000011101100110010100100001010001010110011101111110,FIGSFQGTJQIAFE-UHFFFAOYSA-N
CC[N]1N=C(C=C1N[C@@H]2CCN(C)[C@H]2C3=CC(=C(C=C3)F)F)C4CC4,9F8460C90CCBE61B_F35F787F0B62582E_6041_UN,8.774737,00000000000000000000001000000000000000100010000000001000000000100100000000010101100101110011011010001000100110010011101011101100000001110110001010011111010110101111010,HBWLKBLHAIJFIA-APWZRJJASA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=CC3=C(C=C2)CCCCC3,C2EFDE19895F53B9_2EA796061CBAFFD2_6041_UN,7.999669,00000000000000000001100000000010000000000000000000000000000000000100000000100001000000100001010000100100010000001000001001000100110001010100011011011111000010101111010,GGFDVEVXKYWSNB-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CC3)C4=C(C=CC=C4F)F,65CEC5F92957DFE5_B9F8D20A0A24D262_6041_UN,8.0305605,00000000000000000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100010001110100001010011011010110101111010,ADGCFWUSKIZIRF-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CC4(NCC3)CC4,ECA5FC56ACE97D30_625CDD4573503092_6041_DP,7.8579416,00000000000000000000001000000000000000100010000000000000000000000110000000000100001000010011000000101100110110011000001011000100110101110110001011010111010110101111010,QQGSKXBWAOLZBZ-UHFFFAOYSA-N
C1(=C(C=NC=C1)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,4298F5D7BCA25C36_69BC1DD88FDB3191_7022_UN,8.094116,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,HDIADHXPNZWPHP-ACJLOTCBSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC2=C([N](N=C2C)C3=C(C=C(C=C3)C)C)Cl)C4,639684E60F7BBE15_FBFBBD7CA90F0419_7019_DP,8.6868105,00000000000000000000000000000000000000000000000000001000000000100100000000010000100100010010001010010001110100010000001011101100110001110100011011011111000010101111010,FNMMDUTURXQLOV-NUJGCVRESA-N
CC1=CC(=C(S1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C,DBC221F933AFD9F6_29E726B611BC2B89_6041_DP,8.559903,00000000000000000000000000000000000010000010000100000100000000100000000000000000111100111011000010101000100110010000001011000100110101110110001011010111010110101111010,RFLJUEUPCOEDQC-DOTOQJQBSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC3=CC2=C(CCNC2)N=C3,4512B82FFEA16242_482E24B60A78A9C6_6041_DP,7.47648,00000000000000000000100000000010000000000000000000000000000000000100000000100001101000100011010000101100110000011001001011000100110101010110011011011111010110101111010,XQCJAOJKCGZJDC-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC4C3CCCC3C4,5B7FDF5590B79401_33517FE8F9EDD3F7_6041_UN,8.875239,00000000000100000001000000000000000000000010000000001000000000000100000000010000101100010011011010001100010100000000001011101100110001110100001000011001010110101111010,KEYXKFIMHSQBQH-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2=CC(=C(C=C2)N3CCOCC3)F)C4CCCC4,A06B73BD3DF0D831_736F116BD7756957_6041_UN,8.644044,00000000000000000000000000000000000000100010000000001000010000100100000000010101100101110000011110101000000101010000001011101100110011110110001011011011010011101111110,LAXOPIYCZKAYFH-UHFFFAOYSA-N
C[N]1N=C(C=C1F)NC2C4CCC(C2C3=CC=CC=C3)C4,06C54E67AA0F07CE_466AA6059877227C_6041_UN,8.154798,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011011010000000010100000000001011101100010001110100001011011011000010101111010,ACHGUEOADBXGHE-UHFFFAOYSA-N
S(C1=CC2=C(C=C1)OCC2)C(C4=CC3=C([N](C)C=C3)C=C4)=O,933D60D4161CCB4A_F4628666EC920070_6038_UN,9.070261,00000000000000000000000000000000000000000000000000000000010100001100000000010000010101001000010010000100010001000100001011100100000010000100000011011000111011111111110,QKNCIEMUEOQIPY-UHFFFAOYSA-N
C1(=C[N](N=C1)C2CCOC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,09E514E612E1D2C8_8AA8E160F3D40943_6041_UN,7.900714,00000000000000000000000000000000000000000010000000001000010000100100000000010001100101110011011111001000100111010001101011101100010011110110001000011011010011101111110,JMBGDWPEGLYFQG-RWZMTBSZSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,9B4586418AF39D98_36B42A7F1F884AAD_6041_UN,8.649249,00000000000000000000000000000000000000100010000000000000000000100100000000010101100101110011010010101000100110010001101011100100010001110110001011011111010010101111010,MEAZQRRZADVFPB-AABGKKOBSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC[C@H]2[C@H](CCCC2)N3CCOCC3)F)CC4,9FAAE86F0CBC1E7E_2768892146D1690C_6041_UN,7.5527096,00000000000000000001000000000000000000000010000000000000010000100000000000010001101001110011010100101000000111010001101011100000110011110110001011011011010111101111110,BEUUURSMKYJMMN-RDPSFJRHSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2COCCN2C)F)CC3,397E216BEE90ACF1_88734453508B5E17_6041_UN,7.2441964,00000000000000000001000000000000000000000010000000000000010000000000000000010001101001110011010101101000000111010001101011100000110011110110001011011111010111101111110,CBPUXOWQFLCICA-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC3(CCNCC3)CC=C,8C5E5E13AC208C8E_F6B54F749EA0FB1D_6041_DP,8.477507,00000000000000000000000000000000001000100010000000000100000000000110000000000100101000110011000000111100110100011000001011000100110101110110001011010111010110101111010,DXBFGEVNSAUFJP-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2C3(CCC2)OCCCC3)F)CC4,7CF20BA377C3192B_4C89F926BB41A27A_6041_UN,7.016778,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110011010110101000110111011001101011100000110011110110001011011011110111101111110,FHIXJMOQCSOZOI-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CC23CCC3)F)CC4,C52A926EAD99D3C9_E4CCD45514C24CB2_6041_UN,7.5503883,00000000000100000001001000000000000000000010000000000000000000000010000000010001101001110011010000001000010110011001101011100000110001110110001010011011010110101111010,MKDHIGWNEMIKID-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC34CC(C)(CC3)CO4,B5EDAC0D04A9628E_FAF649A1282E4BB7_6041_UN,7.4873953,00000000000000000000000001000000000000000010000000000000010000000110000000010101001101010011010110101100011111001001101011100100110011110110001011011111110111101111110,QAAILPAMWMEZQX-UHFFFAOYSA-N
CO[C@@H]1C[C@H](NC1)C2=NC=CN2CCN5CC3=C(C=CC=C3)C4(CC4)C5,97CCA3BD534BC3EA_E72C33457A7FD5F2_6034_UN,8.048995,00000000000000000000001000000000000000100000000000000000000000100110000000010101001101100011010111101100110000011000101011100111110010000110001111011011110111101111110,WOZDJXOHVLYXKZ-MJGOQNOKSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=N3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,F39D0B5360378CE0_1FE6D2240D3D1022_6041_DP,8.4304285,00000000000000000001000001000000000000000010000000000000000000100100000000010101100101110011010010101000111110010001101011100100110101110100001011011111010010101111010,QTKWVDVRNYXSOM-YMBUTIGBSA-N
CN1CCN(CC1)C2=NC(=CS2)C3=CC=C(C=C3)N[C@@H]4C6=C(OC5(C4)CCC5)C=CC(=C6)F,B0DC628C530AF209_FCBD81BB4797FED3_6041_UN,7.8945007,00000000000100000000000000000000000010000010000100000000010000100110000000010101010101111001010011101100111100011101101011100100110011110110001011011001110011101111110,LNTWFMGPDMTCGD-QFIPXVFZSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,05B2FC72BFC78D5B_45729AB93458E461_6041_UN,8.41387,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101100010110010000001011100100110001110110011011011111010110101111010,ICBILVPVFPSYDB-HXOBKFHXSA-N
FC2=C(C=C1C=COC1=C2)NCC3CCCN(C)C3C4=CC=CS4,253305FCC8255494_D7871C317F025A92_6041_UN,8.619782,00000000000000000000000000000000000010000010000000000000010000100000000000010000111101111011010010101100010110010001101011100100110001110110001011011011110110101111110,JHMHWHMIRBEQGT-UHFFFAOYSA-N
C(C1(CC=C)CC=CC1)=CC2=C(C=C(C)C=C2)C3=CC=N[N]3C,DC0C17E9B5F9C96B_4CE8BE17AC264B37_7019_UN,8.457606,00000000000000000000000000000000001000000000000000001000000000100110000000010000100100000000011010010000000000001000000011101100010000000100001010001110000110101111010,NXUTVCDPRJELPK-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2CCOCC23CCC3)F,396609700D7EC4C5_829C11020C1F83BB_7022_UN,7.450523,00000000000100000000000000000000000000000010000000000000010000000010000000100000000001110011010001101000110101011001001000100000110011110110001011011111010111101111110,NMKYPGZWSLAAPL-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC2NCC3(C2)CCOCC3)C=CC(=C4)Cl)C5,614A3683A3909A35_942AAC6454AEE04C_6034_UN,7.095958,00000000000000000000000000000000000000000000000000000000010000000110000000010001101101110011010010101101110101011001101011100100110010100110001011011001010111101111110,COEOINYJPAJAKJ-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CCC2CCCN(C)C2)C=CC(=C3)Br)C4,FF4FE8A17F8D4DE8_F746B7776293AE58_6034_UN,7.610426,00000000000000000000000000000000000000000000001000000000000000000110000000110000000101110000010010101100010110011001101011100100110000100110011011011100010110101111010,MDGPVTKFSSFZDM-UHFFFAOYSA-N
N3C(CNC(=O)C2=CC1=C(C=CC(=C1)F)OC2)C4CCC3CC4,83791F65CC143E67_24BFACABD898C5A8_6038_DP,8.0662565,00000000000000000000000000000000000000000010000000100010010000000000000000001001001000010111100001111100110101110100011011000000110100100110001011010001111111110111110,UYEKDUAQUNJYSR-UHFFFAOYSA-N
CC1=C(C(=CC=C1)F)NCC2N(C)CC3(CC2)CCC3,A890CE8BA25626E1_DFE04E9CDDD3D1F8_6041_UN,7.6245236,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011111010110101111010,QDMSUCOOTPHIAL-UHFFFAOYSA-N
CC1=C(C(=CC=C1)Cl)NCC2N(C)CC3(CC2)CCC3,C3541E9A52D7E5B3_BE433E8515E9F76E_7022_UN,7.6245146,00000000000100000000000000000000000000000000000000000000000000000010000000010001001001110011010000101001010110011001101001100000110001110110001011011111010110101111010,GYWXEUIHARFOFT-UHFFFAOYSA-N
CC1=C[N](N=C1)CC2=C(C=C(C=C2)NCC3C(C)(C)C4CCC3C4)F,19F832F59EAD0AD1_D2664D50E2941D8F_6041_UN,8.338822,00000000000000000000000000000000000000000010000000001000000000000110000000110000101100010001001010001000010110011000101011101100110001110110011011011111010110101111010,QZDCNUYQFZRQEC-UHFFFAOYSA-N
CN(C)CC[N]1C=CC2=C1C=C(C=C2)NCC3(CC3)C4=NC=C(C=C4)F,628BC0D50DE2EB49_7C9E334DE7C193CA_6041_UN,8.269411,00000000000000000000001000000000000000000010000000000000000000100110000000110001101101110011010010101100010100011001101011100100010001110110001001011101010110101111010,PIEAKMNDCCQEEN-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CC=N2)NCC(N3CCOCC3)C4=CC(=CC=C4)F,99E467564B9CCD6A_CAFDED2222A61F9A_6041_UN,7.7089796,00000000000000000000000000000000000000000010000000000000010000000100000000010001101101110001010110101100010101010000001011100100110011110110001001011001010111101111110,VSNYHVSVCSVKIR-UHFFFAOYSA-N
FC2=C[N]1C=NC=C1C=C2NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,645B5AB50FF718C8_2CB67B5C4E77E021_6041_UN,8.602103,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,AMGTTZHSEIMYES-VLIAUNLRSA-N
CN1CCCC1C2=CC=C(C=C2)NCC3(CCNCC3)C4=C(C=NC=C4)F,A76CA1CFC167A37C_BEBC375F716C2E19_6041_DP,8.14148,00000000000000000000000000000000000000000010000000000000000000100110000000010000001101110011010010101000100110011001101011100100110101110110001011011011010110101111010,JOPNCVFSZUEYFK-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NC4CC(C3=CC=N[N]3C)OCC4,81BBBD91CD7A90DC_1E6F2BCABDF78CE4_6041_UN,8.307953,00000000000000000000000000000000000000000010000000001000010000100100000000010001100100010010011111100100110111010000001011101100110011110100001011011011110011101111110,VNRBNRYSIOITDQ-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)F,2C2840EE67287EFE_F6D4410005515665_7022_UN,8.239681,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011111010110101111010,MNPBWMZXYFOEHC-QRWLVFNGSA-N
CC1=C(C=C(C=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)Cl,F779CAC0505F63B9_6D5C5B88FA97301B_7022_UN,8.239678,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011111010110101111010,QYDDNGKFTMAGKY-QRWLVFNGSA-N
O[C@H](CBr)C1=C(C=CC=C1)NCC2CC3CCC2N(C)C3,B8B5A70E57FE5153_04700891427403F8_6041_UN,8.416365,00000000000000000000000000000000000000000000001000000100000000000000000000010000101001100011010001101000110010010001101001100000110111110111001011011011110111101111110,OHYOWYVGPZQEBP-YAAHMLIESA-N
FC1=CC=C(C=C1)C(CCC=CC2=C(C=N[N]2C)C3CCC3)C4=CC=C(C=C4)F,EDCA4C854F7141A9_3258C5DA3CA0E684_7019_UN,8.156657,00000000000100000000000000000000000000000010000000001000000000100100000000010000100100010000011010010000000100000000001011101100000000100100001011011010000110101111010,APUBNIZBHOHLAS-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C(F)F)Cl)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,C9C235C122950842_5B2752D7FE819FD3_7022_UN,8.478903,00000000000000000000001000000000000000000010000000000000000000000010000000100000001000010011000000001101010100001001101000000100110001110000000011010111010110101111010,UPLPDHWSDFVOTI-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(C4=C(CC)C=CC(=C4)F)=O,40B65DEA3A51AC5B_72EF7F638CE4FD7F_6038_UN,8.640833,00000000000000000001001000000000000000000010000000000000000000000000000000000000001000010011100010001000010100100010010000000000110000100000000011000011011110101111110,IEUSTBRWJJDXCZ-UHFFFAOYSA-N
C(C23CC1CC(CC(C1)C2)C3)=CC6=CC4=C([N](N=C4C)C5=CC=CC=C5)N=C6Cl,F0314B6853DD504A_BA7BBE3B2C356CB9_7019_UN,8.096457,00000000000000000000000000000000000000100000000000001000000000100110000000010101100100010000001010110101010100001000000011101100100001110100001011001010000010101111010,DKFBPLRBLNKLPO-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)N[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)F)F,ACE5054C6E67666A_011CAC50FEBEA88C_6041_DP,8.576487,00000000000000000001000001000000000000100010000000000000010000100100000000000100100101010011010111100000111101010000101011100100110111110100001011011011110011101111110,LTWYDWWHAIVISZ-GXNYLJPESA-N
C1(=CC=C(C=C1)C2CCOCC2)N[C@@H]3CCN(CC)[C@H]3C4=CC(=C(C(=C4)F)F)F,CF55550D8956F4EC_8FF265C6F0255A2B_6041_UN,8.751477,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011000010101000100111010010101011100100110011110110001011011011010111101111110,PXAFIMWDPURCEE-GGAORHGYSA-N
CC1=C(C=C(C(=C1)NCC(OC)C2CCCOC2)F)F,191955FAEA716150_3C38F0FAEF883EA4_7022_UN,7.6826463,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110101010100101000000111000000101000000010110011110110000011010111110111111111110,OIZDBWGDWYQWNO-UHFFFAOYSA-N
CC2=C(C=C1N=C(C(=CC1=C2)C)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F)C,EB5E2C7DB863AE0C_F6212D9D4345B31E_6041_UN,8.138217,00000000000000000000000000000000000000100010000000000000010000100100000000000100001100010011000011101100010111000000001011000100110011110110011011010111110111101111110,TWDWCUDGPUSWOP-AVRDEDQJSA-N
CC1=C(C=CC=C1F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,6AA1ED100D6E37BA_810D02C29AAADA76_6041_UN,8.289251,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110011011011111110111101111110,ODZPHQCYCGUFRG-IRXDYDNUSA-N
CC1=C(C=CC=C1Br)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,3B9C40A26F1B7B9B_B32F87EC6F352A5C_7022_UN,8.289259,00000000000000000000000000000000000000000000001000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110011011011111110111101111110,FWMAIKOCBVGOSM-IRXDYDNUSA-N
CC1=C(C=CC=C1Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,DD4A67AB29AA26D6_6F2CD5F0C67BBE6E_7022_UN,8.289248,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110011011011111110111101111110,CFOZKGRBVXHLFA-IRXDYDNUSA-N
N(CC1C2CCC(C1)C=C2)C(C3=C(CC)[N](N=C3)C4=CC=C(C=C4)F)=O,FDFFC251D14A3C8D_EC80F28179919782_6038_UN,8.5871,00000000000000000000000000000000000000000010000000001000000000100100000000010000101100010011101011011000010100110010011011101100110001110100001011011011011110101111110,ZFALZVDKCVIMIT-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC(OC)C2CCCO2)F)CC3,F91779F0B1426988_2BBFD4F5296A6C87_6041_UN,7.6826653,00000000000000000001000000000000000000000010000000000000010000000000000010010001101101110001010111001000000111010001101011100010110011110110001010011111110111111111110,VJMGZNFZZHPTHW-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)N[C@@H]2CNC[C@@H]2CC3=CC=CC=C3,95C4737910E7DF28_EDF4248EBC798126_7022_DP,7.9255266,00000000000000000000000000000000000000000110000000000110000000000000000000000001101100110011000010001001100100010000000001000100110101110110001011000011010110100111010,DBRKLLBXMXUYNN-SUMWQHHRSA-N
CC1=CC2=C(C=C1)C(=CN2CC4CCCN(CC3=CC=C(C=C3)I)C4)C5CCNCC5,944B6E8D26464E90_8C439B92AFA95399_6034_UN,8.408385,00000000000000000000000000010000000000000000000000000000000000100100000000010000101101110001000010101100110100010000001011100100110000100110001001011001010110101111010,UDGZFQVWGQDRLQ-UHFFFAOYSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC3=C[N](CC2CCCN2)N=C3,944C6AAA37656167_08B6B1F9D4DDC38D_6041_DP,8.197178,00000000000000000000100000000010000000000000000000001000000000000100000000110001101100100011011010001000100000011001001011101100110101010110011010011111010110101111010,FBIVHYPENMQDBJ-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCC3=C(C=CC(=C3)F)F,E6390990FB40930F_D16428DAB6DF0D9F_6038_UN,7.820603,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,HUPRUFDGHWONNC-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCCC3C4(C3)CCOCC4,53C450230CB27090_AA0A0F29E37BFD92_6041_UN,7.1825604,00000000000000000000001000000000000000100000000000000000010000000110000000000100001000100001000000101100110011011000001011000100110011010110011011010111010111101111110,RGDZHNKGIZHOOY-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC[C@@H]3C[C@H](F)CN3CC4=CC=CS4,38577335E8BC7969_85F8BB34FB65BD44_6041_UN,8.472758,00000000000000000000000000000000000010100010000000000000000000000100000000010101011101111011000010101100010110010000000011100100110001110110011011001111010110101111010,ZZUNFUQWUPBPNT-ROUUACIJSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3CC4(NC3)CCC4,781602DD2B2969AB_F6EA237F55107C28_6041_DP,7.570719,00000000000100000000000000000000000000100000000000001100000000100110000000010101101101000011011010001000110010011000001011101100110101010110001010011111010110101111010,XXRBHYOCCVLHDX-UHFFFAOYSA-N
NCC(OC2=CC1=C(CCN(C)C1)C=C2F)C3COCC3,186F2D5789FF3E0A_5669B102145DF67A_6035_UN,8.029856,00000000000000000000000000000000000000000010000000000000010000000000000000010000001111110101010110101100010101010101101011100011110010100110001111011011110101111111110,SMCGUTRIMPHHIV-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CC4(CN3)CCC4,3B14BCD42CD37E8F_E527105585599879_6041_DP,7.731658,00000000000100000000000000000000000000100010000000000010000000000110000000000101001100010011000010101100110110011000001011000100110101110110001011010111010110101111010,MESLXVSGKLZPFF-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC3CCN(C)C34CCCNC4,FD500598DCCB428E_EA4D998989606A9E_6041_DP,8.220493,00000000000000000000000000000000000000100010000000001100000000100110000000010101101101110011011010101000110110011001101011101100110101110110001011011111010010101111010,ZYTTVNQEZHNWHQ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)[NH]C(=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,59872DD799D81C03_9621790F6C87A927_6041_UN,8.433033,00000000000000000000001000000000000000100011000000001000000000100100000000010101101101010011011010101100010100010000001011101100110101110110001011011011010110101111010,CNGSZOFOFZEAPS-SZNDQCEHSA-N
CC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3CCOCC3)C=C(Br)C=C4)C,FCB603A9BCD1F0EC_3B29F8736E7F694C_6034_UN,9.032591,00000000000000000000000000000000000000000000001000000000010000100100000000010000101101110011000010101100010111000000101011100100110010100110001011011111010111101111110,NZKMEXYECSHUAA-LPHOPBHVSA-N
CC1=C(C(=CC=C1)F)NCCN(C)CC2COCCC2,EC1120EB442398B0_C2548685ECA6F8AE_6041_UN,7.252968,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001011011111010111101111110,JEXFFFCSJBQFEL-UHFFFAOYSA-N
CC1=C(C(=CC=C1)Cl)NCCN(C)CC2COCCC2,745E412421C186FA_7D5A4C77257EA27E_7022_UN,7.252983,00000000000000000000000000000000000000000000000000000000010000000000000000000001001001110001010001101001100111010001101000100000110011110110001011011111010111101111110,BKWWIVNTLXQWDS-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CC2(CC(C)C2)C)C=CC(=C3)C)C4,F4752E9E0BCDC0EB_1E0DC26332B72033_6034_UN,8.382627,00000000000100000000000000000000000000000000000000000000000000000110000000010000000101000000000010001100010010011011101001100100110000000100010011011100010110101111010,UDMIEXALCSUGKN-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)NC2CC(OCC2)C3=CC=C(C=C3)F)C4[C@@H]5CNC[C@H]45,26B62A5E8E0182DB_44AE76031DB9398A_6041_DP,8.058385,00000000000000000000001000000000000000100010000000000000010000100100000000000101101101110011010011101000110111010001001011100100110111110110001001011001110111101111110,DYXNAZNVKCJULM-FLANIQCISA-N
C1(=CSC(=C1)C2OCCO2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,5AFA07EF3B6AF360_BC62DFEE8941EA77_6041_UN,7.6597533,00000000000000000000000000000000000010000010000000000000010000100000000010010001010101111000010010101000000101010001101011110100110011110110001011011011010111111111110,ZMWRHOKGSJKKPY-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC3CCCCN(CC2=CC=CC=C2)C3)Cl)C4CC4,8E3D9FBA5899A874_BDA143CF13FB2C45_7022_UN,8.248971,00000000000000000001001000000000000000000000000000000000000000100000000000010000101001110011000000001001000110010000001001100100110001110110001011011011010110101111010,GRGLBXKQOHWWCK-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)N[C@H]3C5=C(OC4(C3)CCCC4)C=CC(=C5)F,0A6CB911B3E57F17_A07DF42A2B9DEB39_6041_UN,7.862256,00000000000000000000000000000000000000100010000000001000010000100110000000010101100101010001011011100100110100011100001011101100110011110100001011011111100011101111110,SQAPFTDSAYXFRE-HXUWFJFHSA-N
NCCCC(OC1=CC2=C(C=C1)CNCC23CC3)C4=CC=C(C=C4)F,F3D05944D3E3713B_A82429F21E2F1B36_6035_UN,8.18314,00000000000000000000001000000000000000000010000000000000000000000010000000000000001010110011000000101100110100011100001001000111110110100110001111010001110101100111110,MLLNUKYGITYLRB-UHFFFAOYSA-N
FC2=C1C=CN=CC1=CC=C2NCC3CCCN(C)C3C4=CC=CS4,4A5820B484C6B482_AD1E8BDAC2A88220_6041_UN,8.697465,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,XSKZNBRWNKOYES-UHFFFAOYSA-N
O(CC2(CC1CO1)CCOCC2)CCC3N(C)CCC3,591F5EB5D6DDEE79_62C96E6EE33A09DD_6039_UN,7.07565,00000000000000001000001000000000000000000000000000000000010000000010000000010000000101100000010011101000000011011001101011100010110010000110000000111010110111111101110,WOKOKWZZYPKBGP-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCCC(CC)CC3,CB31ABAD2D941DBF_157D3446D2B7D70B_6041_UN,7.909004,00000000000000000001000000000000000000000010000000001000000000000100000000010000101100010011011010001100010110000010101011101100110001110100001000011101010110101111010,ZIWYDYFJOGGLMM-UHFFFAOYSA-N
C1(=CC2=C(N=C1)[NH]C=C2C3CC3)NCC4=CC=C([Si](C)(C)C)C=C4,7D5AB7FA70B6E1B3_F40EAE2F8824B7FE_6041_UN,7.7483296,00000000000000000000101000000010000000100000000000000000000000100100000000100101001100100001010010101100010000001000000011000100000101010100011001011101010110101111010,WDDOSDGIMFPNAM-UHFFFAOYSA-N
C2(=C1C=CC=CC1=CC=C2Cl)NC3CC4CC3CN4C,3B94E4A85DF760CE_FD5CAFC1F756480D_7022_UN,8.460493,00000000000000000000000000000000000000000000000000000000000000000000000000010000100101110011010010101101110110010001100001100100110001110100001011001011010010101111010,QJQWXZPRVGCICG-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C3CCCCC23)Cl)C4CC4,079505502CA7CD04_7F73D7263D77AA6A_7022_UN,7.9226956,00000000000000000001001000000000000000000000000000000000000000100000000000000000001000010001000000001001010110000000001000000000110001110000000011010011010110101111010,KDPOVNIVLURJGX-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C(=CC=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C,ED456D46F070F12F_6A3A760861A2DE92_6041_DP,8.189791,00000000000000000000000000000000000000000010000000000110000000100100000000000001101100110011000010101100110100010000001011000100110101110110001011010111010110101111010,KMCRLOLNJPYDKQ-FXAWDEMLSA-N
CC1=C(C4=C(N1CC3CCCN(CC2=CC=C(C=C2)I)C3)C=CC=C4)C5CCNCC5,4209AC89027EF208_06FE2E92E394A17E_6034_UN,8.58824,00000000000000000000000000010000000000000000000000000000000000100100000000010000101101110001000010101100110110010000101011100100110000100110001011011011010110101111010,KOIGQHJHEQFOFB-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)COCC2)[S](C4=C3C=C[NH]C3=CC=C4)(=O)=O,71CA7F7D6C5EF282_018A2B42AF770B86_6029_UN,8.83637,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100101000001010101110011001001000011011001100111110001110001011111001010111110111110,BEOYENJFYOHAIT-UHFFFAOYSA-N
O[C@H](CCl)C1=CC=C(C=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,C7C95CEC678F409A_8AE1FFDB098B2497_6041_UN,9.171158,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101100001011110101001100011010001101011101100110111110111001001011111110111111111110,UWBKTIOXJCREEP-SQNIBIBYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@]34CNC[C@H]3CN(C)CC4)Cl,0AA9C783D8818D2C_FA6AE03CDCF19AC9_6034_UN,8.051502,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101111011010010101101011110011001101111100100110101110110001011011111010110101111010,DNDSLHQQRGQBNG-JXFKEZNVSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC2=C([N](N=C2C)CC3=CC=CC=C3)Cl)C4,B8E0FD3CC8D4A1F2_AE9E33C5D654CE0E_7019_DP,8.559994,00000000000000000000000000000000000000000000000000001000000000000100000000010000100100010010001010011001110110010000001011101100110000100100001011011011010110101111010,DBUYTHASDZUSQN-NUJGCVRESA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=C(C(=CC=C2)C3=CN=CC=C3)F)C4,24368D23F19345E5_31002838313DC910_6035_UN,8.550201,00000000000000000000000000000000000000000010000000000000000000100100000000100000000001110000010011101000010100000101001001100111110000100100001111011110110101101111110,KMAPYPHPCSBCNT-WWKQJJJLSA-N
N(CCN1CC2CCC(C1)O2)C(C3=C[N](C)C4=C3C=C(C=C4)F)=O,3CBB36E5EE8587A9_07CB2FC21506EDA3_6038_UN,8.114879,00000000000000000001000000000000000000000010000000000000010000000100000000010001101101110001110111101100110100110000011011100100110010100110001001011001111111111111110,PNQXRLUWENXOKW-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C[N](C)N=C3C4=CC=C(C=C4)F,35B5E3970E46987A_7153BFF926AE75A5_7019_UN,7.6904974,00000000000100000000000000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001011011010000010101111010,KWJNJOQBBVRZQC-UHFFFAOYSA-N
FC2=C(C=C1OC=CC1=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,210A927CC861B845_E617154C8802E185_6041_UN,8.618909,00000000000000000000001000000000000000000010000000001000010000100100000000010001101101010011011011101100010100010000001011101100110001110110001011011011110110101111110,PBFYKZRHUYKVHN-VFNWGFHPSA-N
FC1=C(C=C(C=C1)CC#N)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F,685FD8EA0B422E9A_E2D797C43582DB4C_6041_DP,7.470203,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,WDQZIOVRDVMVSQ-VQIMIIECSA-N
FC2=C1C=NC=CC1=CC(=C2)NCC3N(C)CC4(CC3)CC4,85D9E00498F8F32E_D135E56BC27A95E5_6041_UN,8.334805,00000000000000000000001000000000000000000010000000000000000000000110000000010001001001110011010000101100010110011001101011100100110001110110001001011011010110101111010,JRQURRULXUXFGS-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)NC2=CC(=CC(=C2)F)C)[C@H]3C[C@@H]4CC[C@H](C3)N4,4A5CE04B7A5A86B6_554B1CA018DD3238_6041_DP,7.953302,00000000000000000001000000000000000000100010000000000000000000000100000000000101100101110011010010101000110100010001101011100100110101110100001001011101010110101111010,ISCHYFDKKSEMJM-HGKCTWBKSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3(CC3)C4CC4,B017105D18022D50_2DE116E52097FC83_6041_UN,8.145759,00000000000000000000001000000000000000100010000000000000000000100110000000000100001000010011000000101100010110001000001001000100110001110100001011010111010110101111010,HDVNDWKLIUXOJR-UHFFFAOYSA-N
C(C2C1CC3CC(C1)CC2C3)=CC4=C(CC)OC5=C4C=CC=C5,0EFE332CFAB63F1F_59C0899145AC8230_7019_UN,9.021349,00000000000000000000000000000000000000000000000000000000010000000000000000000000000100000000000010010100010000000010000000000100100010000100000011000010100100001011110,BBUVQHNBJPNPEZ-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC3CCCN(C)C3C4=CC=CS4,51F9C9BB647A3D6C_1A760894002FDDAF_7022_UN,8.475667,00000000000000000000000000000000000010000010000000001000000000100100000000010000111101111011011010101000000110010001101011101100110001110110001011011011010110101111010,ZOUKQOKDZJUZQN-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)C#N)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)F,FA02F9B2557A2EEF_2299E21D5EA1814A_6041_DP,7.796491,00000000000000000000000000000000000000000110000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001011010110101111010,ICQISHPBHRCEJR-NWDGAFQWSA-N
CCC5CCC1=C(C4=C(N1CC2CCCN2CC3=C(C=CC=C3)Cl)C=CC(=C4)C)C5,3CD6462C443658AD_2A3BF51826BADBB9_6034_UN,8.457348,00000000000000000000000000000000000000000000000000000000000000000100000000010001000101110000000010001101010110010010101011100100110000100110001011011110010110101111010,YHKWSJIPQHFJHF-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N=CC(=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,E3BF30FCE11EED59_512C3FD7165A116F_6041_UN,8.746963,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,QVENFVNIBAGAGV-QRQCRPRQSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC(OCC)C3CCOCC3,B0CB233D0986863B_4F1282D7E52706E1_6041_UN,8.305749,00000000000000000000000000000000000000100000000000000000010000000100000000000100001000100001000100101100010011000010001011000110110011010110011011010111110111111111110,JLPUATOBQXKANE-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CC3(CCC2)CC3,8028398192F1BE92_6843FD5FE9A8BE33_6041_UN,7.543851,00000000000000000000101000000010000000000000000000000000000000000110000000100001001000100011010000101000010000001000001001000000110001010100011011011111010110101111010,RHYDBPIJKVYVJI-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2C3=C(CCC2)C=CC=C3F)C4CCCC4,C5A1203394D31964_5DCD11A43572842C_6041_UN,8.273419,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011011010000100110100010000001011101100110001110100001011011011000010101111010,MQMZEBUJTFBOIX-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(=O)C3=C[NH]C4=C3C=CC(=C4)F,B1E570EBB7993658_CD8F14037B76FD0F_6038_UN,7.634182,00000000000000000001000000000000000000000010000000000100010000000100000000000000101100010010100011101100010100100000011011000100110110100100001001010001111111110111110,AXZGACLTIXZXDB-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NCC3CCCN(C)C3C4=CC=CS4,A7D78643E4463F48_7600906D1445884C_6041_UN,7.94433,00000000000000000000000000000000000010000010000000000000010000100000000010010000111101111011010010101000000111010001101011110100110011110110001011011011010111111111110,BDNCMKLZXGVCPT-UHFFFAOYSA-N
C(C1(CC=C)CCOCC1)=CC2=C[N](C)C3=C2C=C(C=C3)F,15481C1220D1DAAC_D929E948A57800CF_7019_UN,8.62273,00000000000000000000000000000000001000000010000000000000010000000110000000010000000101110000010010110100010101001000001011100100110010100110000001011000010111101111110,PGLHFQCEMSVSKK-UHFFFAOYSA-N
N(CC2=NC1=C(C=CC(=C1)F)O2)C(C45CC(C3CNC3)(C4)C5)=O,867A41BFC8066582_5678CFB6265E8336_6038_DP,8.0963745,00000000100100000000000000000000000000000010000000000000010000100110000000000001001100110011100110001100010100111000010011000100110110100110001000000001111110110111110,AQJZCTIJQVUWHR-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)C=CC2=C(C=N[N]2C)C3CCC3)OC(OC4)C5=CSC=C5,61A2828DCE409B60_05413608BC5EF86E_7019_UN,8.476157,00000000000100000000000000000000000010000010000000001000010000100100000000010000100100011100011010110100010101000100001011111100000000100100001011011010110011111111110,IPXXVLYSRBKKRV-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC3CC4(CN3)CCC4,D7FA51E9E98F6E18_F01E3668B4221F98_6041_DP,7.740529,00000000000100000000000000000000000000100000000000001010000000100110000000010101101100000011011010001000110010011000001011101100110101010110001010011111010110101111010,OGPYYDLRTCRAHU-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(=O)C3=C[NH]C4=C3C=C(C(=C4)Br)Br,FE1181E2E4323FC0_A4CD9F961BBF35B7_6038_UN,7.7427506,00000000000000000001000000000000000000000000001000000100010000000100000000000000101100010010100011101100010100100000011011000100110110100100001011010011111111110111110,SRXCMKPVGCUMIF-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@H]3[C@H](C2=NC=C[N]2C)OCCC3)Cl)C4CC4,424B225BC55692D2_D37720959015453D_7022_UN,8.306673,00000000000000000000001000000000000000100000000000000000010000100100000000010101001101010011010111101001000111000000001011100100110011110110001011011111110111101111110,CZDBAOYFPUAIED-HNAYVOBHSA-N
CN5CCCN(CC1=C(C=C(C=C1)NC2C3OCC4CC2CC34)F)CC5,80B829136A6DB5F3_E1377DA3D3D0555D_6041_UN,7.789703,00000000000000000001000000000000000000000010000000000000010000000000000000010001100101110011010110001100010111010001101011100000110001110110001011011011110111101111110,QQBMBKRHODIZLK-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCCC(C)C2)Cl)C3CC3,41BCA5B22DD877F9_6E9D7790BFB40F94_7022_UN,8.021687,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010011000000001001000110000001101000000000110001110000000011010111010110101111010,LLXPFBAFUBILEN-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NCC3CCN(C(CC)C)C3,1627A80010DCE427_E691CCB463CCC58E_6041_UN,7.6401687,00000000000000000000000000000000000000000010000000000000000000000000000000010000101101110011000010001100010110010011101001100000110001110110001010011101010110101111010,HHRLLVDCJHYGQK-UHFFFAOYSA-N
FC2=C(C=C1C=CC=CC1=N2)NC3CCN(C)C34CCCNC4,D6DF95833DE4AE5D_46667460311C136F_6041_DP,8.568757,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001011011011010010101111010,ZDERLUMAQRIQSK-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NC3CCN(C)C4CCCC34,0E25234813B4AE0A_D76ACDB19B674F04_7022_UN,8.488247,00000000000000000000000000000000000000000000000000000000000000000000000000010000100001110011010010101101110110010001101001100100110001110100001011011011010010101111010,NTKFYKAXHIZHTE-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Br)NC3CCN(C)C4CCCC34,073595993DC93FF1_878A858770EC2B72_7022_UN,8.488245,00000000000000000000000000000000000000000000001000000000000000000000000000010000100001110011010010101100110110010001101001100100110001110100001011011011010010101111010,LOHQSJAUABDLDX-UHFFFAOYSA-N
N1CCC5(C1)CCN(CC2=NC=C(N=C2)NC3(CC[Si](C)(C)CC3)C4=CC=CC=C4)CC5,1903FAB8D049571C_31A7092D0025F265_6041_DP,8.15626,00000000000000000000100000000010000000100000000000000000000000100110000000110101101101100011010010101000110000011001101011100100110101010110001001011101010110101111010,FULWGKKDCCFOSD-UHFFFAOYSA-N
C2(=C1OC=CC1=CC(=C2)F)NC3CCN(C)C34CCCNC4,7CB8D9C90E9EBEFC_86E7AF5334AA8C28_7022_DP,8.281952,00000000000000000000000000000000000000000010000000000100010000000010000000010001101101110011010110101100110110011001101011100100110101110110001001011001110010101111110,PZEYBVBLCSDCID-UHFFFAOYSA-N
CCOC(OCC)C2=NC1=C(N=CC(=C1)Br)N2CC(C3=CC=CC(=C3)C)N4CCNCC4,5C5918E32CE7584A_9AC7E041F7C2EF8D_6034_UN,8.921027,00000000000000000000000000000000000000100000001000000000000000000100000000010101101101110001000110101100110101010010001011110110110000100110011011011111010111111111110,YGQWTVCTSNIGSW-UHFFFAOYSA-N
C(C1CC2CCC1CC2)=CC4=CC=C(C3=CC=C(CC)C=C3)O4,36CB13F730633E24_ED2941F3CC0D74C4_7019_UN,8.662903,00000000000000000000000000000000000000000000000000000000010000100000000000000000000100000000000010010000010000000010001000000100110000000100000001010000100100001011110,RTINCSMVLPAXSU-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)N[C@H]3CC[C@]2(OCCNC2)CC3,A7467A04344E1070_B5B1B2DE5A6CD860_6041_DP,7.7804756,00000000000000000000000000000000000000000110000000000000010000000010000000000000001000110011000100101000110101011000001011000000110111110110001011010011110011101111110,CTFXRXKLPJQEIG-CZIWCDLHSA-N
N(CC1CC2CCC(C1)S2)C(=O)C3=C[NH]C4=C3C=C(C(=C4)Br)Br,E1FE3F215BCBF1E7_5BF8D647724B902D_6038_UN,7.851027,00000000000000000001000000000000000010000000001000000100000000000100000000000000111100011010100011101100010100100000011011000100110100100100001011010011011110100111110,LLYAQUGGTICDFQ-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)Br)C)NCC2=NC=C[N]2CC3C(CCN3)C4CC4,F20710B2091A2FAD_D89D3C8C96A3CDA0_6034_DP,8.430026,00000000000000000000001000000000000000100000001000000000000000100100000000010101001101010011000010001000100110010000001011100100110101110110001010011111010110101111010,AHLXUUOCMRUIHW-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2C3(CCNC2)CCOCC3)F,BED5BA7C69C9E770_A25FE66B7B2624D3_7022_DP,7.224205,00000000000000000000000000000000000000000010000000000100010000000010000000100000101001110011010000101000110101011001001011100000110111110110001011011111010111101111110,ZNAYBCGHAJMPDQ-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NCC2N(C)CC3(CC2)CCC3)F)F,B18CFCDD9D064879_ECA2AF618872127A_7022_UN,7.985282,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011111010110101111010,AKPJBYWAAVERBT-UHFFFAOYSA-N
CC1=C(C(=CC=C1)F)N[C@H]2[C@@H](OCC2)C3=CC=N[N]3CC4CC4,02C4F59FDC27130B_844850B0E9FBDDB0_7022_UN,8.670517,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011001111001000100101010000001011101100010011110110001010011011110111101111110,YFGLMAFZEYLIRV-CRAIPNDOSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CCC2(COC2)CC3)F)CC4,D8B130667927F12C_B31DB210FC23BCD1_6041_UN,7.3325586,00000000100100000001000000000000000000000010000000000000010000000010000000010001100001110010010000001000110111011001101011100000110001110110001011011011010111101111110,ZYYFXLSKAXYZHR-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCC3)C4CCC4,36AB32543B786A97_8AB8870B434ECEE5_6041_UN,8.10003,00000000000100000000000000000000000000000010000000001000000000100110000000010000101100010011011010001100010100001000001011101100110001110100001000011001010110101111010,KJMIQCBSDCUZSD-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)NC4CC(C3=CC=N[N]3C)OCC4,ED2ABEE7D32134FF_5505DD8DF865294A_6041_UN,7.6778164,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111100100110111010000001011101100110011110100001011011011110011101111110,ZXEDMFMUMMGBSV-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)N[C@H](CC)C3=CC(=C(C=C3)C)F,451D0D8308813D36_94C6116FF13FF56A_6041_DP,8.599634,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101010011010010101000100110010010001011100100110101110100011011011111010110101111010,QOKVFPOFXOSBJA-TZHYSIJRSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC34CC(C)(CO3)CCC4,9D5B918406DFE5A5_E0CB05361B2D9D65_7022_UN,7.6158776,00000000000000000001000000000000000000000010000000001000010000000110000000010000101100010011001110001000010111011001101011101100110011110110001011011011110111101111110,OOOAKLABCMTDFU-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(C3=C(C)N=C4C(=C3)C=CC=C4F)=O,450F0F0200C44A7E_F1FCDDEFB77865EE_6038_UN,8.048931,00000000000000000001000000000000000000000010000000000000010000000100000000000000101100010010100011101100010100100000011011000100110010100100001011010011111111111111110,SRNAXVPCWSFJRL-UHFFFAOYSA-N
C(C12CCC(CC1)C2)=CC3=C([N](C)C4=C3C=CC=C4)Cl,7A614FF5656FE24B_2D3E9328FAF5692A_7019_UN,8.376099,00000000000000000000000000000000000000000000000000000000000000000110000000010000000101010000010010010101010100001000001001100100110000100100000011011010000010101111010,LNNUCODYXWBSRB-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CCC(CN3)(C)C)Cl,451EF41AEC170F77_CC8945F478589234_6034_DP,8.561865,00000000000000000000000000000000000010000000000100000000000000000110000000110111011101011011000010101001101100011001101111100100110101110110011011011111010110101111010,FRGIIODNTLKHKH-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NC3CN(C)C4(C3)CCOCC4,77A181F1383E2E2E_1A6BDEA502A10207_6041_UN,7.686203,00000000000000000000000000000000000000000010000000000000010000000110000000010001100101110001010011101100110111011001101011100100110011110110001011011111010011101111110,NKUFZGYIUWWEHC-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC3=NC=C2CCCCC2=C3,F6780DE6E225F28E_168E0E4C776693D9_7022_UN,8.088352,00000000000000000000100000000010000000100000000000000000000000000100000000100100000000100001010000100100010000001000001001000100110001010100011011011101000010101111010,ISNMITLXCJZILP-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=C2C3CC3)C[C@]4(C)COC[C@@H]5CCCN45,243F1024AADEF868_7AC0A24DFE40CC8D_6034_UN,8.093122,00000000000000000000001000000000000000000000001000000000010000100110000000010001000101110000000111101100010111011001101011100100110000100110001001011000010111101111110,IGIHPFYDZLLWQX-OXJNMPFZSA-N
N(C1=CC2=C(C=C1)OCCC2)[S](C4=CC(=C3[NH]C=CC3=C4)C)(=O)=O,4E8E9919C7BF1096_30EE87C287C78B55_6029_UN,9.009381,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100001001001010100110011001001100011011001100101111011100001011111001110011111111110,PBPLDUMULTYISP-UHFFFAOYSA-N
N(CC3CN1CC2CC1(C2)CO3)C(=O)C4=C[NH]C5=C4C=C(C(=C5)Br)Br,97841F4DA8F3AEE3_1688980D8AC016A6_6038_UN,8.186489,00000000000100000000000000000000000000000000001000000100010000000110000000000000101101110011100111101100010101111000010011100100110110100110001011001011111111110111110,USJFHTXWOCENGS-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2C3(CCC2)OCCCC3)F,BCDCF21E83117CDC_B8E0694F83C0E3C1_7022_UN,7.449338,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110011010110101000110101011001001000100000110011110110001011011111110111101111110,OZEZXEFILFDSJT-UHFFFAOYSA-N
CC(C)C1=C(C=C(C=C1)NCC2N(C)CC3(CC2)CC3)F,97691532B84BEBB7_D53E85BF2E75C5A5_6041_UN,8.0141535,00000000000000000000001000000000000000000010000000000000000000000010000000110001001001110011010000101000010110011001101001100000110001110110011011011111010110101111010,FCXCXNRFVLVMQS-UHFFFAOYSA-N
O(C3CCN(CC1=CC=CC=C1)C2(CC2)C3)CC4CNC(CO4)(C)C,B95FE1CE0ECE7C57_7E1D6C49107439E3_6039_DP,8.155866,00000000000000000000001000000000000000000000000000000000010000000010000010110000001001100011000101101000110001011001101011100011110010000110001101011101110111111111110,VPBRRWDBVIUYLT-UHFFFAOYSA-N
CN5CC(C1=NN=C(C)N1C[C@H]2[C@@H](CCNC2)C3=CC=C(C=C3)F)C4(CNC4)C5,20F808040850318B_93882F9A159891D2_6034_UN,7.7520676,00000000100100000000000000000000000000100010000000001000000000100110000000010101101101110011011010101000110110011001101011101100110100100110001011011111010110101111010,SOXAJTAAVPTMBI-CTCAENTCSA-N
N1CCCC2=C1C=C(C(=C2)NCC3CN(C)C4=C(C3)C=CC=C4)F,CE87EDF93CC63C7A_5CE06A8B2CF524E5_6041_DP,7.754829,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001110011010000101100110110010001001011100100100101110110001011011011010110101111010,JUOQTYFOTIJBKU-UHFFFAOYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC4=C(ON=C4C)C=CC5=CC=C(C=C5)F,0BE2E7107A05DA40_15C0DD5DC9A956AE_6041_DP,7.998334,00000000000000000000000000000000000000100010000000000000010000100100000100000101100100010011001111110010110100010000001011001100010101110100001011010011100010101111110,KVCAEFVNPUIOCR-XPIZARPCSA-N
O(C2CCN(CC1=CSC=C1)CC2)CC3CNC(CO3)(C)C,FC902CCFADC4AF12_EE025EFE1FD1FA79_6039_DP,8.48688,00000000000000000000000000000000000010000000000000000000010000000010000010110000001101101011000111101000100001011001101011100011110010000110001101011101110111111111110,KCUDDGFUJALLHU-UHFFFAOYSA-N
CC1CCOC1CC=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,DFCE4BE854BCEE06_81FB25E408C2CA13_7019_UN,8.048454,00000000000000000000000000000000000000000010000000000000010000000000000000000000000101010000010010010000000111010001101000100000110011110100000010011110110111101111110,KEFCASMZFSRXKP-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC4CCN(CC3CCCO3)CC4,678FAB04C4BC06E4_0725825C4359A329_6041_UN,7.814824,00000000000000000000000000000000000000100000000000000000010000000100000000010100100101100010000110101100110001010000001011100100110011010110011011011111110111101111110,DHCVXTUQLRUUNV-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CN=C2)NCC3CCCN(C)C3C4=CC=CS4,5DA3CFB6BF8F520F_CD6FF6C2CB3C03D3_6041_UN,8.639227,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,GJCIPKKEVYRGIC-UHFFFAOYSA-N
O(C2(CC1=CC=C(C=C1)F)CCOCC2)C[C@@H]3N(C)CCC3,312B682225F12D0A_9D259CA1165F193C_6039_UN,7.594702,00000000000000000000000000000000000000000010000000000000010000000010000000010000000101110100010110101000000111011001101011100011110010100110000101011010110111111111110,MUQLBWOZYLAIFE-QGZVFWFLSA-N
C[N]1C=C(C=N1)C4=NCC(C=CC3=C(N(C)C2CCCC2)C=CC(=C3)F)O4,41183F8DA9414512_DCD09441E0470C57_7019_UN,8.706411,00000000000000000000000000000000000000000010000000001000010000100100000000010010100101010000111111011000000110110000111111101100010011110100001010011110110011101111110,CDKPPRYKHCBQCB-UHFFFAOYSA-N
CC2=C1N=CC=C(C1=C(C=C2)NCC3CC4CCC3N(C)C4)F,10B2064005505D11_677CCFA5BDE6E98D_6041_UN,8.642338,00000000000000000000000000000000000000000010000000000000000000000100000000010000101001110011010000101100010110010001101011100100110001110110001001011101010110101111010,DOGVTFUODGGKBP-UHFFFAOYSA-N
C1(=CC2=C(C=C1)OCCCC2=O)NC4=CC3=C([N](C)C=C3)C=C4,DFD5E6AB921FB80B_82D447199EFCE1BA_6041_UN,9.137303,00000000000000000001000000000000000000000000000000000000010000000100000000010000000101000100010010000100010001000100001011100101000011010100001111011001111011111111110,OFAKNIBFVAIMOE-UHFFFAOYSA-N
N4CCC1(CCCC1C=CC2=C(Cl)[N](C(=N2)N(C)C)C3=CC=C(C=C3)F)CC4,5FCB7DE9237FCBDC_9F9539A47B5EDE87_7019_DP,7.6651587,00000000000000000000000001000000000000000010000000000000000000100110000000110101001101110001010010111001111100011000001011100100110001110110001011011111010010101111010,FKFUEOZBHPOWSQ-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4(CCC4)C5=C(C=CC=C5F)F,4996FF0FEB0F6C96_B19A410C4F4EDE9F_6041_DP,8.413495,00000000000100000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010010101111010,SZMHMMOTYKXREH-ZHZUQJFRSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCCC(CC3)C4=CC=CC=C4,04B775B5741C926A_113030EB5F225506_6041_UN,7.730515,00000000000000000001000000000000000000000010000000001000000000100100000000010000101100010011011010001100010100000000001011101100110001110100001001011001010110101111010,JVMQGAPEBWAHCX-UHFFFAOYSA-N
CCN3CCC1=C(C(=CC(=C1)NCC2(C)C=CCCC2)F)C3,4E6506324253B298_0001B14DE5B03C1F_6041_UN,8.065918,00000000000000000000000000000000000000000010000000000000000000000010000000010000001001110011000000111100010110011011101001100000110001110110001011011101010110101111010,UTRQLVCAQHXFAQ-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC34CNC(C3)CO4,3D91C90589864ADD_E9626C3E0767492A_6041_DP,8.01835,00000000000000000000000000000000000000100010000000001100010000100110000000010101101100010011011111101000110101011000000011101100110111110110001011001011110111101111110,LRBPYQXDLRJADG-UHFFFAOYSA-N
O=[N](=O)C1=CC2=C(C=C1)C(=CC=N2)NC4=C3OCCCC3=CC(=C4)F,445D58640330B096_8062F2263988A7D4_6041_UN,8.310873,00000000000000000000000010000000000000000010000001000000110000010100001100000000100000010001001100100110010101000100001111101100101011110100001011111001110011110111110,ZWAYQNWSHXLFLF-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC(=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,46E612F957017115_1C29AC04F282DC8D_6041_UN,8.618988,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110101110110001011011011010110101111010,ZOGFIJBONARFTQ-VFNWGFHPSA-N
FC1=C(C=C(C=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)C4OCCO4,20716A0C66CF993D_2C5756B68EF6AC70_6041_UN,8.3398485,00000000000000000000000000000000000000000010000000001000010000100100000010010000101101110001011110101000000111010001101011111100110011110110001011111111110111111111110,ZIRKMUGRJUUSKD-ROUUACIJSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3(CCC)CNCC3)Cl,045CD4238E7128A0_7C72A9A2C71871A1_6034_UN,8.574356,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101111011000010001001101110011011001111100100110101110110001010011111010110101111010,PDFXLBDGAMCQNS-UHFFFAOYSA-N
CN4CCN(CC1=C(C=CC=C1)NCC2CCC3(CC2)C(C3)(F)F)CC4,9DF492A08CD3D6C7_D441B30C34B3DFC9_7022_UN,8.091581,00000000000000000000001000000000000000000010000000000000000000000010000000010001101001110011010000101000010100011001101011100000110001110110001011011011010110101111010,OLVZIYJJUXZYTL-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@H]4N[C@H]3CCO[C@H]3C4)Cl,D634B6A2C01033E3_BFF02A508784E442_6034_UN,8.085888,00000000000000000000000000000000000010000000000100000000010000000100000000010111010101011011000111001101111101010000001111100100110111110110001010011011110111101111110,XLFODKMGKCDPQQ-JQFCIGGWSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCCCC3)CC4=C(C=C(C=C4)F)F,B421A0AACF13BD65_7280AB84A5935BBD_6041_UN,7.8741293,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100110001110100001011011011000110101111010,MZVHDMCOLRQHFQ-UHFFFAOYSA-N
N1CCC4(CC1)CCC2=C(C=CC(=C2)NC3=CC=CC(=C3)CN(C)C)O4,9B75722DD2774761_46F36162C4FFB910_6041_DP,6.96592,00000000000000000000000000000000000000000000000000000000010000000010000000100000001001100001010001101100110000011101001011100100110111010110001011011101110111101111110,RJBCGADHTBXKQK-UHFFFAOYSA-N
C(CC1COCCO1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,2EFFA06726494656_9241967DD99BA37B_7019_UN,8.043468,00000000000000000000000000000000000000000010000000000000010000000000000010000000000001110000010010110000000111010000101010100000110011110110000011011010110111111111110,OHDKYWJZOTVSHQ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)N[C@H]3CC[C@@H](N2CCN(C)CC2)CC3)C4OCCO4,02AFA5BC84F4B59D_BC951022387F07BA_6041_UN,7.118352,00000000000000000000000000000000000000000010000000000000010000100000000010010001000101110010010010101000100101010001101011110000110011110110001011011011010011111111110,AWZNLYXTFWIJSU-WOVMCDHWSA-N
CC5=NC1=C(C=C(C=C1F)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4)S5,EF3D6606BE0E4C6C_1689C0D4A7574614_6041_UN,8.354324,00000000000000000000001000000000000010000010000100000000000000000110000000100000011100011011000010001100010100001001101011000100110001110100011011010101010110101111010,VTXHOVBBNZNDQD-UHFFFAOYSA-N
N2CCC(OC1=CC(=C(C=C1F)C#N)F)CC2C3=CC=CC=C3,D0998825CEC21FE9_F7162C1D34C29D2B_6003_DP,8.084307,00000000000000000000000000000000000000000110000000000000000000100000000000000000001000010001000001101000100100010100001001000111110010100100001111010011110011100111110,CENOAKMLQGIBMY-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC3CN(CC2=CC=CC=C2)CC34CCC4)Cl)C5CC5,E1C7CBA762FED9F7_53DCCF12092FA6BF_7022_UN,8.262331,00000000000100000000001000000000000000000000000000000000000000100010000000010000101101110011000010001001010110001000001001100100110001110110001011011011010110101111010,PSTFWBFZDFCWCU-UHFFFAOYSA-N
CC1=N[N](C(=C1)NCC2CCN(C)C2C3=CC(=C(C=C3)Cl)F)C4CCCCO4,FDB2E7E0EC150E62_EADDB661E82F7DF7_7022_UN,8.463307,00000000000000000000000000000000000000100010000000001000010000100100000000010101101101110011111111101001000111110001111011101100110011110110001011011111010111101111110,NAPOYOGXONSELK-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C(=CC=C2)NCC(C3CCNCC3)F)C,271F7BB3F940CBF6_E1DEA756CB531A38_6041_DP,8.655511,00000000000000000000000000000000000000000010000000000010000000000100000000000001001100100001000010101100110100010000001011000100110101110110001011010111010110101111010,QZSJJSSDPBXQAG-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC3(CCOCC3)CC4=CC=C(C=C4)F,A77433F59985A6E5_581E30E7CA83A478_6041_DP,7.9390144,00000000000000000000000000000000000000100010000000000000010000100110000000010101101101110011010011101000100111011000001011100100110111110110001011011011010111101111110,JCEIKEURMHHEBN-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)N[C@@H]2CCO[C@H]2C3CCNCC3,587628293B9ED212_23FC510CD9D77C53_6041_DP,8.110998,00000000000000000000000000000000000000000110000000000000010000100000000000000000001100110011000111101000100101010000001011000000110111110110001011010011110011101111110,PYOCCPOHCLTHLX-WBVHZDCISA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCCC3)CC4=C(C=C(C=C4)F)F,E39B6E30B61980D8_FF5B9C394960878C_6041_UN,8.045636,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100110001110100001010011011000110101111010,OXXFRAWDIOLHHY-UHFFFAOYSA-N
FC2=C(C=C1C(=CC=NC1=C2)NCC3CCCN(C)C3C4=CC=CS4)F,68DD985D6E0955E2_7880B36745EC4EC3_6041_UN,8.783006,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,RTYVVRDOERVYMB-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,5216932B618EE2D8_B32FB1CA5929D507_6041_UN,8.381855,00000000000000000000001000000000000000100011000000001000000000100100000000010101101101010011011010101100010100010000001011101100110101110110001011011011010110101111010,QVLADHCTSDIMPJ-VFNWGFHPSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCOCC3)C4=CC(=CC=C4)F,25A6EF51BDC27D08_927CF93A09719C7E_6041_UN,7.6798077,00000000000000000000001000000000000000000010000000001000010000100110000000010001100100110011011011100000100101011000001011101100110011110110001011011011010011101111110,SNFUQZFFXFTODV-UHFFFAOYSA-N
C1(=CN=C(C=C1)C2OCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,A0F8A06F9A80B52F_3ECF07FDD3A892EA_6041_UN,8.866564,00000000000000000000000000000000000000000010000000000000010000100100000010010001100101110011010110101000100111010001101011110100000011110110001011011011010011111111110,IMQVKKBNOBIJPY-AEFFLSMTSA-N
N4CC1=C(C=C(C=C1)NC(C#N)C2=CC(=C(C=C2)F)F)C3(CC3)C4,61469D0583055FB9_59105B2B0807B5DF_6041_DP,8.04351,00000000000000000000001000000000000000000110000000000000000000000010000000000001001000110011000000101100010100001000000001000100110101110110001011010011010010100111010,PZDDFOFRGLMVTR-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC[C@@]23CCCN[C@H]2CCCC3)F,43B4235B1326C7EC_1A0D73FCC9158828_7022_DP,7.5524216,00000000000000000000000000000000000000000010000000000100000000000010000000100000101001110011010000101100110100011001001001100000110101110110001011011111010110101111010,OKCNLEZKXGBIEY-RBUKOAKNSA-N
FC1=C(C(=CC=C1)NCC3=C2CCCCC2=N[N]3C)C4CC4,2E76DDC383231932_A163B80A882A0F4F_6041_UN,7.789911,00000000000000000000001000000000000000000010000000001000000000100100000000010001101100010001011010001100010110010000101011101100110001110100001011011011010110101111010,NKBFHHVTWVIXBQ-UHFFFAOYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC4=CC(=C(C=C4)N5CCCCC5)F,C0EC6FF0554495F3_AFBE3D514724BED1_6041_DP,7.533922,00000000000000000000000000000000000000100010000000000000000000100100000000010101100101110011000010101000110100010000001011100100110101110110001011011011010010100111010,OAXLFTDNEJIBSS-MDOVXXIYSA-N
FC1=CC5=C(C(=C1)C=CC3=CC(=C2OCOC2=C3)C4=C(C)[N](N=C4)C)OCOC5,D3103A515AF641D1_EDA08D0B3E5CAD56_7019_UN,8.371799,00000000000000000000000000001000000000000010000000001000010000100100000010010000100100110100011010110100010101000100000011111100100000100110101011101110110011111111110,NVQJKBLSEHCMEF-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)NCC2CNCC(O2)(C)C)C#N)F,F21C68D7D66CDF4B_33C3B3FD2C76B9FA_6041_DP,8.450455,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110001011000111110111101111110,OQYQFYYXEDZQNS-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CC3)C4=C(C=CC=N4)F,BA7A58F735756754_B429F1DD6D30714C_6041_UN,8.115735,00000000000000000000001000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100010001110110001011011011010110101111010,CDLLPNHQBQTAPE-INIZCTEOSA-N
FC1=CC4=C(C(=C1)NCC3(N2CCN(C)CC2)CCCCCC3)OC=C4,BD94FDA6F2F923BD_17C5928569C52A86_6041_UN,7.8539915,00000000000000000001000000000000000000000010000000000000010000100010000000010001001101110011010110101100010100011001101011100100110001110110001001011001110110101111110,GYHXRRITLKDDLW-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CCN2CCNCC2(C)C)C=CC(=C3)Cl)C4,FE9E2BCF5F9D118D_37361E13B4224A3A_6034_UN,8.203012,00000000000000000000000000000000000000000000000000000000000000000110000000110001001101110011000010101101110110011011101011100100110101100110011011011111010110101111010,ONZJGWOCAZUBSR-UHFFFAOYSA-N
CC1=C(C=CC(=C1)NC2CCN(C)C23CCCNC3)C#C,171595DB8E2F8E05_7520445638EAC951_6041_DP,8.138718,00000000000000000100000000000000000000000000000000000100000000000010000000010001101101100011010010101000110010011001101011100000110101010110001011011111010010101111010,QBYHFYRDODHRHG-UHFFFAOYSA-N
CCC(C)C2=C[N]1C=CC=C(C1=N2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,9336B09280049B90_3F109C27B1BC1B88_6041_UN,8.322245,00000000000000000000000000000000000000100010000000000000000000100100000000010101100101110011010010101100110110010011101011100100000001110100011001011111010110101111010,XZJBNEMACCZNBW-BAMDKVGYSA-N
FC2=C(C=C1C=CN=CC1=C2)NC3CCN(C)C34CCCNC4,C7116C960F95CC6D_B7C17920CFCEB983_6041_DP,8.717587,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001011011011010010101111010,UFZRSHFWAWGLTF-UHFFFAOYSA-N
FC2=C(C=C1C=NC=CC1=C2)NCC3CCCN(C)C3C4=CC=CS4,088C011FF495537C_FC7C932015706162_6041_UN,8.758502,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,JAZOSAOMPFYYIH-UHFFFAOYSA-N
CC1=C(C=CC(=C1)NC[C@H]2[C@@H](C2)C3=C(C=CC=C3F)F)OC4CCOC4,E438044FA729551A_A7228271873C55EB_7022_UN,7.9729958,00000000000000000000001000000000000000000010000000000000010000100000000010000000001100110111000010001000000101000100001000000111010011110110000111010011110111111111110,UCCGHJLLUFCDQR-DRXWIORDSA-N
CC1=CC2=C(C=C1)N(C=C2Br)C[C@H]3[C@@H](CNC3)C4CCOCC4,2A1D181B35C423AA_C37C1D199EFC15BF_6034_UN,9.283177,00000000000000000000000000000000000000000000001000000000010000100100000000010000101101110011000010101100010101000000001011100100110010100110001001011011010111101111110,HLEPGQLUSIIHEB-RDJZCZTQSA-N
C[N]2C=C1C=C(C=CC1=N2)NCC3(CCOCC3)C4=CC=C(C=C4)F,1C355D304BCBE0A0_3DF5F17422550A16_6041_UN,7.32781,00000000000000000000000000000000000000000010000000001000010000100110000000010000101100110011011010101100010101001000001011101100110011110110001001011001010111101111110,GJMVXMNNYAQCOX-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,E7B55A7247EE32A3_D8AA4EE44BEB14B2_7022_UN,8.384751,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110011011011111110111101111110,RNRUAQLOGRXRRF-IRXDYDNUSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@H]2C[C@@H](OCC2)C3=CC=CS3)F)CC4,74CA24563C3D9BCD_7C35BF5E8061854D_6041_UN,8.088387,00000000000000000001000000000000000010000010000000000000010000100000000000010001110101111010010011101000100111010001101011100100110011110110001011011011110111101111110,CPGOHTCIRMAQGY-TZIWHRDSSA-N
C1(=CC=C(C=C1)Br)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,F4C7B2834DC55395_DBE801817E673018_7022_UN,7.8040276,00000000000000000000001000000000000000000000001000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,RMCMANSCBQQWDD-KUHUBIRLSA-N
C1(=CC=C(C=C1)Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,89EA3BDC6CC719DE_4B71819B88715DC2_7022_UN,7.8040314,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101001000100010000001011101100110001110110001011011011010110101111010,PYNVYVLHSLISJU-KUHUBIRLSA-N
CC1=C(C=C(C=C1)Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,D51A2EEE63506AC9_34A9A30E49592B80_7022_UN,8.384733,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110011011011111110111101111110,YFVWHGICMOWTQH-IRXDYDNUSA-N
C1(=CC=C(C=C1)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,D3610BE899516104_102D213DD9C274B6_7022_UN,7.8040185,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,YMHPAYYNIRGWHF-KUHUBIRLSA-N
C1(=CC2=C(N=C1)CCOC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,89CA2B5306FE37E0_17AE58330A1C44BE_6041_UN,8.789527,00000000000000000000000000000000000000000010000000000000010000100100000000010001100101110011010011101100110111010001101011100100110011110110001011011011010011101111110,NPONPBQUYCSCRT-MOPGFXCFSA-N
N1C2CCCC(C1)C2CNC(=O)CC3=C[NH]C4=C3C=C(C=C4)F,7CA0AFB6DC0DE087_8283939246147B90_6038_DP,8.026847,00000000000000000001000000000000000000000010000000000100000000000100000000000000101100010011100010001100110100110000011011000100110110100110001001010001011110100111110,POQOTSVUFWQLFN-UHFFFAOYSA-N
N(C2C1C3CC4C1CC5C2C3C45)C(C7=C(C6=CC=CC(=C6[NH]7)CC)F)=O,3F31E4CA46BFB549_AF76CBAC4C79F4E0_6038_UN,8.683276,00000000000100000001000000000000000000000010000000000010000000000100000000000001000100010011100110000100010100100010010001000100110101100100001011000011001110101111110,AOUCMTIZLVQZET-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=CC(=CN=C3)F,475F04A30160B903_CFEB9443CAC600FE_6038_UN,8.2223215,00000000000000000000000000000000000000000010000000000000000000000100000000000000001000010011100000111000110100110000011001000000110010100100001001010001011110100111110,USXRTNUOKFMBLM-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@H]3[C@H]2COC[C@H]2C3)F)CC4,E341106FDB19CAF9_FC4BD7ED90A953D6_6041_UN,7.462874,00000000000100000001000000000000000000000010000000000000010000000000000000010001100101110011010011001000110111010001101011100000110001110110001010011011010111101111110,NKROKCIGCQGNEG-HHXXYDBFSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CC4CCC(C3)O4,EB33238E4FE565A6_3B0303B71741EEDA_6041_UN,8.240951,00000000000000000001000000000000000000000010000000001000010000000100000000010000101100010010011010101100010100000000001011101100110011110100001001011001110111101111110,NNTBBDKFKNOFAD-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CCOCC3)C4=CC(=CC=C4)F,AA058998FE294FAF_5A73778D4AFD5E44_6041_UN,7.89176,00000000000000000000000000000000000000100010000000000000010000100110000000010100101101110011010010101000000111011001101011100100110011110110001011011011010111101111110,YPDGPDUXBFMQEM-FQEVSTJZSA-N
FC1=CC2=C(C=C1)C=NC(=C2)NCC3N(C)CC4(CC3)CC4,1F88B7BFFEABF8F2_D1001CFA74E18F3F_6041_UN,8.348933,00000000000000000000001000000000000000100010000000000000000000000110000000010101001001110011010000101100010110011001101011100100110001110110001001011011010110101111010,TVHHVKPRSFBVOQ-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2CC2)NCC3=N[N](C)C4=C3CNCC4,04DD50F89720532D_911ABA139E193095_6041_DP,8.2248,00000000000000000000001000000000000000000010000000001000000000100100000000010001101100110001011010101100110110010000101011101100110101110110001011011011010110101111010,BCRLZOAWRJZVCQ-UHFFFAOYSA-N
CC1=C(C=CC=C1NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,5DDC0B701F02EE1A_3F8DC19B47FC972E_6041_DP,7.465376,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100110010000001001000100110101110110001011010011010110101111010,PJEXEIWRAFBYGL-PKOBYXMFSA-N
N(C1=CC2=C(C=C1)OCCC2)[S](C4=CC3=C(C=C[N]3C)C=C4)(=O)=O,A5FCAAD17E93B9AF_EFE0A58EF1DA0F0F_6029_UN,8.810045,00000000000000000000000000000000110000000000000000010001011111001101010001010000010101001001011010100110011001001100011011101100101011011100001011111001110011111111110,TWSVPKZWRHNTLO-UHFFFAOYSA-N
C2=CC1=C(C=CC=C1)N2C4=C(CN3CCCCC3)C=CNC4=O,C02DAC72A8D225F7_9DF441F42CC00A0A_6034_UN,9.030512,00000000000000000000000000000000000000000000000000000000000000100100000000010001100101100001100110101100010000110100011011100101110001010110001111011011011110100111110,DXIWSHCLVDPTNG-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(CC)CC3)C4=CCNCC4,11D8EAAD639C12ED_E6BEEB4FE756DC3D_6034_UN,8.703188,00000000000000000000001000000000000000000010000000100000000000100110000000011000001101110001000010111100110100011010101011100100110000100110001001011001010110101111010,DJUKUZRRNKGAKM-UHFFFAOYSA-N
FC1=CC(=CC=C1)CC2=CN(C=N2)CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,694A20F4261A9AA2_ABA55A50A9161A43_6034_UN,8.023571,00000000000100000000000000000000000000000010000000000000000000000110000000110101000101010000000010001000010110011000101011100100110000100100001001011100010110101111010,ZQKCFYCBVFHNHK-SQGPQFPESA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC4C(C)(C4)C5=CC(=CC=C5)F,5246011C643CE4A4_C1D668917D1D26A5_6041_DP,7.329322,00000000000000000000001000000000000000100010000000000000000000100110000000000101100100010011000010100000110100011001101011000100010101110100001001010011000010101111010,JGCLBWWXVMFUNH-DACZGVNWSA-N
C[N]2C=C1N=CC(=CC1=N2)NCC3(CCOCC3)C4=CC(=CC=C4)F,F15C6448581D4B9A_A950E4C407DE6C8D_6041_UN,7.4772243,00000000000000000000000000000000000000000010000000001000010000100110000000010001101100110011011010101100010101001000001011101100110011110110001001011001010111101111110,PZMOMMKBSIBPJT-UHFFFAOYSA-N
C1(=CC=C(O1)C2CC2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,6BE25FE9E52C7961_2A3F7F8BADE3A539_7022_UN,8.145372,00000000000000000000001000000000000000000000000000000000010000100000000000010000101101110011110010101001000110110001111011100100110001110110001001011011110110101111110,RCBUEMIFBJUSPO-UHFFFAOYSA-N
C[N]1C=CN=C1C(NC(=O)CC2CC3CCC2O3)C4=CC(=C(C=C4)F)F,051A75A66ED2937A_E8EDAB1B2F493EAA_6038_UN,7.923997,00000000000000000000000000000000000000100010000000000000010000000100000000010101000101010001110010000000110100110000011011100100110010100100001011011011101111111111110,PIXBTCPUNNEFSY-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,23A41070A2984F64_2623E0F23B50A862_6041_UN,8.457111,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011111010110101111010,FKCLHCYRKKHHRC-HXOBKFHXSA-N
N5CC1=C(C=C(C=C1)NC2=C(C=C(C=C2)N3CCCCC3)F)C4(CC4)C5,5C263E479DAC6D1F_B54378C7DD76D5E6_6041_DP,8.074584,00000000000000000000001000000000000000000010000000000000000000100010000000010000001001110011000000101100010100011000001011100100110101110110001011011011010010100111010,JSRCDHRYTWURRC-UHFFFAOYSA-N
CCC1=C(C=CC(=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)F,72B23A6C4DE12F55_5763172388B98CDE_6041_UN,8.271771,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010011101011101100110011110110011011011111110111101111110,NGUUVBJOHHWOSR-ROUUACIJSA-N
NCC3(OC1=C2C(=CC=C1)OCCNC2)CCC4=C3C=CC(=C4)F,6C0A4429F70013DA_5B9F9D102D5C2394_6035_UN,7.698653,00000000000000000001000000000000000000000010000000000000010000000010000000000000001010110111000111001100110101011100001011000111110110100110001111010001110101110111110,AKWIMFWFEWCVPP-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3CCNC4(C3)CCC4,1A6ABA53BCCC9141_8BC35AE1745DAEBA_6041_DP,7.5467224,00000000000100000000000000000000000000100000000000001000000000100110000000010101101101000011011010101000110010011000001011101100110101010110001011011111010110101111010,DUDKYFQDTFQOJH-UHFFFAOYSA-N
FC1=CC(=CC=C1)NCC2=NC=CN2CC3CNCCC34CCN(C)CC4,6FCDFA3646CB73C5_9FC98C02D04C10AB_6034_UN,7.9540715,00000000000000000000000000000000000000100010000000000000000000000110000000010101101101110011010010101000110100011001101011100100110101110110001011011011010110101111010,WFEMFIHIABHBKC-UHFFFAOYSA-N
ClC1=CC(=CC=C1)NCC2=NC=CN2CC3CNCCC34CCN(C)CC4,531FA5C433112827_C2163BF1705BB2AA_6034_UN,7.9540434,00000000000000000000000000000000000000100000000000000000000000000110000000010101101101110011010010101001110100011001101011100100110101110110001011011011010110101111010,ILPYYXIWNIYQOS-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC4OCCN(CC3=CC=CC(=C3)C)C4)F,DA59586D285A813E_2EC4509E25AE6389_6041_DP,7.6861224,00000000000000000000000000000000000000000010000000000000010000000000000000010000101001110011000100101100110111010000001011100100110111110110001011011011110111101111110,XCTFGJWEKLNLFH-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NC2=CC(=N[N]2C)C3CCCOC3,759F9936B646795C_287FAE51F79F6AFA_7022_UN,8.690846,00000000000000000000000000000000000000100010010000001000010000100100000000010101100100110000011011110000000101000000001011101100110011110110001011011011010011101111110,HJMPOOIAGWBIPH-UHFFFAOYSA-N
N(CCN1CC2C(C1)C3CCC2C=C3)C(=O)[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)F)F,5168F1D184DB89FC_D76911F96EC40A64_6038_UN,8.003868,00000000000000000000000000000000000000000010000000000000010000100000000000010001001101110111100011011100110101110000011011100000110010100110001011011011111111110111110,NLOMTOWOJVRPEB-CFHJBFKDSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4C(C)(C4)C5=C(C=CC=C5F)F,F0753096C06EE65E_F7ED5C15B0EA1C69_6041_DP,8.51702,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011001100011100100110101110110001011001111010010101111010,CGXVSQMCPXAFNE-BKZZUPSISA-N
N(CCN1CC2C(C1)C3CCC2C=C3)C(=O)[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)Cl)F,89150850258EF2EC_B4FCF0DB6B21F3E1_6038_UN,8.003843,00000000000000000000000000000000000000000010000000000000010000100000000000010001001101110111100011011101110101110000011011100000110010100110001011011011111111110111110,PTJOMNIFDPCDLF-CFHJBFKDSA-N
C(=CC1=CC(=CC(=C1)F)F)NCC23CCC(C)(CC2)OC3,BE1E802ACCDA0B5E_44D35447C803ECBB_7022_UN,7.2888665,00000000000000000000000000000000000000000010010000000000010000000010000000000000001000010011000001111000010101001001101000000000110010100110000001010001110101101111110,TZZRPHIFLBWJNO-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCCC3)C4CC4,116768312FC9A1B3_90641292F4FA13FE_6041_UN,8.178049,00000000000000000000001000000000000000000010000000001000000000100110000000010000101100010011011010001100010100001000001011101100110001110100001000011001010110101111010,JPUVHFAJYLBEMP-UHFFFAOYSA-N
O(C2CCC1=C(C=CC=C1)C2)CC3=CC4=C(C=C3)NC(=O)O4,DCD3DDE617C414A6_79F9E8EB9F2E4AAC_6039_UN,9.042405,00000000000000000000000100000000000000000000000000000000010000000100000000000000000100000000000110000100011001100100011011010111110010000100000111110001111111010111110,DIHQWZZGFLWUAA-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CC3(CC2=CC=CC=C2)CCCNC3)C(=CC(=C4)F)F)C5,F2E3170C0F47DF8A_F680FAA43C383EBB_6034_UN,8.339724,00000000000000000000000000000000000000000010000000000000000000000110000000110000101101110011000010101100110100011001101011100100110000100110001011011101010110101111010,FKFSKQHYADGFGH-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC3OCC2(CNC2)C3)F,E6F7D16CD8ED8AEF_88021ABE2B36B4B1_6041_DP,7.4336443,00000000100100000000000000000000000000000010000000000000010000000010000000100000001101110011010111001000010101001001000011100000110111110110001010001111110111101111110,KFSIJVFNYFQRDX-UHFFFAOYSA-N
N1CCC3(CC1)OC4(COC2=C(C(=CC=C2)C(F)F)F)CC3(N)C4,F34E115121E557AC_352209D9CA439ACC_6035_DP,8.084918,00000000000100000000000000000000000000000010000000000000010000000010000010000000001110110011000111101000110101011100001011000011110111100110001111010011110111110111110,NARYYXCRVHDUOF-UHFFFAOYSA-N
CN1[C@@H](COCC1)COC2=CC(=C(C)C=C2C3CNCC3)Cl,E8F66BA12F1853F7_424A0F275788074F_6035_UN,8.1413765,00000000000000000000000000000000000000000000000000000000010000100000000000010000001101110111010110101001100101010101101011100011110010100110001111011111110111111111110,RLYUDALLNUXPEB-KZUDCZAMSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCCC3C2CC2CC3)F)CC4,1789F6653EB49907_4034C55F0C7CA389_6041_UN,8.181848,00000000000000000001001000000000000000000010000000000000000000000000000000010001101001110001010010001000110110010001101011100000110001110110001011011011010110101111010,MFSBFTBRKPEBKX-UHFFFAOYSA-N
COC1(COC1)C2=CC=C(C=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,53C690B23874F3D9_B8324CED529CAF6E_6041_DP,7.533927,00000000100100000000000000000000000000000010000000000100010000100010000010000000101000110011010000101000100101011000101011000111110111110110001101010011110111111111110,ZVRABBBPDRYDIK-LAUBAEHRSA-N
C1(=CC2=C(C=C1)OCCCC2=O)NC4=CC3=C(C=C[N]3C)C=C4,769537B190404B64_08FDE0959BC98EDB_6041_UN,9.415,00000000000000000001000000000000000000000000000000000000010000000100000000010000100101000100010010000100010001000100001011100101000011010100001111011001111011111111110,OTIMDDXBLSLZEL-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4=C(C=CC(=C4F)C)F,FF2FA60FDC0F75E9_9150EFF450E4B2BD_6041_DP,8.657622,00000000000000000001000000000000000000100010000000000000000000000100000000000101100101010011010010100000110100010000101011100100110101110100001011011111000010101111010,LSMNCALDVNRVLU-BTTYYORXSA-N
CC2=C1N(C=CC1=CC=C2F)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,514083266BCC882A_BA78AD41C10C08F3_6034_UN,8.627508,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101100010110010000001011100100110001100110001011011110010110101111010,CJFZXANPBWQDKT-VGSWGCGISA-N
FC1=CC(=C(C=C1)NC3C[C@H]2CCC[C@H](N2C)C3)C=C,A67D84A0A290B5A4_EDCB32DA3FEDC744_6041_UN,8.041383,00000000000000000000000000000000001000000010000000000000000000000000000000010000100001010001010000110100110110010000101001100000110001110100001011011011000010101111010,NOCSULATCGDLET-MQVJKMGUSA-N
N4C[C@@H]1COC[C@]1(C=CC2=C(C)[N](C(=C2)C)C3=C(C(=CC=C3)Cl)Cl)C4,F3E0D282A8601A0A_1482C6FC01652A3E_7019_DP,8.729132,00000000000000000000000000000000000000000000000000000000010000100110000000010000001101110011000011011101010101001000000011100100110001110110001010001111010011101111110,FCOJPHDYMOMCDT-UZLBHIALSA-N
CN(C)CC1=C(C=C(C=C1)NC3CCC2(CCCCO2)CC3)F,55331FDFC807EF9D_D2824D341D6243A3_7022_UN,7.9901237,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110010010000101000110101011001001000100000110011110110001011011111110111101111110,GGCIYIAOZAQNIK-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)NCC3=C(C=N[N]3C)C4CCC4,A5FFA4274FE76D75_71C399A1542B191F_6041_UN,7.816375,00000000000100000000000000000000000000000010000000001000000000100100000000010001101100010001011010001100010100010000101011101100110001110100001010011011010110101111010,COTYVBCGIMVZPL-UHFFFAOYSA-N
C1(=C(C=C(C=C1)F)Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,A5DB3B02B49C7B03_5ABFDE612D3FC5C3_7022_UN,8.781997,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,QQDWLXKVLGJYCX-HOTGVXAUSA-N
C1(=C(C=C(C=C1)Cl)Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,FD147B14C5C2D439_40DA6B53C28185EC_7022_UN,8.781993,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,HYNMZUYBEBNMRZ-HOTGVXAUSA-N
C1(=C(C=C(C=C1)F)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,7FEB16AB1186C1C6_CF7ED99D478E8B22_7022_UN,8.781989,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,KXAXYLBBCASGPP-HOTGVXAUSA-N
C1(=C(C=C(C=C1)Cl)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,D7DCFB88AFF4A3B1_AD26DFE115042E72_7022_UN,8.781973,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,GEEZXUOSHUCJEE-HOTGVXAUSA-N
FC1=C(C=CC2=C1CCC2)NCC3CCCN(C)C3C4=CC=CS4,025CA656B8607AEC_4778B02BF996AF69_6041_UN,8.017149,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,RYHVVKXRDAZOSD-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCN(C)C23CCCNC3)F)CC4,4F814CD8D53AB28C_B1E4BDD8348A083C_6041_DP,7.7305403,00000000000000000001000000000000000000000010000000000100000000000010000000010001101101110011010010101000110110011001101011100000110101110110001011011111010110101111010,CSSMIISSNVCQOO-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)NCC2CNCC(C2)(C)C)C#N)F,22A9FA35ED769BBE_9FCD1208A7E42044_6041_DP,8.440299,00000000000000000000000000000000000000000110000000000100000000000010000000100000101000110010000000101000000110001001000001000000100101110110001011000111010110101111010,VUIJXRMHGGACDL-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3COC2(CC2)C3)F)CC4,1987521A3336A154_D36C31655173401F_6041_UN,7.0262327,00000000000000000001001000000000000000000010000000000000010000000010000000010001100101110001010111001000110111011001101011100000110011110110001010011011110111101111110,QVCTXBOXNVNMTA-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CNC3(CO2)CCC3)F)CC4,23B345090DE42A10_769C7B6D6FB72627_6041_DP,7.5284786,00000000000100000001000000000000000000000010000000000100010000000010000000010001101001110011010100101000110111011001101011100000110111110110001011011011110111101111110,SGWKYXBVDDFYSX-UHFFFAOYSA-N
CC1(C)CCCCC1C=CC2=C[NH]C3=C(CC)C=CC=C23,13389EB2273E07FB_F8A8AED6500915B8_7019_UN,8.551215,00000000000000000000000000000000000000000000000000000000000000000110000000100000000100000010000010010100010010001011101001000100110000000100010001010111000110001111010,NBTKAXWCUJQQLH-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C[N](C)C4=C3C=C(C=C4)F,8B735E8A292BD222_FD5FA3A3166D5FC8_7019_UN,8.242195,00000000000100000000000000000000000000000010000000000000000000000110000000010000000101010000010010010100010100001000001001100100110000100100000001011000000010101111010,GEULGDDGZVJJNE-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)C3=NC2=C(C=CC=C2)[N]3C[C@@H]4C[C@H]4C5CCNC5,8E25E3E890339DFE_D3D4309C0B227A63_6034_DP,8.478229,00000000000000000000001000000000000000100010000000000000000000100100000000010101001101110011000010001100110100010000001011100100110000100110001011011011010110101111010,DNPRRICNMVFMEW-RRSHCKCTSA-N
FC1=C(C=C(C=C1)C2=NC=CN2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4)Br,B7B6CBD8A4E041B2_88E868B6AEA7A8AD_6034_UN,8.238948,00000000000100000000000000000000000000100010001000000000000000100110000000110101000101010000000010001000010110011000101011100100110000100100001011011110010110101111010,DXUVJXPMMNIGCY-NUEKZKHPSA-N
FC1=C(C=C(C=C1)C2=NC=CN2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4)F,10CA719BFBAE6AFE_7B30E30D1CDE8259_6034_UN,8.238935,00000000000100000000000000000000000000100010000000000000000000100110000000110101000101010000000010001000010110011000101011100100110000100100001011011110010110101111010,HHGSWUBZQFLZFN-NUEKZKHPSA-N
N(C1C2C1C3CCC2C3)C(C5=C(CC)N=C4C=C(C=CC4=C5)F)=O,F4332D70AF300FF5_55FD281FE2B7D03D_6038_UN,8.233582,00000000000000000001001000000000000000000010000000000000000000000100000000000000100000010001100011100100010100110010011001000100010001100100001011010011001110101111110,VWLYUKYXZMGKFL-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NC2(C)CCC3(CC2)OCCO3,193CDCE66FDC06DF_DBC5D5AE0AC77F76_7022_UN,8.674895,00000000000000000000000000000000000000000010010000000000010000000010000010000000000100010010000010010000110101011001101010010000110011100110000001010001110011111111110,FBLKTINSRDCWRE-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)F)C#N,C7B715BE58A44243_5B7FAE71DDBC650F_6041_DP,8.166288,00000000000000000000000000000000000000000110000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001111010110101111010,WUBPYSKKZCDOPG-UONOGXRCSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@@H]3CN[C@@H]4CCCC[C@H]34,40DE01C95EB91208_A8DAABE031B5C320_6041_DP,7.969697,00000000000000000000000000000000000000100010000000000100000000000100000000000100101100010011000010101100110110010000001011000100110101110110001011010111010110101111010,GNPJDYQIHWLLJG-HDMKZQKVSA-N
C4CC1=C(C3=C(N1CC2(CN(C)C)CCCCC2)C=CC=C3)CN4,D0EE4C4FDF1046B2_F84D8BB2833652EA_6034_UN,7.4385767,00000000000000000000000000000000000000000000000000000000000000000110000000110000101101100001010010101100110010011001001011100100110000000110001011011101010110101111010,YNPRGKRRXKYOOX-UHFFFAOYSA-N
FC1=C(C=CC(=C1)CC#N)NC(C2CNC2)C3=CC=C(C=C3)F,59CE8D0DA5EA32DA_188B32EB4288CEF5_6041_DP,7.454597,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110010000000001000000100010000000001000100000101110110001011000011010110100111010,FQSUYURCIJVLPT-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,A45989D3500E4C49_780DA582369A2DFE_6041_UN,8.495026,00000000000000000000000000000000000000100010000000001000010000100100000000010100101101110001011110101100010111010001101011101100110011110110011011011111110111101111110,OADPNEGOQXYMRG-ICSRJNTNSA-N
N(C1C3C2CC(CC(C1)C2)C3)C(C5=C(CC)N=C4C=C(C=CC4=C5)F)=O,2751D6FC64B8654F_0C34CD04E7F164C4_6038_UN,8.361824,00000000000000000001000000000000000000000010000000000000000000000100000000000000100000010011100011100100110100110010010001000100110001100100001011000011001110101111110,DLUWECKUQGRLQH-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,3517685B61D45A64_BB314A4A701C33F7_6041_UN,8.133191,00000000000000000000001000000000000000000010000000001000010000100100000010010001101101010011011010101000000101010000001011111100110011110110001011011011010111111111110,VEBVXYVRWCGSPH-IERDGZPVSA-N
FC1=CC(=C(C=C1)CCC#N)NC(C2CNC2)C3=CC=C(C=C3)F,CB571DA08E254290_48A5AC55C22E7115_6041_DP,7.375474,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110011000000001000000100010000001001000100000101110110001011010011010110100111010,WXJLZMZZUBXJRX-UHFFFAOYSA-N
FC1=C(C2=C(C(=C1)F)N=CC=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,A7CAD76031871D45_558C7FAAAE0E9664_6041_UN,8.562542,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,FHWYXSRFHCLFRD-PEBXRYMYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC[C@@H]3CCNC[C@@H]3C=C)Cl,50189CF3556DE5D7_6B0CE57684EF5808_6034_DP,8.071943,00000000000000000000000000000000001010000000000100000000000000000100000000010110011101111011000010111001101100010000001111100100110101110110001011011011010110101111010,WTIRUYARLOPQHE-IRXDYDNUSA-N
C2(=C1C=CC=CC1=C(C=C2)Cl)NCC3N(C)CC4(CC3)CCC4,9A93FD30C7DBE16E_60086BD21344CD2C_7022_UN,8.058609,00000000000100000000000000000000000000000000000000000000000000000010000000010001001001110011010000101101010110011001101001100100110001110110001001011011010110101111010,VSIZXUHAJSYRDM-UHFFFAOYSA-N
C1CC(CCN1)C3=CC2=C(C=CC=C2)[N]3CC4(CCNC4)C,3BE430ADEBC08856_4A3D67C647A1A54C_6034_DP,8.205268,00000000000000000000000000000000000000000000000000000000000000100110000000010000101101100011000010101100110010011001101011100100110100000110001011011011010110101111010,UBDLKALDSKVTNN-UHFFFAOYSA-N
O(C1C2CCC1C3CNCC23)C4=CC(=C(C=C4)C(F)(F)F)C#N,1C66E92F4B38BDB9_3E2563050A383A03_6035_UN,8.8825445,00000000000000000000000000000000000000000110000000000000000000000000000000000000001100100001000010001100011100001100001001000011110000100110001111010011110001100111110,AKODMFWXCCHWMA-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@@]34[C@@H](CCC3)OCC4,A2BF836F0092A466_1DAA5EE1D43AE7E2_6041_UN,7.485842,00000000000000000000000000000000000000100010000000000000010000000110000000000100001100010011000011101100010111001000001011000100110011110110001011010111110111101111110,WPEQGCHOMIVPMG-VQIMIIECSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC[C@@H]3CNC[C@H]3C,1321B88C1F8261DC_97F89110AED67BB4_6041_DP,8.605206,00000000000000000000000000000000000000000010000000000100000000000100000000100000101100110011000010101100010110000001100011000100110101110110011011000111010110101111010,DSZWKXRLVABDKG-OCCSQVGLSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3C2CCC2CN3)F)CC4,0C8205588F23CF2B_0447587BCA7CD7C3_6041_DP,8.296,00000000000100000001000000000000000000000010000000000010000000000000000000010001101101110011010010001000110110010001101011100000110101110110001010011011010110101111010,RTFRCAFDQHCVBX-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC3=NC=C(CC2COCCC2)S3)F,74D2AF70FA89ED75_795A81554D0092BD_7022_UN,8.137624,00000000000000000000000000000000000010000010000100000000010000000100000000100100010101111001010010101000001101000001001011100100110011110110001011011111010111101111110,UROCKFZTSKQYFN-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)N[C@H]3[C@@H](OCC3)C4=CC(=CN=C4)Br,22BEB61CC30D7080_679FD6A8D35FAF16_7022_UN,7.7601266,00000000000000000000001000000000000000000110001000000000010000100110000000000000000100010011000111100000100101011000001011000100000011110100001011010011110011100111110,WZKYPMMHRCIHQH-AEFFLSMTSA-N
O(CC2(CC1CO1)CCOCC2)CCCN3CCN(C)CC3,9B25CD6DC1C12A12_004790EB8F697BB2_6039_UN,7.587845,00000000000000001000001000000000000000000000000000000000010000000010000000010001000001100000010001101000000001011001101011100010110010000110001001111000110101111101110,QUMBFHBRFKYRFL-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CCCC3)C4=C(C=CC=C4)F,5C85B7A1E8F0D5C9_81416C9B3147CE4E_6041_UN,7.862804,00000000000000000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,WIJYBZCGZMSFGE-FQEVSTJZSA-N
CC1=C(C(=CC(=C1)Br)C)NCC2=NC=CN2C[C@H]3[C@@H](CNC3)C4CCOCC4,76368E08E05C6CF1_D628793CB2D535CB_6034_UN,8.212957,00000000000000000000000000000000000000100000001000000000010000100100000000010101101101110011000010101000000111010000001011100100110111110110001011011111010111101111110,YKSQDLWMGUPUGH-ICSRJNTNSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCCC(C)CC3,6387E78CA1895675_CF9FE2071B2A12A4_6041_UN,7.9587016,00000000000000000001000000000000000000000010000000001000000000000100000000010000101100010011011010001100010110000001101011101100110001110100001000011101010110101111010,CZJOWGVYXIBNQT-UHFFFAOYSA-N
OC(CF)C1=CC(=CC=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,90D5EF01C0EC922C_F132C9435778D850_6041_UN,9.086535,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101100001011110101000100011010001101011101100110111110111001001011111110111111111110,AKUDSTSMYSKMGQ-FQECFTEESA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(CC)COC2)F)CC3,6235E73F149983F3_BA1B3E53D67D955E_6041_UN,7.7941785,00000000100100000001000000000000000000000010000000000000010000000010000000010001101001110010010001001000000111011011101011100000110001110110001010011111010111101111110,RDMBWRZFPFVHLR-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CCC23CNC3)F,82F06EC472587A0B_E6688028E045D58A_7022_DP,7.4146647,00000000100100000000000000000000000000000010000000000000000000000010000000100000001001110011010000001000010100001001001001100000110101110110001010011111010110101111010,QFPNCKKVBKJKIJ-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,FE71007DEF75C674_28DF01097CF748AF_6041_UN,8.563645,00000000000000000000001000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,ILMLGDRLIIBEMW-HKUYNNGSSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC23CC(C)(C2)C3)F)CC4,A0E63B42FBA3E884_3AC351ADCF44061C_6041_UN,7.7936535,00000000000100000001000000000000000000000010000000000000000000000010000000010001101001110010010000001000010110011001101011100000110001110110001010011111010110101111010,DXZQHPKNNDCMDW-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC34CC(C)(CC3)CO4,4F93BA80480E5C80_0E9DA6AC2EE6047A_6041_UN,7.5320215,00000000000000000000000000000000000000000010000000000000010000000110000000000000101100010011000110101100010111001001101011000100110011110110001011010111110111101111110,NHAPLIFNFCFUOZ-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)COCC2)[S](C4=CC3=C(C(=C[NH]3)CC)C=C4)(=O)=O,48BEB40BC04A2C58_52B90704BFF4E1CE_6029_UN,8.792905,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100101011001010101110011001001010011011001100111110001110001011111001010111111111110,CWICSJUQJVJKKJ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3OC2(CCC(C)(CC2)C)CC3)F)CC4,331C8E2EE101BBC8_CBD9D75F1A9206B2_6041_UN,7.7283564,00000000000000000001000000000000000000000010000000000000010000000010000000110001101101110011010110001000010110011001101011100000110011110110011011011111110111101111110,QONISKQIOUOARK-UHFFFAOYSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC3=CC2=C(CCCNC2)C=C3,46C67D9001E249E1_90849DDD29181C8D_6041_DP,7.7640066,00000000000000000001100000000010000000000000000000000000000000000000000000100000001000100011010000001100110000011001001001000100110101010110011011011111010110101111010,JWBHSJPWZIMJBI-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCC23CNC3)Cl)C4CC4,F62830A7A1EC5F73_59FFAB60D69DEAFA_7022_DP,8.010494,00000000100100000000001000000000000000000000000000000000000000100010000000000000001000110011000000001001010110001000001001000000110101110110001010010011010110101111010,FMUNMIAWONHNLT-UHFFFAOYSA-N
CC1(CCO1)C2=CC(=CS2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,136DC80E3CF55290_7E8D16CB6517B1A9_6041_UN,7.7352996,00000000100100000000000000000000000010000010000000000000010000100010000000010001010101111000010010101000000101011001101011100100110011110110001011011111110111101111110,BYZXPRDPGMLPLN-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3COC2(CCCCC2)O3)F)CC4,98055C60CD23AD4E_F4EEF9D9E73245DB_6041_UN,6.9461904,00000000000000000001000000000000000000000010000000000000010000000000000010010001101101110010010111001000010111011001101011110000110011110110001011011011110111111111110,DRFUSKKANVLWGB-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCCC2CCCOC2)Cl)C3CC3,2DFF01041FB77FC8_9F17E747AED44986_7022_UN,7.671652,00000000000000000000001000000000000000000000000000000000010000100000000000000000001000110001000000101001100111010000001000000000110011110110000011010011010111101111110,HRRBGKNWMIVSPF-UHFFFAOYSA-N
C(CC1CO1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,FA02EC12EEF33EAD_FBFA7DA61971EAB3_7019_UN,8.263605,00000000000000001000001000000000000000000010000000000000010000000000000000000000000001010000010010010000000111010000101000100000010011110100000010011010110111101111110,UKSCIHJPWZXNMG-UHFFFAOYSA-N
FC1=CC(=CN=C1)C2=C5C(=CC(=C2)C=C[C@@H]3CCCO[C@H]3C4=CC=N[N]4C)OCO5,061AFC304F83C205_ED11C37EB1A57714_7019_UN,8.412833,00000000000000000000000000001000000000000010000000001000010000100100000010010000100100010000011111110100010101000100001011111100100010100110001011111010110011111111110,JNUAEZKQGBCCII-KSFYIVLOSA-N
CC1=C(C=C(C=C1)N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)CC=C,5C7BD81599C0F95B_70BAFCD8BAC73905_6041_DP,8.836914,00000000000000000000000000000000001000000010000000000010000000100000000000000001001000110011000000111000100100010000101001000100110101110110001011010011010110101111010,NEJWDLVWMNREBC-NHCUHLMSSA-N
FC1=C(C2=C(C=C1)C=CN=C2)NC4C[C@H]3CCC[C@H](N3C)C4,B7A5670F67EE6FB8_3298069FFFC65DC3_6041_UN,8.258576,00000000000000000000000000000000000000000010000000000000000000000100000000010000100001010001010000100100110110010000101011100100110001110100001011011011000010101111010,KFBRLZYHSWOFRZ-GOOCMWNKSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=CC=C(C=C2)C3=NN=C4CCCCC[N]34,5FDB22A7E4906BA6_A8064103C3DE0F0A_6041_UN,8.171093,00000000000000000001100000000010000000100000000000001000000000100100000000100101100101100000011010101100010000011000001011101100110001010100011011011111010010101111010,LTBVRXMNODQYAA-UHFFFAOYSA-N
C2(=C1OC=CC1=CC=C2F)NC(C)CC3CCCCN3C,80005A423CEAC623_6446657F3366A70D_7022_UN,7.893971,00000000000000000000000000000000000000000010000000000000010000000000000000010000100101110001010110101100110110010001101011100100110001110100001011011111110110101111110,BPFMDTAOWILSOR-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C=N[N]2C3CCCCO3)NC4=C[N](C[Si](C)(C)C)N=C4,78AAF15D62EBE6E0_381A95AE56A3ECDE_6041_UN,7.7454515,00000000000000000000100000001010000000000000000000001000010000100100000000110001100100100001111110101100010001111001011011101100111011010110011001011101010111101111110,QTFICBRUPZTZBV-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)C#N)F)NCC2CCC(CN2)(C)C,C452B754DBCA59DE_C73C49D850AFB79B_7022_DP,8.347026,00000000000000000000000000000000000000000110000000000010000000000010000000100001001000010011000000101000100100011001101001000000110101110110001011010111010110101111010,WFXOHGVDEURHRL-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(C)CCC4(CC3)CC4,B26DF9F449DC2763_91E8EA8CD38CE539_6041_UN,7.419962,00000000000000000000001000000000000000100000000000000000000000100110000000010100101101100011010010101000010010011001101011100000110001010110001001011111010110101111010,KPGPQMHKQNEFMB-KRWDZBQOSA-N
CC1=C(C2=C([NH]1)C=CC=C2NCC(C3CCNCC3)F)C,D38455D25FCAD677_D23D5A0242F464A7_6041_DP,8.626412,00000000000000000000000000000000000000000010000000000100000000000100000000000000101100100001000010101100110100010000001011000100110101110110001011010111010110101111010,FRWGSOYDMGIWNJ-UHFFFAOYSA-N
CN(C)CC1=C[N](C2=C1C=CC(=C2)F)C[C@@]34CCCN[C@H]3CCCC4,0B30E6F2AF027FF0_478E7D373D7DF85E_6034_DP,7.5825176,00000000000000000000000000000000000000000010000000000000000000000110000000110000101101110011010010101100110100011001001011100100110000100110001001011101010110101111010,QZAIPCYMKKEEDS-LEWJYISDSA-N
CN(CC1CCNCC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,C62DDC62A1CFD7A7_BD0ACFD8C53E1DB5_6041_DP,8.504249,00000000000000000000001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010001001011100100110101110110001011011011010110101111010,MNPGUIRHURZRQT-RHSMWYFYSA-N
FC2=C(C=C1C=CC=CC1=N2)NCC3CCCN(C)C3C4=CC=CS4,4D94E4EBA48718C0_822B6F2FA3F674C6_6041_UN,8.5348835,00000000000000000000000000000000000010000010000000000000000000100100000000010001111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,OWONFZZHDZCAGL-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCCC3CC23)Cl)C4CC4,4DA174630DC26A05_E161A4E7AAE1862D_7022_UN,8.090799,00000000000000000001001000000000000000000000000000000000000000100000000000000000001000010011000000001001010110000000001000000000110001110000000011010011010110101111010,JXFMZLZCLCAGRW-UHFFFAOYSA-N
C2(=CC1=C(C=CC=C1F)S2)NC[C@@H]3CCCN(C)[C@H]3C4=CN=C[N]4C,82B67E8D075D53A8_12AFF7E94158F863_7022_UN,7.8847446,00000000000000000000000000000000000010000010000100000000000000100100000000010101111101111011010010101100010110010001101011100100110001110110001011011111010110101111010,XCQBPILZSDHAQQ-ORAYPTAESA-N
CC(NC(=O)CC1CC2CCC1C2)CC3=C[NH]C4=C3C=C(C(=C4)F)F,AD11D9C41047FDA5_DFE055F4D7572815_6038_UN,8.158094,00000000000000000000000000000000000000000010000000000000000000000100000000000000000100010011100010000100110110110001011001000100110110100100001011010011001110101111110,KOUHAVNGIOIAMC-UHFFFAOYSA-N
C1(=CC(=CC=C1)Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,A507FEA9B4C596EF_F173F3E6FBCBAEFF_7022_UN,7.7833905,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101001000100010000001011101100110001110110001011011011010110101111010,HHPNKHJCNBKXCQ-KUHUBIRLSA-N
CC1=NC(=CC(=N1)N[C@@H]2CCN(C)[C@H]2C3=CC=C(C=C3)F)C4CC4,213692E90BB9A4AB_25C93728511F4BCC_6041_UN,8.413047,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101110011010010101000100110010001101011100100000001110100001001011111010010101111010,SHLVZNMNXWFZNC-APWZRJJASA-N
C1(=CC(=CC=C1)Br)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,E5F5F6ED34FFCED0_88A3005A4998AE2B_7022_UN,7.7833824,00000000000000000000001000000000000000000000001000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,GBSKVVPVKIUCKN-KUHUBIRLSA-N
C1(=CC(=CC=C1)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,C6DEF50B83910020_91191986C37038EF_7022_UN,7.7833805,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,NOLNKVMXPJVLQD-KUHUBIRLSA-N
C(C[C@]12C[C@H]1CCC2)=CC3=C[N](N=C3C)C4=C(C=CC=C4)F,1E0FE0CCF4F15262_C6F178E327CDEFAA_7019_UN,8.406447,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011010000110101111010,IDMPBXILKRVLQG-APWZRJJASA-N
C(C[C@]12C[C@H]1CCC2)=CC3=C[N](N=C3C)C4=C(C=CC=C4)Cl,29F05851B133121D_8B47A23B2511BE93_7019_UN,8.406445,00000000000000000000001000000000000000000000000000001000000000100110000000010000100100010000001010010001010100001000001011101100110001110100001011011010000110101111010,WRZNJGNWCKGNLR-APWZRJJASA-N
O[C@H](CBr)C1=C(C=CC=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,A0CD0E6407ECE6BA_64CC8033F2455BDA_6041_UN,8.719874,00000000000000000000001000000000000000000000001000000100000000100100000000010101101101000011010011101000100000010000001011100100110111110111001011011011110111101111110,OUIVEVRAXILSJO-LPTQZCDUSA-N
CC1=C(C=C(C(=C1)NC2C4=C(C3CCC2C3)C=CC=C4)Cl)C5CC5,3459B09F5CB0C775_8BE99B287EB7113B_7022_UN,7.7627387,00000000000000000001001000000000000000000000000000000000000000100000000000000000000000010011000010000101010110000000001000000100010001110000000011010011000010101111010,CRXSSMDEMJSFQH-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)NCC2C3(CCNC2)CCOCC3)C#N,40137CA6787A6F04_CFA36F474547F006_6041_DP,7.9614806,00000000000000000000000000000000000000000110000000000100010000000010000000000000101000110011000000101000110101011000001011000000110111110110001011010011010111101111110,XHTNFYRIUPOOKK-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)CCC2)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,A1278403AE8D1235_4CEBDEDCE7F92F7A_6041_UN,8.615721,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101100010110010001101011100100110001110110001011011011010110101111010,FQOBGQZERBXCDX-JXFKEZNVSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC[C@H]3[C@H](CCCC3)N4CCOCC4,DDD696F6079A3BF7_8E17DA95F3B90821_6041_UN,7.7637324,00000000000000000000000001000000000000000010000000000000010000100100000000010101101101110011010110101100011111010000001011100100110011110110001011011011010111101111110,ROVGAPFMRMCYRK-HOCLYGCPSA-N
FC2=C1OC=CC1=C(C=C2)NCC3CCCN(C)C3C4=CC=CS4,05DC435E38431F9F_62186FFBEE450773_6041_UN,8.49703,00000000000000000000000000000000000010000010000000000000010000100000000000010000111101111011010011101100010110010001101011100100110001110110001001011011110110101111110,XVXYNDNRYZHUSG-UHFFFAOYSA-N
CC3=NC2=C([C@H]1CCCN[C@H]1CC2)N3CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,6D1DE44587C70554_AB9B7617FF75DB6B_6034_UN,8.186598,00000000000000000000000000000000000000100000000000000000000000000100000000010101101101010011000010101101110110010010101011100100110100100110001011011111010110101111010,RHQVKBSUNUNPMN-WSTRIDTPSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC[C@H]4[C@@H](C4)C5=C(C=CC=C5F)F,AFB42F496E116518_677E08FF3FD426E9_6041_DP,7.972804,00000000000000000001001001000000000000100010000000000000000000100100000000000100101101010011010010101000111100010000101011100100110101110100001011011011010110101111010,DWNPNMMICQANBP-ZOFXXKQRSA-N
O[C@H](CCl)C1=CC(=CC=C1)NCC2N(C)CC3(CC2)CCC3,EB2F63EFAC9B77E6_5D3A7184CF2D3FFB_6041_UN,8.268076,00000000000100000000000000000000000000000000000000000000000000000010000000010001001001100011010000101001110010011001101001100000110111110111001001011011110111101111110,GGFRNZCWBOPJTM-ZYMOGRSISA-N
O[C@H](CF)C1=CC(=CC=C1)NCC2N(C)CC3(CC2)CCC3,99634A61F65AC0C3_1094AD05F8F694AC_6041_UN,8.268089,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001100011010000101000110010011001101001100000110111110111001001011011110111101111110,BAOBMNYBNSOXMP-ZYMOGRSISA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NC[C@H]3[C@@H](C3)C4CCOCC4,2CC28FA5A5366CE1_4949197208B15CFA_6041_UN,8.535079,00000000000000000000001000000000000000000010000000000000010000100100000000000000101000110011000000101100010101000000001011000100110011110110001011010011010111101111110,PTNBLKXGHASBQW-HOTGVXAUSA-N
CC1=C(C=CC(=C1)NC[C@H]2[C@@H](C2)C3=C(C(=CC=C3)Cl)Cl)OC4CCOC4,BE74105DF464BBD0_3102FE6D2440B158_7022_UN,7.9795847,00000000000000000000001000000000000000000000000000000000010000100000000010000000001100110111000010001001000101000100001000000111010011110110000111010011110111111111110,RRKQLKGZIYMZLN-GVVCSIHDSA-N
C[N]1N=C(N=C1NC[C@H]2[C@@H](OCC2)C3=CC=C(C=C3)F)C4CCOCC4,B4A8C80EA5D2CA77_31A24C8B146269F9_6041_UN,7.6398067,00000000000000000000000001000000000000100010000000001000010000100100000000010101101100110011011011101000001111000000001011101100110011110110001011011011110111111111110,BFJMBEIUGGHPFQ-RDJZCZTQSA-N
C[N]1C=C(C2=C1C=CC=N2)NCC(F)C3CCCCC3,0CBD04AB5AD61E9F_FA52952A0036F9CE_6041_UN,7.9323373,00000000000000000000000000000000000000000010000000000000000000000100000000010001101101000001010010101100010100000000001011100100110001110100001001011001010110101111010,HMAJDIMGGMPTNJ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC34OC(C)(C)C(C3)C4,CBA27EA3090999F3_B2B8DEEF82263AE4_6041_UN,7.2960978,00000000000100000000000000000000000000100010000000000000010000000110000000100100001100010010000110101100010110001000100011000100100011110100011011000111110111101111110,HPMJLVPQATVTEF-UHFFFAOYSA-N
C(C1CCNCC1)C2=CN(C=N2)CC(CC)NCC3=C(C=C(C=C3)Cl)Cl,27983BB1F537DC7D_9F0EF6AFFED344B2_6034_UN,8.723695,00000000000000000000000000000000000000000000000000000000000000000100000000010101001101110001000010101001100110010010101011100100110100100110001011011011010110101111010,IRLAKSVWIUKOJB-UHFFFAOYSA-N
CN(CC=CC1CCC2(CN1)CCOCC2)CC3=CC=C(C=C3)F,F31C25977CA922CD_1A3736692F2CCDAC_7019_DP,7.642379,00000000000000000000000000000000000000000010000000000000010000000010000000000000001001110011010000111000110101011001001011100000110010100110001001011001010111101111110,ANJRMIAVBGLODX-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2OCC3(CC2)CCC3)F,2B6055DB244A7EE1_358AE39A38945869_6041_UN,7.3109803,00000000000100000000000000000000000000000010000000000000010000000010000000100000001001110011010100101000010101001001001000100000110011110110001011011111110111101111110,ZFUKRPRNPCGRHE-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CCSC(C)C3,A01BD93CF73BDB40_9A29004F29B90A4D_6041_UN,8.014476,00000000000000000000000000000000000010100000000000000000000000000100000000000100011000001011000000101100010010000001101011000100110001010110011011010111010110101111010,ZOFXEOJHFLQJTP-UHFFFAOYSA-N
OC(CBr)C1=CC=C(C=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,3E0A94105BFAD3F2_B3B96F15C380FF93_6041_UN,8.697481,00000000000000000000001000000000000000000000001000000000000000100100000000010101101101000011010010101000100000010000001011100100110111110111001011011011110111101111110,CMLXUIHYNGZMGK-GSZILNDISA-N
O[C@H](CCl)C1=CC(=CC=C1)NCC2N(C)CC3(CC2)CC3,ACBABC483FE239BD_FAF11B723402368A_6041_UN,8.443735,00000000000000000000001000000000000000000000000000000000000000000010000000010001001001100011010000101001110010011001101001100000110111110111001001011011110111101111110,RVKXRKRACMBIJC-OEMAIJDKSA-N
O[C@H](CF)C1=CC(=CC=C1)NCC2N(C)CC3(CC2)CC3,50FDA8B8E5B41467_B75FC7F303D99DDD_6041_UN,8.443753,00000000000000000000001000000000000000000010000000000000000000000010000000010001001001100011010000101000110010011001101001100000110111110111001001011011110111101111110,INBZLWFAIAHPGZ-OEMAIJDKSA-N
FC1=C(C(=CC=C1)NC3CC2=C(C=N[N]2C)CC3)C4CC4,630E1A3674536F9C_85EE470B9D84D0A7_6041_UN,8.654184,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010011011010000100110110010000101011101100110001110100001011011011000010101111010,ZGRCBFJCZKVVHZ-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=C[NH]2)NCC3CCCN(C)C3C4=CC=CS4,67F83569FDC63D20_54567AF01188194D_6041_UN,8.247367,00000000000000000000000000000000000010000000000000000010000000100100000000010001111101101011010010101100010010010001101011100100110101010110001011011111010110101111010,HQPGDZSMPLAVRQ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC3(C)CC2CC2C3)Cl)C4CC4,6C417A52D7158935_D3D9E734C0083E03_7022_UN,8.515317,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010010000010001001010110001001000000000000110001110000000011010111010110101111010,FGGCTRMWUFYDGH-UHFFFAOYSA-N
CN5CCCN(CC1=C(C=C(C=C1)NCC2C3CC(C2)C4CC34)F)CC5,091B79E3C847E4B8_A260B2436BD16066_6041_UN,8.363832,00000000000000000001001000000000000000000010000000000000000000000000000000010001101001110011010010001000010110010001101011100000110001110110001011011011010110101111010,JVSRHLRFPHAONQ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2[C@H](CN2)C3=CC=CC=C3)Cl)C4CC4,7C6F3742EBD39CD1_CE9DA277DF4DFD03_7022_DP,8.700665,00000000100100000000001000000000000000000000000000000010000000100000000000000001001000010011000000001001100110010000000001000100010101110110001011010011010110101111010,VHKVFYLKBIJAPM-YLJYHZDGSA-N
C1(=CC(=CC=C1)C2(CCOCC2)C#N)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F,EEDE2888333A0949_1CE931D6E51AC7B9_6041_DP,8.12365,00000000000000000000000000000000000000000110000000000010010000100010000000000001001000110011000000101000100101011000001011000100110111110110001011010011010011100111110,UJALGQLPUDXLSR-DENIHFKCSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC(CC)C2CCCCO2)F)CC3,FA1D108229044B1F_B7932B7361D388C2_6041_UN,7.723382,00000000000000000001000000000000000000000010000000000000010000000000000000010001100001110011010100101000100111010011101011100000110011110110001011011111110111101111110,DYMYRFAQIKYCER-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC3CC2(CCNCC2)C3,C8AE34A4ED76FA40_825F7220F69E302C_6041_DP,7.965478,00000000000100000000000000000000000000000110000000000000000000000010000000000000001000110011000000101000110110011000001001000000110101110110001011010011010110101111010,BUVNHKFIAHECIZ-UHFFFAOYSA-N
C1(=CN=C(C=C1)C2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,0744CF73C83BE484_1E1F5492634579F0_6041_UN,8.558735,00000000000000000000000000000000000000000010000000000000010000100100000000010001100101110011010010101000100111010001101011100100110011110110001011011011010011101111110,IEDVEDFWPAFMQT-RTWAWAEBSA-N
O(C1C2CCC1C3CNCC23)C4=CC=C(C=C4)C(=O)CCl,C3A286A716954B23_F1F20752B463C934_6035_UN,8.456624,00000000000000000000000000000000000000000000000000000000000000000000000000000000001100100001000010001101010000000100001001000011110010100110000101010001111101110111110,LWNFWYIZNGXOQZ-UHFFFAOYSA-N
BrC2=C1N(C=CC(C1=CC=C2)=O)CC3(CNCC3)C4CCOCC4,07E561B5FD03A630_275439C12B3AE3F6_6034_UN,8.488629,00000000000000000000000000000000000000000000001000000000010000100110000000010000101101110011000011101100110101011100001011100101110010100110001101011001111111110111110,IIIATHBBPWEYCE-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NCCCC3=NC2=C(CCCN2)C=C3,96C3C3342EF189E3_438CBDC552BA2686_7022_DP,7.4897227,00000000000000000000100000000010000000100000000000000000000000000100000000100100001000100011010000101100110000011000001011000100100101010110011011011101010110101111010,UDDRWCREGUFUAU-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,B5C9FB39F31B79F8_B9F93F691CC6BCA0_6041_UN,7.7140183,00000000000000000000000000000000000000000010000000000000010000100000000010010000101101110001010110101000000111010001101011110100110011110110001011111011110111111111110,FLQBEXNOEUZWDJ-PMACEKPBSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC2=C([N](N=C2C)CC3=C(C=CC=C3)Cl)C)C4,CF16487809ACFB8D_A5501024066583CA_7019_DP,8.883336,00000000000000000000000000000000000000000000000000001000000000000100000000010000100100010010001010011001110110010000101011101100110000100100001011011111010110101111010,RRGIIAOKQPQUAO-MDYRTPRTSA-N
CN(C)CC1=C(C=C(C=C1)NCC2C3(CCNC2)CCC3)F,6352EFAB95B0AF36_6ADC2A5FADF43A30_7022_DP,7.661455,00000000000100000000000000000000000000000010000000000100000000000010000000100000101001110011010000101000110100011001001001100000110101110110001011011111010110101111010,NBQQYLJFSAGGRQ-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NC3(COC3)C4=C(C=CC=C4)F,6B8151854226132D_039C56BEE212B9C3_6041_UN,8.024532,00000000100100000000000000000000000000100010000000000000010000100110000000010100100101110001010110101000100111011001101011100100010001110110001011011011010011101111110,CEUCFJXACOTSEG-KRWDZBQOSA-N
C(CCC1CO1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,D6B285AEB4D330EE_4E19E5F521419D3E_7019_UN,8.141943,00000000000000001000001000000000000000000010000000000000010000000000000000000000000001010000010010010000000111010000101000100000110011110100000010011010110111101111110,SKZQCYOJGYFQLP-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CC3=C(C(=CC=C3)Br)F,9CAAA98E58B7CAA9_69481E49B5A1D806_6038_UN,7.4232974,00000000000000000000000000000000000000000010001000000000000000000000000000000000001000010011100010001000110100110000011000000000110010100000000011010011011110100111110,SNOFNVGQPBQERD-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CC3=C(C(=CC=C3)F)F,3AEA2DFE3591150F_828B8BF5B78F97F6_6038_UN,7.423293,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001000110100110000011000000000110010100000000011010011011110100111110,QVODLDHBYOGBPG-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CC3=C(C(=CC=C3)Cl)F,150FB90545A6C97C_5BAE9020FC069DE7_6038_UN,7.423291,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001001110100110000011000000000110010100000000011010011011110100111110,AQNJMZDZIMHGKH-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCNCCC2)F)CC3,2C78204192D01536_FBFA4C27B145DA45_6041_DP,7.921296,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010000001000100110010001101011100000110101110110001010011011010110101111010,DEGTWMBYVKBYMM-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CC3(CC2=CC=CC=C2)CCNC3)C(=CC(=C4)F)F)C5,0AB227066CE9BB63_F358A44D43039F32_6034_UN,8.328385,00000000000000000000000000000000000000000010000000000000000000000110000000110000101101110011000010001100110100011001101011100100110000100110001011011101010110101111010,GTKWDWHYRCPMDG-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CC3=C(C(=CC=C3)Cl)Cl,1847A8E1E0C1B038_953AE333872B3A0A_6038_UN,7.4231377,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010011100010001001110100110000011000000000110010100000000011010011011110100111110,NZDNAIAMHFNDBY-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,0F37C0F84A60EF87_500A0ACE3986530A_6041_UN,8.241039,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,MLRNDSGWXVWNEB-ZHRRBRCNSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3OCC2(CCNC2)C3)F)CC4,D30FAB1C1B680DD7_AEA629170F665C33_6041_DP,7.283914,00000000000000000001000000000000000000000010000000000000010000000010000000010001101101110011010111001000110111011001101011100000110111110110001010011011110111101111110,KRGGBXGZUHKLKG-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3CCNC3CC)Cl,4F289709725F11F0_8293396BE65F4355_6034_UN,8.234511,00000000000000000000000000000000000010000000000100000000000000000100000000010110111101011011000010001001101110010010001111100100110101110110001010011111010110101111010,XPDMARVZZKLBPG-UHFFFAOYSA-N
CC2=C1N(C=CC1=C(C=C2)F)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,CE872C11B75ABF85_77AB7B4608327A51_6034_UN,8.558568,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101100010110010000001011100100110001100110001011011110010110101111010,UODSGCLKRWRSHD-ZHRRBRCNSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NCC4=C(C)OC(=N4)C5=CC=C(C=C5)F,B67494295515EA40_D84DE5B67053C2C5_6041_DP,8.061658,00000000000000000000000000000000000000100010000000000000010000100100000000000101101100010011100111101000110100110000111011000100010101110100001011010011110110101111110,WMDBSMYPCCSOFC-GMBSWORKSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC4CCCN(C3=CC=N[N]3C)C4,52F6DEBC4D9A2D9A_E2DC8A4183F67C8D_6041_UN,7.93509,00000000000000000000000000000000000000100010000000001000010000100100000010010101100101110011011010101000100111010000001011111100110011110110001011011011010011111111110,JJCCSUPNMWWWQT-UHFFFAOYSA-N
N(C1C4C2CC5C3CC(C1C23)C45)C(C7=C(CC)N=C6C=C(C=CC6=C7)F)=O,335C9C794649339B_4F0F195CBBE20412_6038_UN,8.576931,00000000000000000001000000000000000000000010000000000000000000000100000000000000100000010001100011100100010100110010010001000100110001100100001011000011001110101111110,HZBJUADAKRBZRC-UHFFFAOYSA-N
CCC5CCC1=C(C4=C(N1CC3(CC2=CC=C(C=C2)F)CC3)C=CC(=C4)C)C5,C8FA1C55C9986C27_C8CF5EB90E7BC52C_6034_UN,7.999295,00000000000000000000001000000000000000000010000000000000000000000110000000010000000101010000000010001100010110011010101001100100110000100100000011011100010110101111010,UHDVFUJHTJUNSE-UHFFFAOYSA-N
CN1CCN(CC1)C2=NC(=CS2)C3=CC=C(C=C3)N[C@@H]4C6=C(OC5(C4)CCCC5)C=CC(=C6)F,A87412137B6A4A8A_BD9A189E2C27C354_6041_UN,7.8869843,00000000000000000000000000000000000010000010000100000000010000100110000000010101010101111001010011101100111100011101101011100100110011110110001011011001110011101111110,IEAAHFJIFLDELJ-QHCPKHFHSA-N
CCC5CCC1=C(C4=C(N1CC3(CC2=CC=C(C=C2)Cl)CC3)C=CC(=C4)C)C5,4E112F5C475D5055_3BA182D87FEB37A7_6034_UN,7.9992867,00000000000000000000001000000000000000000000000000000000000000000110000000010000000101010000000010001101010110011010101001100100110000100100000011011100010110101111010,COBHUEHOPVKKRS-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C=CCCCC2)Cl)C3CC3,B53B4E7DBA121F08_5B514BB35C9A32C5_7022_UN,7.9620137,00000000000000000001001000000000000000000000000000000000000000100000000000000000001000010011000000011001000110000000001000000000110001110000000010010011010110101111010,LKZNCQSQVPETMK-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(CC)COC3)C4CCNCC4,67F31DFB24D49653_B9A18677D4703443_6034_UN,8.874852,00000000100100000000000000000000000000000010000000000000010000100110000000010000001101110001000011101100110101011010101011100100110000100110001001011001010111101111110,PGMMAIRXHDIUCO-UHFFFAOYSA-N
C1(=CC(=NC=C1)Cl)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,102CD19E18617668_F15B2EFC32FC1018_7022_UN,7.9889126,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,DVTSOTBEJOSXHR-ACJLOTCBSA-N
C(C2CCC1(CC1)C2)=CC3=C([N](N=C3C)CC4=C(C=CC=C4Cl)Cl)C,BF0F2D32171805FC_35F959F139B03201_7019_UN,8.42351,00000000000000000000001000000000000000000000000000001000000000000110000000010000100100010000001010011001010110011000101011101100110000100100001010011110010110101111010,NUQPFKHWJYYTRI-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NCCC2C(C)(CCCO2)C,420FD73506EAC738_7D8CEE7C7457C3B5_7022_UN,8.234809,00000000000000000000000000000000000000000010010000000000010000000010000000100000001000010000000001111000100111011001101000000000110010100110000001010111110101101111110,XPFXONSJLAOIKZ-UHFFFAOYSA-N
FC2=C(C=C1C=COC1=C2)NC4C[C@H]3CCC[C@H](N3C)C4,365CCB10C5337B0B_2870EC6C4BF80482_6041_UN,8.323924,00000000000000000000000000000000000000000010000000000000010000000000000000010000100101010001010010100100110110010000101011100100110001110100001011011011100010101111110,LUDNZMKXSOANJU-AGUYFDCRSA-N
FC2=C1C=CC=NC1=C(C=C2)NCC3CCCN(C)C3C4=CC=CS4,B2803EA0EA27EDA7_25EA84425EE96C9E_6041_UN,8.560935,00000000000000000000000000000000000010000010000000000000000000100100000000010001111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,DUFVUCOPNSTDDW-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3CCCC(CC)C3,2D88F7D1011A7684_FDE8C63FBF4CBC21_6041_UN,8.238519,00000000000000000000000000000000000000000010000000000000000000000100000000000001001000010011000000101100010110000010101001000100110001110100001011010111010110101111010,WIBZUTZXOKQCQV-UHFFFAOYSA-N
CC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]4[C@@H](CNC4)C5=CC(=CC=C5)F,25BD821330EA4D78_32E029CD94D5D911_6034_UN,7.99732,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010001000100100010000001011100100110100100110001011011011010110101111010,OYGYTYMVCCKCJQ-XWQVQCDNSA-N
N2CCC(OC1=CC(=C(C=C1F)C#N)F)CC2C3=CC=C(C=C3)F,59EDFF88B8C309A0_1F7E842A6C4B8C76_6003_DP,8.044134,00000000000000000000000000000000000000000110000000000000000000100000000000000000001000010001000001101000100100010100001001000111110010100100001111010011110011100111110,VAQOGODVDXISML-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NC4CCOC(C3=CN=C[N]3C)C4,20F26808A04E429E_7015FFA4E4B89FD7_6041_UN,7.1888285,00000000000000000000000000000000000000000010000000000000010000100100000000010101000101010011010111100100110111010000001011100100110011110100001011011011110011101111110,TZUNIUIUEPJYHU-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=C[NH]2)NCC4(C)CCOC3(CCC3)C4,362C09F623C47EFD_878BC53C210413E1_6041_UN,7.48982,00000000000100000000000000000000000000000000000000000010010000000110000000000001001100000011000010101100010011001001101011000100110111010110001011010111110111101111110,WCWMMAFKQVJZOX-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NC4CC(C3=NC=C[N]3C)OCC4,878ACC985D6F2AA0_55CC100A33071271_6041_UN,8.29202,00000000000000000000000000000000000000100010000000000000010000100100000000010101100101010010010111100100110111010000001011100100110011110100001011011111110011101111110,PAOKGCOLKCROKN-UHFFFAOYSA-N
CC1=NC(=NC(=C1)N[C@@H]2CCN(C)[C@H]2C3=CC=C(C=C3)F)C4CC4,DBDFC3903318E5B1_60FB1ED70F641C0F_6041_UN,8.41236,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101110011010010101000100110010001101011100100000001110100001001011111010010101111010,KDMZMYCCTCCKOR-AEFFLSMTSA-N
CC1=C(C=C(C(=C1)NC[C@H]2[C@@H](C2)C3CCOCC3)Cl)C4CC4,1DC2FA7500742033_ABA35B36B654DE98_7022_UN,7.7554693,00000000000000000000001000000000000000000000000000000000010000100000000000000000001000110011000000101001000111000000001000000000110011110110000011010011010111101111110,HMUICOUMYFYDIJ-RDJZCZTQSA-N
C[Si](C)(C)C1=CC=C(C=C1)C=CCCCC3=NC2=C(CCCN2)C=C3,E7546CEDC778F3B6_3F2F79A24AE441F9_7019_DP,7.708944,00000000000000000000100000000010000000100000000000000000000000000100000000100100001000100011010000111100110000011000001011000100100000010100011011011101010110101111010,QDAQHQHMSAHOQN-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCCCC3)C4=CC=CS4,E0B7CF61EFE40B73_A7B46A13662C496E_6041_UN,7.6329913,00000000000000000000000000000000000010000010000000001000000000100110000000010000111100011011011010001100010100001000001011101100110001110100001001011001010110101111010,ZTWHAVHNGQTYPY-UHFFFAOYSA-N
C1(=CSC=C1C(F)F)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,3DC64CC30984A4EF_7CEDED9F09D468D9_7022_DP,8.527594,00000000000000000000000000000000000010000010000000000100000000100100000000010101101101101011010010001000000110000000000011100100110101110110001010001011010110101110010,SWYMZDISMMYCBW-VHSXEESVSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NC3=CN=C([Si](C)(C)C)C=C3)C4,C5A6818DA6B40F6B_9534ADD135DEB457_6041_UN,7.876951,00000000000000000000100000000010000000000000000000000000000000000100000000110001100101100011010010101100110000011001101011100100110101010110011011011101010010101111010,ACJJVUGOMGILKC-UHFFFAOYSA-N
C2(=C1OC=CC1=CC=C2F)NC[C@@H]3CCCN(C)[C@H]3C4=CN=C[N]4C,69341B9B6FFD7EBF_72B753FAEE5CC597_7022_UN,8.139699,00000000000000000000000000000000000000000010000000000000010000100100000000010101101101110011010110101100010110010001101011100100110001110110001011011111110110101111110,ASYCXWIYAFJWJV-KBXCAEBGSA-N
N1CC5(C1)CCCN(CC2=NN=C(C=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F)C5,36F747EC7C548F51_79C4E25224B771E0_6041_DP,8.1876,00000000100100000000000000000000000000100010000000001000000000100110000000010101101101110011011010101000110110011001101011101100110101110110001001011011010110101111010,YWGDEYLEDKXYOS-IRLDBZIGSA-N
C(C[C@]12C[C@H]1CCC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,9168A5B94C87466C_DA9E757A58D29D99_7019_UN,8.020363,00000000000000000000001000000000000000000010000000000000000000000010000000000000000001010000010010010000010110011000101000100000110001110000000011011010000110101111010,KROSQOBQHFPYRP-UTKZUKDTSA-N
N1CCCC2=C1C=C(C(=C2)N[C@H]4[C@H](C3=NC=C[N]3C)OCC4)F,8120DDDA8AE6761E_E094E3F5B09047FC_6041_DP,7.6002765,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101010011010111101100110101010000001011100100100111110110001011011011110011101111110,GJFDXDFUFWOCKS-CZUORRHYSA-N
C[N]1N=C(C=C1NCC2(CCCC2)C3=C(C=CC=C3)F)C4CCCC4,98683FE5A096322A_7D6DD7F1C7517F38_6041_UN,7.9639173,00000000000000000000000000000000000000100010000000001000000000100110000000010101101100010011011010001000000110001000001011101100110001110100001010011011010110101111010,JQSVRYVZIZXWJJ-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3C4CCC(CC3)O4,443B9E1381395C53_464C0146A087FA56_6041_UN,8.375429,00000000000000000001000000000000000000000010000000001000010000000100000000010000100100010011011110100100110100010000001011101100110011110100001001011001100011101111110,AOGNJUSYWMUFQM-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)NC[C@@H]2CNCC(O2)(C)C)C#N,D5AD3B1669E9274C_DD148FAB94E6477C_6041_DP,7.9713364,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110011011000111110111101111110,ZSRQFVKHXMFBDG-LBPRGKRZSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3C5CCC(C3C4=CC=CC=C4)C5,1E2B3FE45869971D_4799A45778B121AA_6041_UN,8.431706,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010011011010000100010100000000001011101100010001110100001001011011000010101111010,AZCLHKGCVYCYKR-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)C#N)F)NCC(C2CCCN2)(C)C,A926CDB174485D5D_D384E7ED700E2789_7022_DP,8.549078,00000000000000000000000000000000000000000110000000000100000000000010000000100000101100010011000010001000100110011001101001000000110101110110001010010111010110101111010,RSZJWRDBIKWJQH-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(=O)C3=C[NH]C4=C3C(=CC=C4)F,5B19BD2628140B49_E2BA970F89104282_6038_UN,7.7999887,00000000000000000000000000000000000000000010000000000100010000000100000000000000101100010001100011001100110100110000011011000100110110100100001001010001111111110111110,BCJNPCIPFBKADO-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)N[C@@H]3C5=C(OC4(C3)CCCC4)C=CC(=C5)F,F02C515036068D1D_E14E84EA082C9744_6041_UN,7.8064437,00000000000000000000000000000000000000100010000000001000010000100110000000010101100101010001011011100100110100011100001011101100110011110100001011011111100011101111110,SQAPFTDSAYXFRE-FQEVSTJZSA-N
CCC4CCC1=C(C3=C(N1CCC2CNCCC2)C=CC(=C3)C)C4,DB868B9057A68071_AEED2CC90A8991CE_6034_UN,8.80224,00000000000000000000000000000000000000000000000000000000000000000100000000010000001101100011000010101100110010010010101011100100110000000110001011011101010110101111010,ITGWCOKQKGIVIW-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)N[C@H]4C6=C(OC5(C4)CCCC5)C=CC(=C6)F,859BA4311C8B4E13_BAF3A774663AEC31_6041_DP,8.57277,00000000000000000000001000000000000000100010000000000000010000000110000000000101101101110001010011101100110110011100001011100100110111110110001011011001110011101111110,JABGNEYVGOIVAC-XVSHDKDLSA-N
FC1=C(C=CC2=C1CCC2)NC[C@H]4[C@H](C3=NC=C[N]3C)OCCC4,ACEB12310A644F5A_AA588D08C1BAFB0A_6041_UN,7.355427,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101010011010111101100010101000000001011100100110011110110001011011011110111101111110,HASCMGDCRWAGDE-KBXCAEBGSA-N
CC1=C(C=C(C(=C1)NCC2C(N(C)CC2)C3=CC=CC=C3)Cl)C4CC4,12B022809FD64587_AB87C5C65E9C7765_7022_UN,8.0715475,00000000000000000000001000000000000000000000000000000000000000100000000000010000101101110011010010001001000110010001101001100100110001110110001011011111010110101111010,LZBOAQKDLLNJLY-UHFFFAOYSA-N
FC1=CC2=C(C=C1)OC=C2NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,FE24266B9727BDE0_12CBB92747BF97C2_6041_UN,8.619287,00000000000000000000001000000000000000000010000000001000010000100100000000010001101101010011011111101100010100010000001011101100110001110110001011011011110110101111110,LPVBULRHWYZVCN-SZNDQCEHSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC4C(C)(C4)C5=CC=C(C=C5)F,C903EACA2CFCF6D9_FD41807112D6B77E_6041_DP,7.3063245,00000000000000000000001000000000000000100010000000000000000000100110000000000101100100010011000010100000110100011001101011000100010101110100001001010011000010101111010,PADIMWWGDKEDQM-DACZGVNWSA-N
C(C1CC2CC1C3CC23)=CC4=C([N](N=C4C)CC5=CC=C(C=C5)Cl)C,187DB3A1FBDBA00B_24EF717CD5260603_7019_UN,8.651939,00000000000000000001001000000000000000000000000000001000000000000100000000010000100100010000001010011001010110010000100011101100110000100100001011001110010110101111010,ADLHAZJMOXXDBE-UHFFFAOYSA-N
C(C2CCCC1(CC1)C2)=CC3=C([N](N=C3C)CC4=C(C=CC=C4Cl)Cl)C,726E2ED052BB6214_6E85A5324BD520D8_7019_UN,8.396604,00000000000000000000001000000000000000000000000000001000000000000110000000010000100100010000001010011001010110011000101011101100110000100100001011011110010110101111010,KRPADSMBFGNSJY-UHFFFAOYSA-N
N3CCCC(CC=CC1=C(Cl)[N](C(=N1)N(C)C)C2=CC=C(C=C2)F)CC3,BFA3D1F0CABBF600_80C89C258D5BB3CF_7019_DP,7.6856403,00000000000000000001000001000000000000000010000000000000000000100100000000110101001101110011010010011001101100010000001011100100110001110110001010011111010110101111010,JVBXDPDFSDJELK-UHFFFAOYSA-N
CO[C@@H]1C[C@H](NC1)C2=NC=CN2CCC(C)C3=CC4=C(C=C3)CCCC4,24CF06C71C73AD39_D0B8E37FC01F9548_6034_UN,8.687315,00000000000000000000000000000000000000100000000000000000000000100100000000010101001101000011010111001100110000010001101011100111110010000110001111011111110111101111110,LGSAZQKCTMLLKE-XHEPWMPHSA-N
FC1=C(C(=CC=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)C4CC4,9146425FAB54168F_57DABADE1AF865E5_6041_DP,8.707455,00000000000000000000001000000000000000000010000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010011011010110101111010,LAGLFDXRVYDSRF-UONOGXRCSA-N
C(C12CCC(CC1)CC2)=CC3=C[N](C)N=C3C4=C(C=CC(=C4)F)F,F7C680FC7481842B_712DBA89E8504CFB_7019_UN,8.223757,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001011011010000010101111010,LPWFTDDROWPZBG-UHFFFAOYSA-N
N2C[C@H]1CN(C[C@H]1C2)C3=NC(=CN=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,C4E4EE78AE009F9E_FD8E8CDFF71354F3_6041_DP,8.679904,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101100110110010001101011100100110101110110001001011011010010101111010,VCSQOJRQJINHHT-AWQBJMPUSA-N
N(C1=CC2=C(C=C1)COCC2)[S](C4=C3[NH]C=CC3=CC=C4)(=O)=O,AC88C34282BBF909_DE787B42CB45E5AF_6029_UN,8.985578,00000000000000000000000000000000110000000000000000010101011111001101010001000000110100101001001011100110011001001000011011001100111111011110001011111001010011110111110,VDQWBAWRTVLTAG-UHFFFAOYSA-N
C(C1(CCC1)C2CCCCO2)=CC5=CC3=C([N](N=C3C)C4=CC=CC=C4)N=C5Cl,A2D53607E0869898_D5CC75E0E5795240_7019_UN,8.338464,00000000000100000000000000000000000000100000000000001000010000100110000000010101100100010000001010110101010101001000001011101100110011110100001011011010110011101111110,OYSAHRSMUAGNPN-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NCC2CCN(C)C2C3=CC=CS3)C4OCCO4,3C85EA3739AA2468_D57EBDA4CEE8C7E8_6041_UN,7.992628,00000000000000000000000000000000000010000010000000000000010000100000000010010000111101111011010010001000000111010001101011110100110011110110001010011011010111111111110,XHGSQHNDVVMCKF-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)OCCC2)[S](C3=CC=CC4=C3[N](C)C=C4)(=O)=O,1020FFEF45AED7BE_69A21DD4EE477B7B_6028_UN,8.729531,00000000000000000000000000000000110000000000000000010001011111001101010001010000110101001001011011100110011001001100011011101100101011011100001011111001110011111111110,NEZGSFVFKDLZCS-UHFFFAOYSA-N
CCC1=C(C(=CC=C1)F)NCC2CC3(C2)C4CCC(C3)C4,031142764CB0F9DF_F92AC1CAB4EA3ECE_6041_UN,7.8653326,00000000000100000000000000000000000000000010000000000000000000000010000000000000001000010010000010001000010100001010001000000000110001110000000011010011010110101111010,JGKITSNVBUGKKL-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3CNCCC3)C[C@H]4[C@@H](CCNC4)C5=CC=C(C=C5)F,DA4720FC36941087_9393B0B38DC419CC_6034_UN,8.095591,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101100110100010000001011100100110100100110001011011011010110101111010,DFLRHEGCFODSJZ-BXBRYHBFSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3CCN(C)C3C4=CC=CS4,E9036AECA87EB2DF_0A7EC4809E281FA9_6041_UN,8.262871,00000000000000000000000000000000000010000010000000000000000000100100000000010001111101111011010010101100010110010001101011100100110001110110001011011111010110101111010,JYJBKTGIERSCGA-UHFFFAOYSA-N
CC4=NC1=C(C=C(C(=C1)NC3C[C@H]2CCC[C@H](N2C)C3)F)[NH]4,12059D93BA4780A9_D1679E28C424B4BB_6041_UN,8.029949,00000000000000000000000000000000000000100010000000000000000000000100000000010101100101010001010010100100110110010000101011100100110101110100001011011111000010101111010,KRTUYRNULCHGJN-YHWZYXNKSA-N
CC1=C(C=CC(=C1F)C#N)N[C@@H]2CNC[C@@H]2CC3=CC=CC=C3,0D1E966C00208EB5_0BC4D740F2BABC2E_6041_DP,7.418021,00000000000000000000000000000000000000000110000000000110000000000000000000000001101100110011000010001000100100010000000001000100110101110110001011000011010110101111010,XEBNURDKVTXDNM-FUHWJXTLSA-N
O=[N](=O)C2=C1C=CN=C(C1=CC=C2)NCC3C4=C(CC3)C=C(C=C4)F,18D723F4186EF8F0_476556875A9B0AC6_6041_UN,8.6153,00000000000000000000000010000000000000100010000001000000100000010100001100000100001000010011001010101110010100000000001101101100111001110100001011011001010110110111110,BZGLHPCTEHFRAS-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CCC3)C4=C(C=CC=C4)F,DCCA284BC8DDFDAB_41C51934DA0B7A08_6041_UN,7.8309846,00000000000100000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,JAXQKMJENOKRDK-IBGZPJMESA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CC3(NCC2)CC3,716DF2A987B29D0E_D1C9476F29397E69_6041_DP,7.721779,00000000000000000000101000000010000000000000000000000000000000000110000000100001001000100011010000101000110000011000001011000000110101010110011011011111010110101111010,SRCVMABNZWCBDE-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC23COC(C)(CC2)C3)F)CC4,AD3439A0B384F987_3FFBD5343E929769_6041_UN,7.022427,00000000000000000001000000000000000000000010000000000000010000000010000000010001100101110011010111101000110111011001101011100000110011110110001011011111110111101111110,WXCAYLIKQLPBGW-UHFFFAOYSA-N
C(C2C1CC3CC(C1)CC2C3)=CC5=CC=C(C4=C(C)C=C(C=C4)F)O5,7BED553DEF98E29D_8032F33BC8E815D0_7019_UN,8.613001,00000000000000000000000000000000000000000010000000000000010000100000000000000000000100010000000010010100010100000000000000000100100000100100000011000010100000001011110,YXTHPYQFPBMEBJ-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,70FC0566C80AEEE8_ECD9F1346AA16CAD_6041_DP,7.595654,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010101111010,CCMPBLPOQKLHLD-SJLPKXTDSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NCC3(CCCO3)C4CC4)C,C8BC2459ED975AE7_8E41EBD2FC282118_6041_UN,7.959648,00000000000000000000001000000000000000000000000000000100010000100110000000000000101100000011000110001100010001001000001011000100110111010110001010010111110111101111110,GSYPCWWWTVKZPI-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(=O)C[N]3C=CC4=C3C=C(C=C4)F,FFD862503B413BE6_A10D361766E42CDD_6038_UN,7.955611,00000000000000000000000000000000000000000010000000000000010000000100000000010001001101010001100110001100110100110000011011100100110010100110001001011001111111110111110,DWQHLCVWFKIRMS-UHFFFAOYSA-N
FC2=CC(=C1OCCC1=C2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,C9641E4A873ECEDF_0D97F03264A8183A_6041_UN,7.969058,00000000000000000000000000000000000000000010000000000000010000100000000000010000101101110001010110101100010111010101101011100100110011110110001011011011110111111111110,FCXFZSBMSAFKTG-OALUTQOASA-N
FC1=CC2=C(C=C1)C=CN=C2NC3CCN(C)C34CCCNC4,11CA0DB5648FFC16_F5912C7316AAD0B5_6041_DP,8.686257,00000000000000000000000000000000000000100010000000000100000000000110000000010101101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,IMACGHUBBUBRGW-UHFFFAOYSA-N
C1(=CC2=C(C=C1)CCC2)NC3=C[N](C[Si](C)(C)C)N=C3,A56411A472857F65_FE5F989DEA6F684B_7022_UN,7.610319,00000000000000000000100000001010000000000000000000001000000000000100000000110001100100100001011010001100010000011001001011101100010001010100011010011101010110101111010,ZQHWYXGDHVUKBH-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NC3CCN(C)C34CCCNC4,0DBEEA7C196619FF_DE3B13DB92C5BA06_7022_DP,8.274411,00000000000000000000000000000000000000000010000000001100000000000110000000010001101101110011011010101000110110011001101011101100110101110110001011011011010110101111010,FPFQJFBTCVLWNO-UHFFFAOYSA-N
FC2=C1C=CN=C(C1=CC=C2)NC3CCN(C)C34CCCNC4,6C91E6F5F58CC570_8932B176FEDDFEC6_6041_DP,8.54487,00000000000000000000000000000000000000100010000000000100000000000110000000010101101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,HVWFCDVEXHRKDO-UHFFFAOYSA-N
C(C1(CCC1)C2CCCCO2)=CC3=C[N](C)C4=C3C=C(C=C4)F,A23275E56221F76C_992DB0FFB8CE5D0F_7019_UN,8.32585,00000000000100000000000000000000000000000010000000000000010000100110000000010000000101010000010010110100010101001000001011100100110010100100000001011000110011101111110,KTQBMHRRFOQQBM-UHFFFAOYSA-N
FC2=C(C=C1C=C[NH]C1=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,2837200F655E15FF_20CEEE4DAAFA7D1F_6041_UN,8.382364,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110101110110001011011011010110101111010,ZTRZHEMLESKZKQ-VFNWGFHPSA-N
FC1=CC4=C(C(=C1)NCC3CC2(CCN2C)C3)OC=C4,993A86BEA0692F31_6F90605E9E6C23F1_6041_UN,8.017178,00000000100100000000000000000000000000000010000000000000010000000010000000010000001101110010010110001100010100011001101011100100110001110110001000011001110110101111110,HIEPSVYKDCOGNM-UHFFFAOYSA-N
C1(=CC2=C(C=C1)OC(C2)C3OCCO3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,6FF96E5731BB5422_1F088192F2967F8D_6041_UN,8.741777,00000000000000000000000000000000000000000010000000000000010000100000000010010001100101110011010010001100110111010101101011110100100011110110001011111011110011111111110,KRWWTUFVQBRWRQ-IZWFHCBGSA-N
FC1=C(C(=CC=C1)C2CC2)NCC3=C(C=N[N]3C)C4CCC4,EEF02740B1B1C591_D985A8B8FE040C18_6041_UN,8.2270975,00000000000100000000001000000000000000000010000000001000000000100100000000010001101100010001011010001000000100010000101011101100100001110100001010011011010110101111010,KXIVZOSGTZZBNV-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NC2CCN(C)C23CCCNC3,94BBF43D07DD5173_6C804E847BDF2B06_7022_DP,7.866846,00000000000000000000000000000000000000000000000000000100000000000010000000010001101101110011010010101001110110011001101011100000110101110110001011011111010010101111010,DXGKUVQPRLNXCI-UHFFFAOYSA-N
CC1=C(C=CC=C1Br)NC2CCN(C)C23CCCNC3,C361A6ADFB4AE9CB_B0831C98D291BF34_7022_DP,7.8668346,00000000000000000000000000000000000000000000001000000100000000000010000000010001101101110011010010101000110110011001101011100000110101110110001011011111010010101111010,ZIZKGIXPMWZCMH-UHFFFAOYSA-N
CC1=C(C=CC=C1F)NC2CCN(C)C23CCCNC3,762FB10472EA442F_82A199B6270E4F1E_6041_DP,7.86683,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101110011010010101000110110011001101011100000110101110110001011011111010010101111010,KMBQCBRDCADBBF-UHFFFAOYSA-N
C1(=CC2=C(C=C1)COCC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,136F7A045B624D46_718A2838BD656294_6041_UN,7.9600525,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011010010101100110111010001101011100100110011110110001011011011010011101111110,BHFLYRFDXYJDGZ-UXHICEINSA-N
N1CCC5(CC1)CCC2=C(C=CC(=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F)O5,920E727D3080353E_4FF775C619E68520_6041_DP,7.765604,00000000000000000000000000000000000000000010000000000000010000100010000000010001101101110011010011101100110110011101101011100100110111110110001011011011110011101111110,UGWAXUROZYQHII-GGAORHGYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC34CC(OC3)CCC4,EF73FC86E6B73D85_D65F97DB4C62A1AE_6041_UN,7.911079,00000000000000000001000000000000000000000010000000001000010000000110000000010000101100010011011011001100010101001000001011101100110011110110001001011001110111101111110,UYHHLZYVNHKANO-UHFFFAOYSA-N
CC4=CC1=C(C=C(C=C1C)NCC2CCNC3(C2)CCC3)[NH]4,62424FE2C727343D_D4E3E808AF3FA66D_6041_DP,7.7452064,00000000000100000000000000000000000000000000000000000100000000000110000000000000101100000011000010101100110000011000001011000100110101010110001001010101010110101111010,WGTDFXLHAPGMTD-UHFFFAOYSA-N
N1CCC2(CC1)NCCC3=C2[N](C=N3)CC5=CC(=C(N4CCN(C)CC4)C=C5)F,A077A3F6D14608B5_1D10E15A41C35CFA_6034_DP,7.794424,00000000000000000000000000000000000000000010000000000100000000100110000000010101101101110011010010101100110100011001101011100100110101110110001011011011010110101111010,GWVNPHWLYYFZTR-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC3(C)C(OCC3)C4CC4,89F36947F6F73D98_0A7B3380381DCF47_7022_UN,8.641616,00000000000000000000001000000000000000000010000000001000010000100110000000010000101100010011001011001000000111011001101011101100110011110110001010011011110111101111110,OVTQJKCSKXQIDM-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CCC3)C4=C(C=CC=C4)F,C83F3D819FDFDF81_8E966AD889183CB6_6041_UN,7.5313063,00000000000100000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100110001110100001010011011010110101111010,LZBIMUFWSYCJHH-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C(C4=C(C3=CC=CC(=C3[NH]4)CC)F)=O,4A94D85E6C822D80_61219352452D31E2_6038_UN,8.3058195,00000000000000000001000000000000000000000010000000000010010000000100000000010001001101110011100110101100110100110010011011100100110110100110001011011011111111111111110,YCTUUXZFANEGHZ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC23CCCNC2C3)Cl)C4CC4,FD57605B5BFEB355_16EA03548D548DEC_7022_DP,7.967061,00000000000000000001001000000000000000000000000000000100000000100010000000000000101000010011000000101001110110011000001001000000110101110110001011010011010110101111010,GTRKSFZJGSXNKD-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)C=C[C@@H]2CCO[C@H]2C3=NC=C[N]3C)OCOC4,0F074A28282AC334_EFD031D60E4CB991_7019_UN,8.284057,00000000000000000000000000001000000000100010000000000000010000100100000000010101000101110100010110110100010101000100001011110100100010100110001011111010110011111111110,BDVWJKPSWHXUOM-SJKOYZFVSA-N
C1(=C(C=CC(=C1)C(F)F)Cl)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,01C7859990035300_1A8CFB9DF4F0DE1A_7022_UN,8.858186,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,YKBTUGAIOXAVBL-KUHUBIRLSA-N
BrC1=CC2=C(C=C1)N(C=C2C3CC3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,6A44F4C76FB1E86E_12C820AE4DC5CCA1_6034_UN,8.591739,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,ITOKJNBFYYLLPE-OSPHWJPCSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCCO3)C4=CC=CC=C4,6D68F93F862587A5_4FC1D03A8B7BCDA2_6041_UN,8.170985,00000000000000000000000000000000000000000010000000001000010000100110000000010000101100010011011110001100010101001000001011101100110011110110001001011001110111101111110,LNBNDIPANWSUHA-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)CC#N,787AA3DF6F51F87C_5467B23A2FA83195_6041_DP,7.778344,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000101001000100110101110110001011010011010110101111010,QYEFPWOLENJMNL-GHTZIAJQSA-N
C1(=NC=C(C=C1)CN2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,CAE050E9F7B3C7EC_DFEC948F51B3EF86_6041_UN,8.821604,00000000000000000000000000000000000000100010000000000000010000100100000000010101100101110011010110101000100111010001101011100100110011110110001011011011010111101111110,MCTILGLYDVESLB-CTNGQTDRSA-N
FC1=C(C2=C(C=C1)C=CO2)NCC3CCCN(C)C3C4=CC=CS4,C408FAF40155DCE7_8CE099ACE510D615_6041_UN,8.397784,00000000000000000000000000000000000010000010000000000000010000100000000000010000111101111011010110101100010110010001101011100100110001110110001011011011110110101111110,IVHYTZQPIVCOQP-UHFFFAOYSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC2=C([N](N=C2C)CC3=CC=C(C=C3)Cl)C)C4,1AA24AF5117E8F52_FD40B9C830B90FA1_7019_DP,8.806244,00000000000000000000000000000000000000000000000000001000000000000100000000010000100100010010001010011001110110010000101011101100110000100100001011011111010110101111010,YLFZONRNPNRMEV-POAQFYNOSA-N
O[C@H](CBr)C1=C(C=CC=C1)NCC2N(C)CC3(CC2)CC3,2494D0D982F309A3_A6C8FDBB3A453BAE_6041_UN,8.442301,00000000000000000000001000000000000000000000001000000100000000000010000000010001001001100011010001101000110010011001101001100000110111110111001011011011110111101111110,SMYLAPHPQOMJIJ-FQNRMIAFSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=CC=C(C=C2)C3=NN=C4CCCCCC[N]34,3F4BFA2C7DD75436_C93CF1AFCB00F014_6041_UN,8.00184,00000000000000000000100000000010000000100000000000001000000000100100000000100101100101100000011010101100010000011000001011101100110001010100011011011111010010101111010,ROGMEUPMLJALGW-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC3(CNC3)C4=NC=C(C=C4)F,CD81C66DAE60CEFF_50F71B9ADAD2A76A_6041_DP,8.222888,00000000100100000000000000000000000000100010000000001100000000100110000000010101101100110010011010101000000110001000000011101100100101110110001011001111010110101111010,FIJMJLQZECIPCJ-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4C(C)OC5=C(C=CC=C45)F,4BE75F11EEC34CAC_7E96AEB0BC5D6B5F_6041_DP,8.5258665,00000000000000000001000000000000000000100010000000000000010000000100000000000101100101010011010111100100110100010100101011100100110101110100001011011111100011101111110,REBROOCMCYEQDM-UOBONFSKSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCC(C(C)C)CC3,302460E53F721FDD_D3406F59864A8826_6041_UN,8.346034,00000000000000000000000000000000000000000010000000001000000000000100000000110000101100010011011010001100010110000000101011101100110001110100011001011101010110101111010,DNDYPSXTIMPYHI-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@H]2O[C@H](CC2)C3=CC=CC=C3)Cl)C4CC4,A91AFD14AE55CF38_57E0E0A30AF32685_7022_UN,8.097691,00000000000000000000001000000000000000000000000000000000010000100000000000000000001100010011000110001001000110000000001000000100110011110100000011010011110111101111110,VCGIANSTGXLSAV-LAUBAEHRSA-N
CC1=C(C=CC(=C1F)C#N)NCC3CCC2(CNC2)O3,4D700BCC5720D9D7_C38AF50A069057E7_6041_DP,7.5349593,00000000100100000000000000000000000000000110000000000000010000000010000000000000001100110011000110001000010110001000001011000000110111110110001010010011110111101111110,RHEVZISRITYCDF-UHFFFAOYSA-N
CC2=C1N=CC=C(C1=C(C=C2)NCC3CCN(C)C3C4=CC=CS4)F,A0809EDF625886CD_C396932E4F0B13A8_6041_UN,8.215063,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001001011111010110101111010,OWTXZMBSGHYZED-UHFFFAOYSA-N
COC1=CC(=CC(=C1)F)NC2C3CC4CC2CC(C3)(F)C4,B572440D7F18EC85_88CCBE4C648F59EC_6041_UN,7.875886,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010010010001000100010100001100000000000011100001110000000101000001100011101111110,IMLKJPDGAZYOKC-UHFFFAOYSA-N
CC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3CCOCC3)C(=CC=C4)Br)C,79A7A5BBC12DC4EC_F45ED3F8BE920B15_6034_UN,8.622434,00000000000000000000000000000000000000000000001000000000010000100100000000010000101101110011000010101100010111000000101011100100110010100110001011011111010111101111110,AKNHVDOSYMOISJ-WMZOPIPTSA-N
FC1=C(C=C(C(=C1)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)F,91BE900F18B16380_F348E4BAA3929638_6041_UN,8.8719845,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,NYSQPMNBYNVAQJ-BLVKFPJESA-N
CC3(C)[C@@H](OC2=CC(=C1OCCC1=C2)Br)[C@H]4CCCN[C@@H]34,845A897457F6C636_19E8E22A9F2FB48E_6035_UN,8.403426,00000000000100000000000000000000000000000000001000000000010000000010000000100000001100010011000011101100110111011100001011000011100010100110000111010111110011111111110,LJUVIPOSSNSRJI-MAZHCROVSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=C(C=CC=C2)C3=NN=C4CCCCC[N]34,464548A4881F5E0C_8E2C5B563508AB84_6041_UN,8.125219,00000000000000000001100000000010000000100000000000001000000000100100000000100101100101100000011010101100010000011000001011101100110001010100011011011111010010101111010,TXOXMPPJLKHNEP-UHFFFAOYSA-N
C[C@@H]1CNC[C@H]1C=CC2=C(Cl)C=CC=C2N3CCOCC3,62717FC5A74B1704_223CBD3BF41A2A1D_7019_DP,9.215378,00000000000000000000000000000000000000000000000000000000010000100000000000010000001101110001000110111001000111010001101011100000110011110110001011011011010011101111110,NWLKKDMWTMAJNN-ZIAGYGMSSA-N
CN1CCN(CC1)C2=NC(=CS2)C3=CC=C(C=C3)NC[C@H]4[C@@H](OCC4)C5=CC=C(C=C5)F,76D8D04681AB8E8C_5AB3F4DCFA23409C_6041_UN,7.846451,00000000000000000000000000000000000010000010000100000000010000100100000000010101011101111011010011101000001101010001101011100100110011110110001001011011110111101111110,WZBGQYUITGXUEF-RDPSFJRHSA-N
CCN4CCC1=C(C(=CC(=C1)NC(CC)C3CN(CC2=CC=CC=C2)CCO3)F)C4,7E3FC4F7182D62F5_997D023374E0FCE1_6041_UN,8.39149,00000000000000000000000000000000000000000010000000000000010000000000000000010000100001110011000100101100110111010010101011100100110011110110001011011101110111101111110,SIFLEOQYKZRWGS-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,0D13317F9BF44ECF_EB0E5A69A2671854_6041_UN,8.446537,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101100010110010001101011100100110001110110001011011011010110101111010,LCNMMXBPERYGRF-JXFKEZNVSA-N
NCCCC(OC1=CC2=C(C=C1)CCNCC2)C3=CC=C(C=C3)F,44B49437833887F6_95FAA5523DC929DA_6035_UN,8.454665,00000000000000000001000000000000000000000010000000000000000000000000000000000000001010110010000000001100110100010100001001000111110110100110001111010001110101100111110,XZIRKSNIWASZIA-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CC3=CC(=C(C=C3)Br)Cl,E4D5FCE34BE04EF7_22E5F15335C4F562_6038_UN,7.4907384,00000000000000000000000000000000000000000000001000000000000000000000000000000000001000010010100000001101110100110000011000000000110010100000000011010011011110100111110,WJRBXGAAPRGTOA-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CC3=CC(=C(C=C3)Br)F,62340B151445DA6C_F6CD20F94824C0A7_6038_UN,7.490734,00000000000000000000000000000000000000000010001000000000000000000000000000000000001000010010100000001100110100110000011000000000110010100000000011010011011110100111110,AEKWGEAKZFMECM-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CC3=CC(=C(C=C3)F)Cl,D35ABC0750190E3E_F68CEA8D56CD6198_6038_UN,7.490731,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010010100000001101110100110000011000000000110010100000000011010011011110100111110,JLXKDJZBUPZLFB-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CC3=CC(=C(C=C3)Cl)Cl,FD8AC49AB2D95BA3_33627C2D0FF3552F_6038_UN,7.490732,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010010100000001101110100110000011000000000110010100000000011010011011110100111110,UDFHCADSCNGPMW-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CC3=CC(=C(C=C3)F)Br,A53DBD38D3995F9A_FF3F5321891A06B2_6038_UN,7.4907355,00000000000000000000000000000000000000000010001000000000000000000000000000000000001000010010100000001100110100110000011000000000110010100000000011010011011110100111110,IZHVQUVUEZYBAY-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CC3=CC(=C(C=C3)F)F,75F63A971F590368_BBD1E4753D6482DB_6038_UN,7.4907327,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010010100000001100110100110000011000000000110010100000000011010011011110100111110,DDMGWLQOQYEPNE-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CC3=CC(=C(C=C3)Cl)F,6ADDDFD241FCF139_938038F3E30504A7_6038_UN,7.4907265,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010010100000001101110100110000011000000000110010100000000011010011011110100111110,INLZRRFOOUKTFE-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CC3=CC(=C(C=C3)Br)Br,AF6777232EE2391B_64409B4F7F76035D_6038_UN,7.4907184,00000000000000000000000000000000000000000000001000000000000000000000000000000000001000010010100000001100110100110000011000000000110010100000000011010011011110100111110,UHIPOIXRLAQRQE-UHFFFAOYSA-N
C(C2CCCC1(CC1)C2)=CC3=C[N](C)N=C3C4=CC=C(C=C4)F,2A0AFCDCEB0A5660_843759DBF6711897_7019_UN,7.6848073,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001011011010000010101111010,BOCVZHAWGUUULZ-UHFFFAOYSA-N
CCC5CCC1=C(C4=C(N1CC3(CC2=CC(=CC=C2)Br)CC3)C=CC(=C4)C)C5,23C0DF332EBFAA61_278FEE30E8F0B12E_6034_UN,7.9412804,00000000000000000000001000000000000000000000001000000000000000000110000000010000000101010000000010001100010110011010101001100100110000100100000011011100010110101111010,AOAPNYFDHVWBLR-UHFFFAOYSA-N
C[N]1N=C(C=C1NCC2(CCCC2)C3=CC=C(C=C3)F)C4CCCC4,8AE735B02FF1272C_E2D4E2E4C0DBDE27_6041_UN,7.9431725,00000000000000000000000000000000000000100010000000001000000000100110000000010101101100010011011010001000000110001000001011101100110001110100001010011011010110101111010,IQNNPHRSFLMFNC-UHFFFAOYSA-N
CC(C)CC1=CC(=C(C=C1)NCC2CC23CCSCC3)F,59492A1282763E89_0F03FCD5921E98C6_6041_UN,7.928786,00000000000000000000001000000000000010000010000000000000000000000010000000100000001000111011000000101000010100001001001000000000110001110110000011010111010110101111010,YCFFZXNFCFQQQW-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC3CC4(NC3)CCC4,9D8263DF223DD78B_E4825AFD3AD5CD17_6041_DP,7.8000836,00000000000100000000000000000000000000100000000000001100000000100110000000010101101100000011011010001000110010011000001011101100110101010110001010011111010110101111010,VRTWQQVBRYUQFT-UHFFFAOYSA-N
CCC[N]1C=C(C(=N1)C2CC2)NC4(CC3=C(C=CC=C3F)F)CCCC4,6F57276E88CDF9B4_23355A1C41077AF5_6041_UN,8.206901,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011001010001000100100011011001011101100110001110100001010011011010110101111010,DVBXOWLIBCSIAB-UHFFFAOYSA-N
N(C1=C2C(=CC=C1)COCC2)[S](C4=C3[NH]C=CC3=C(C)C=C4)(=O)=O,1E864DA28FDF087B_831867177BE2195D_6029_UN,8.805128,00000000000000000000000000000000110000000000000000010101011111001101010001000000110100101011001011100110011001001000011011001100111111011110001011111001010011111111110,OMSSCDBKJKWLDG-UHFFFAOYSA-N
FC2=C(C=C1C=CC=NC1=C2)NCC3CCCN(C)C3C4=CC=CS4,4C7CBF021CD979B3_65616D2B7DBA5210_6041_UN,8.690513,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,KOVSDLXVDAZBAG-UHFFFAOYSA-N
CC2=C1[NH]C=CC1=CC(=C2)NCC3N(C)CC4(CC3)CC4,8C729005D4532AE7_034B84836C929BDF_6041_UN,8.030939,00000000000000000000001000000000000000000000000000000000000000000110000000010001001101100011010010101100010010011001101011100100110101010110001001011111010110101111010,NYBCFKRLWOFVCC-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C(C)(C)C3=CC=C(C=C3)F)=O,F986E5BEA8487F7A_01DA7A6578388124_6038_UN,8.361672,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010001100010001000110110111000011000000000110010100100000001010101111111111111110,OBTLSLBVCUDOSM-UHFFFAOYSA-N
N5CC1=C(C=C(C=C1)NC2=CC(=C(C=C2)N3CCOCC3)F)C4(CC4)C5,9DBD21A6D25F9A6D_D8A0F88A97B3C340_6041_DP,8.090452,00000000000000000000001000000000000000000010000000000000010000100010000000010000001001110011000100101100010101011000001011100100110111110110001011011011010011100111110,YGYBPBJQYKAFRC-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,9360F9588C359391_7A2CAA491D2BB877_6041_UN,8.037395,00000000000000000000001000000000000000000010000000001000000000000110000000110000101100010011011010001100010100001001101011101100110001110100011011011101010110101111010,XUISTLHKXRZRIY-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4C5CC6CC4CC(C5)(F)C6,57EA9303F6BBBA02_3013C22F9C486E6C_6041_DP,7.7152715,00000000000000000000001000000000000000100010000000000000000000000110000000000101101101110011010010101100010110001000000011100000110101110110001001001001010010101111010,WDOWADVXQPNSSN-DXBHYYJCSA-N
ClC2=C1C=CN(C1=CC=N2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,77935D097F1DE626_3CAD9765D4D8EB02_6034_UN,8.651006,00000000000000000000001000000000000000000000000000000000000000100100000000010101100101010000010010101101010100010000001011100100110001100110001011011010010110101111010,BNBCAJNFNQNYLC-KUHUBIRLSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)C5=C4OC=CC4=CC(=C5)F,80DD88A67C09EBA2_20A68C44987EF3AD_6004_DP,8.53435,00000000000000000001000000000000000000100010000000000000010000100100000000000101100101010011010011100100110100010000101011100100110001110100001001011001100010101111110,NPBWZXAHQOAXMK-MUJYYYPQSA-N
CC1=C(C3=C(N1CC2CCC(CI)OC2)C=CC=C3)C4=CCNCC4,8856C9F567E92144_1331B8DE04ED9524_6034_UN,8.704932,00000000000000000000000000010000000000000000000000100000010000100100000000011000001101100001000011111100110011010000101011100100110010100110001011011011110111101111110,YYOXAKOTBAGWKW-UHFFFAOYSA-N
BrC1=CC=C(C=C1)C2=CN(C=N2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,017B4D67A74AF249_51BF9BA8F8AE4DE6_6034_UN,8.438993,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101000000100010000001011100100110001100110001011011010010110101111010,FDQMXWNDMCBTOL-VGSWGCGISA-N
ClC1=CC=C(C=C1)C2=CN(C=N2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,81A9F910154B6DAE_72210B211A687E4F_6034_UN,8.438991,00000000000000000000001000000000000000000000000000000000000000100100000000010101100101010000010010101001000100010000001011100100110001100110001011011010010110101111010,JQWQVLBWJAHICF-VGSWGCGISA-N
FC1=CC=C(C=C1)C2=CN(C=N2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,2CF92CC4C0C2D1ED_A3E343D6756F533B_6034_UN,8.438978,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101000000100010000001011100100110001100110001011011010010110101111010,KAKUPVQKIBQAOC-VGSWGCGISA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CCC3)C4=CC(=CC=C4)F,3EFD0ACD553C810B_C16DB6B61A61BB2C_6041_UN,7.450245,00000000000100000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100110001110100001010011011010110101111010,NIVVFEJTIXGQNI-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CCCC3)C4=C(C(=CC=C4)F)F,2D32E8DF1DC5F056_09D9EBD89B770C15_6041_UN,7.9788,00000000000000000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,HIGZIBPFWLKEER-IBGZPJMESA-N
FC2=C(C=C1C=C[NH]C1=C2)NC4C[C@H]3CCC[C@H](N3C)C4,3AE9275DAD803A23_1208C437FA5998B4_6041_UN,8.1689625,00000000000000000000000000000000000000000010000000000000000000000100000000010000100101010001010010100100110110010000101011100100110101110100001011011011000010101111010,BATGVQIGELZZJQ-AGUYFDCRSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CC3)C4=NC=C(C=C4)F,7DFDC3E557A30993_4F450B9764356F48_6041_UN,8.092549,00000000000000000000001000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100010001110110001001011011010110101111010,ZGBQDHASROIWPL-INIZCTEOSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC(CC)C3CC4CCC3C4,DBD93B94D7DB55D9_76A863209F62F83B_6041_UN,8.009016,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011011010100000110110010010001011101100110001110100001011011111000110101111010,BOSXFXIJFLSLGB-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NCCN2CCNCC2C3=NC=C[N]3C,672642127F0F4DAC_BBD248A9337184D7_7022_DP,8.186347,00000000000000000000000000000000000000100010010000000000000000100100000000010101101101110001010010111000100110010000001011100100110100100110001011011011010110101111010,QBHZDFZJAWNTCK-UHFFFAOYSA-N
CC1=C(C3=C(N1CC2(CC)COC(CI)C2)C=CC=C3)C4=CCNCC4,C6D0D26478C969E7_699A533319436346_6034_UN,8.61518,00000000000000000000000000010000000000000000000000100000010000100110000000011000001101100001000011111100110011011010101011100100110010100110001011011111110111101111110,XEVXFGHSMCQHNI-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC34COC(C)(CC3)C4,1D8C5DD946959096_EBDDBEAC5C2598E2_7022_UN,7.6638174,00000000000000000000000000000000000000000010000000001000010000000110000000010000101100010011001011101000010111011001101011101100110011110110001011011011110111101111110,WZUJEYLYYXYTBD-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC2CNC3(C2)CCOCC3)C=CC(=C4)Cl)C5,7902F4EF7B670492_4387701C24E38D78_6034_UN,7.134991,00000000000000000000000000000000000000000000000000000000010000000110000000010000101101110011010011101101110101011001101011100100110010100110001011011001010111101111110,YPWQRXABJIDWOZ-UHFFFAOYSA-N
CC1=C[N](N=C1)CC2=C(C=C(C=C2)NC3CCN(C)C34CCCNC4)F,05FE032FC8A8106C_C97000D85EDDFEEC_6041_DP,7.873312,00000000000000000000000000000000000000000010000000001100000000000110000000010001101101110011011010101000110110011001101011101100110101110110001011011111010110101111010,MLJBTHZCQSYPHC-UHFFFAOYSA-N
CC1=C(C=CC2=C1CCC2)NC3=CN=C([Si](C)(C)C)C=C3,49F7A6F31CCBDB89_B64F0642D3086CCE_6041_UN,7.578689,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100001010010100100010010001000101001000100010001010100011011011111000010101111010,FQIIQNICYYDKEH-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1C)Br)[N]2CC[C@@H]3CCNC[C@@H]3C=C,0EEE53D05153B2D5_0D1BDF0F8D740821_6034_DP,9.150431,00000000000000000000000000000000001000000000001000000000000000000100000000010000001101110001000010111100110110010000101011100100110000100110001011011111010110101111010,IAOQWHABGROKIC-HOTGVXAUSA-N
C1(=CC(=CC(=C1)F)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,691D560419CC17F3_9597D3CBC50F4B9A_7022_UN,8.251735,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,VWHMBOIWSATNLP-YJYMSZOUSA-N
C1(=CC(=CC(=C1)Cl)Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,840902A6D8F24F75_EE8F197561C457F8_7022_UN,8.251717,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101001000100010000001011101100110001110110001011011011010110101111010,FEVBBLWAVOXMIS-YJYMSZOUSA-N
C1(=CC(=CC(=C1)F)Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,76066711760F3966_1D36672CDB033D1D_7022_UN,8.251713,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101001000100010000001011101100110001110110001011011011010110101111010,CYILWTXIDZSOTD-YJYMSZOUSA-N
C(CC1COC1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,A9B627B31B31C016_E7A09E9D5156EF7A_7019_UN,8.064685,00000000100100000000000000000000000000000010000000000000010000000000000000000000000001110000010010010000000111010000101000100000110001110110000010011010010111101111110,PIWXZFPMJRTJOH-UHFFFAOYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC4C(C)(C4)C5=C(C=CC=C5)F,6D655ECE2AF53605_52AF69E77AFC2D00_6041_DP,7.495518,00000000000000000000001000000000000000100010000000000000000000100110000000000101100100010011000010100000110100011001101011000100010101110100001011010011000010101111010,QDCHRNNRJIFZCT-TWLRPFNCSA-N
C2(=C1C=N[N](C1=CC=C2)C3CCCCO3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,120E5A0927EC8811_C6F6CD406D2C7034_6041_UN,8.676702,00000000000000000000000000000000000000000010000000001000010000100100000000010001100101110011111110101100110111110001111011101100110011110110001011011011010011101111110,ZZRQVSOPEAKLFT-FQXDTITESA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CCC3CCN(C)C3)Cl,484A396F191622FC_E9D0362150CF31A7_6034_UN,8.029194,00000000000000000000000000000000000010000000000100000000000000000100000000010110010101111011010010001001001110010001101111100100110001110110001010011111010110101111010,KPJDZANOBWLQIV-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3(CCC)CNCC3)Cl,A1558790B919C790_9953080C55B7E30A_6034_UN,8.578333,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101111011000010001001101110011011001111100100110101110110001010011111010110101111010,FMBRHPUVYAEGEP-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC(OC)C2CCOC2)F)CC3,F7F667EE95DB08B1_1B1F59D297D5E49E_6041_UN,7.396543,00000000000000000001000000000000000000000010000000000000010000000000000000010001101101110101010110001000000111010001101011100010110011110110001010011111110111111111110,LFVBBVHHGHVJDL-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CC=N2)NC(CC)C3CCCC3,AD4C82A51FAFB3F9_995AF5609B2FE04C_6041_UN,8.199796,00000000000000000000000000000000000000000010000000000000000000000100000000000000100000010011000010100100110110010010001001000100110001110100001001010001000110101111010,WNCHUWIHDXEXDH-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(CC)CCOCC3)C4=CCNCC4,C85E79DBB81A4B1B_6B1C75E85429C75F_6034_UN,8.547721,00000000000000000000000000000000000000000010000000100000010000100110000000011000001101110001000010111100110111011010101011100100110010100110001001011001010111101111110,FKAQBCVTDINBKK-UHFFFAOYSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)NC[C@@H]4CCCN(C)[C@H]4C5=CC=CC=C5)F,A826D1DDBB19EF9C_0C4E5F769C5B0D26_6041_UN,7.411326,00000000000000000000000000000000000000000010000000000000000000100100000000010000101001110011010000101100010110010001101011100100110001110110001011011111010110101111010,GAHVMXLHKGEZRD-DCFHFQCYSA-N
FC1=C(C=C(C=C1)C3=C2C=CC=CC2=C(N=N3)NC[C@@H]4OCCN(C)[C@H]4C5=C[N](N=C5)C)F,AB99AAC4746585B2_87E45D5FB431BF5C_6041_UN,8.623494,00000000000000000000000000000000000000100010000000001000010000100100000000010101101101110001011110101100010111010001101011101100111011110110001011011111110111101111110,VVYZUSDRJTXTFT-GMAHTHKFSA-N
CC1=CC2=C(C=C1)C(=CN2CC4(CC3=CC=C(C=C3)F)CCNC4)C5=CCNCC5,14248E5ECBB45AD7_0C8953F7ED60967C_6034_UN,8.555345,00000000000000000000000000000000000000000010000000100000000000100110000000011000101101110011000010111100110100011000001011100100110100100110001001011001010110101111010,FAIXHUSFJJJTEW-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CCC(C)(C)CC3)Cl,395469C4B11EC002_19E77C1C844A8358_6034_UN,8.350368,00000000000000000000000000000000000010000000000100000000000000000110000000110110010101011011000010001001001100001001101111100100110001110100011011011111010110101111010,LCGBWXDOXCQIFT-UHFFFAOYSA-N
COCC1=C(C=CC(=C1)[N](=O)=O)NC2=CC4=C(C=C2)OC3(CCC3)C=C4,37536DD9605CA133_5238E44244D63031_6041_UN,7.9859657,00000000000100000000000010000000000000000000000001000000110000010010001100000000000000100010011001110110010001001101001100101110001011010100101011111011110111111111110,PPMGJKAVDOFNQG-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)N[C@H]4[C@H](C3=CC=N[N]3C)OCC4,0236CEBCBE2145FE_799A5B2B14CBB22D_6041_UN,7.892278,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111000100110101010000001011101100010011110100001010011011110011101111110,DMFYYRVVNRWFSO-RHSMWYFYSA-N
CC1=C(C=C(C=C1)NC[C@H]2[C@@H](OCC2)C3=CC=C(C=C3)F)CC=C,B3E670EFD52E3BCF_7A002ACB7A427640_6041_UN,7.897398,00000000000000000000000000000000001000000010000000000000010000100000000000000000001100010011000011011000000101000000101000000100110011110110000011010011110111101111110,KQIYKYPOKYMZMR-RXVVDRJESA-N
FC1=C(C=C(C=C1)NCCC2CCCN(C)C2)C3OCCO3,89762DEC754AFB59_2AEC682A6F34C9C4_6041_UN,6.8992906,00000000000000000000000000000000000000000010000000000000010000100000000010010000001101110001010010101000100111010001101011110000110011110110001011011011010111111111110,GAXPHQFRHXKUMF-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CC3)C4=C(C=CC=C4)F,5230C8403904232C_D5682406783FFBEA_6041_UN,7.934038,00000000000000000000001000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100010001110110001011011011010110101111010,FOBHSBGEWWVEGI-SFHVURJKSA-N
N(CC1C2CCC(C1)CC2)C(=O)CCC3=CC(=C(C=C3)Cl)F,617BE68A243F0C9B_4D8C36CC99834517_6038_UN,7.7137938,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000001001110100110000011000000000110010100000000011010011011110100111110,RNJODKQUVATBAE-UHFFFAOYSA-N
N(CC1C2CCC(C1)CC2)C(=O)CCC3=CC(=C(C=C3)Cl)Cl,5546925CDC34F196_5CD18D450CE90E4C_6038_UN,7.71379,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010011100000001001110100110000011000000000110010100000000011010011011110100111110,DSEODGSHXHEXFO-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NC3COC2(CCNCC2)C3,83E69918943D83BE_8AD0A441BD40BEA5_6041_DP,7.8547993,00000000000000000000000000000000000000000110000000000000010000000010000000000000001100110001000111101000110101011000001011000000110111110110001011010011110011101111110,DGWJAZATHPFUQZ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C3(CCNC2)CCC3)Cl)C4CC4,E8D95E7FCB6CAD78_CD05606C024E96D6_7022_DP,7.722455,00000000000100000000001000000000000000000000000000000100000000100010000000000000101000110011000000101001110110011000001001000000110101110110001011010011010110101111010,QLMOKAFXZUDHCK-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@H]2[C@H](CC2)C3=CC=CC=C3)Cl)C4CC4,CA2D728841FFA977_BE83DC0D48A66603_7022_UN,8.640616,00000000000100000000001000000000000000000000000000000000000000100000000000000000000000010011000000000001100110010000001000000100000001110000000011010011000010101111010,XBJIHTIIWOMBJS-VQIMIIECSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC4(CC3CC3)CCCC4,314EC28B82315349_E1FEFAEEB9708FA9_6041_UN,7.834091,00000000000000000000001000000000000000000010000000001000000000000110000000010000101100010011011010001100010100001000001011101100110001110100001000011001010110101111010,WPPCOMXDHVIRGD-UHFFFAOYSA-N
C2(=C1OC=CC1=CC=C2F)NCC3CCCN(C)C3C4=CC=CS4,C408FAF40155DCE7_9F35B02CB650E7F1_7022_UN,8.341724,00000000000000000000000000000000000010000010000000000000010000100000000000010000111101111011010110101100010110010001101011100100110001110110001011011011110110101111110,IVHYTZQPIVCOQP-UHFFFAOYSA-N
O(CC1CC2(CO1)CCOCC2)C[C@@H]3CNCC(O3)(C)C,D691527F48FA4322_410A5C774F3F11EF_6039_DP,7.3130736,00000000000000000000000000000000000000000000000000000000010000000010000010100000001100100010000111101000010011001001001011000010110010000110100001110101110101111101110,XKPFYJLAEVPVQK-KZUDCZAMSA-N
CC1(CCO1)C2=CC=C(S2)NCC3=NC4=C([N]3C)C=CC(=C4)F,708C0776D2017FAC_48EC9C466BD1133F_6041_UN,8.030208,00000000100100000000000000000000000010100010000100000000010000100110000000010101011101011000010010001100010101011001101011100100000011110110001010011111110111101111110,BQJUFTLARYQGMV-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NCC2(CCNC2)C(C)(C)C,D5FE6E177694A953_E93FD11079B41B96_7022_DP,8.754142,00000000000000000000000000000000000000000110000000000100000000000010000000100000101100110011000010001001100110011000101001000000110101110110011010010111010110101111010,UIEDCWGVHKOPHK-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2CC2)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,F5A7EC60AA534C66_26DF5F184105039E_6041_UN,8.589937,00000000000000000000001000000000000000000010000000000000000000100100000000010000101101110011010010101000000110010001101011100100110001110110001011011011010110101111010,BWTQJCQWKNJYAR-PXNSSMCTSA-N
CC1=C(C=C(C(=C1)N[C@@H]3C[C@H]2CC[C@H](N2)C3)F)[N]4C=CC=C4,FE0B8A7539DA6A08_163B86A80337EA2C_6041_DP,8.096587,00000000000000000001000000000000000000000010000000000100000000100100000000010000100101010011000010100000110100010000001011100100110101110100001011011011000010101111010,MYVDMMIRPBATFR-QDMKHBRRSA-N
N1CC(C1)(C#N)C2=NC=C(C=C2)N[C@H]3[C@@H](C3)C4=C(C=C(C=C4)F)F,B259CFD7ED6C77D2_812E3C99B5E0F71D_6041_DP,7.5240145,00000000100100000000001000000000000000000110000000000000000000100110000000000001101000110010000000101000100100011000000011000100000101110110001011000011010010100111010,AUJMOCUWVZQYNJ-GOEBONIOSA-N
C1(=C(C=C(C=C1)C2CC2)F)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,F5A7EC60AA534C66_B541724086A37729_7022_UN,8.305722,00000000000000000000001000000000000000000010000000000000000000100100000000010000101101110011010010101000000110010001101011100100110001110110001011011011010110101111010,BWTQJCQWKNJYAR-PXNSSMCTSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,909B617064CE2DE4_4181804DCEE0D696_7022_UN,8.305717,00000000000000000000001000000000000000000000000000000000000000100100000000010000101101110011010010101001000110010001101011100100110001110110001011011011010110101111010,OREKCNQOYQTLOI-PXNSSMCTSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2CCCN(C)[C@H]2C3=C[N](N=C3)C)Cl)C4CC4,87BE37AA9E977879_D08D1797154A9D2E_7022_UN,8.349426,00000000000000000000001000000000000000000000000000001000000000100100000000010000101101110011011010101001000110010001101011101100110001110110011011011111010110101111010,SXDXHOHRRVMRMZ-HRAATJIYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3C2CC2CC3)F)CC4,41CE58FBF17C62A4_F45997794D245A08_6041_UN,8.044582,00000000000000000001001000000000000000000010000000000000000000000000000000010001101001110011010010001000010110010001101011100000110001110110001011011011010110101111010,URSHJTNAJYAWTD-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2(CC2)C3CCSCC3)F)CC4,DD165E9026E55249_9CA98FD1D0E688BF_6041_UN,7.9298534,00000000000000000001001000000000000010000010000000000000000000100010000000010001100001111011010000101000100110011001101011100000110001110110001011011011010110101111010,CASPPTWPJQGNNH-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC[C@@H]2CCO[C@H]2C3=CC=N[N]3C)C4CC4,67D24EAFEC36269F_50800A5FC11242C0_6041_UN,8.372335,00000000000000000000001000000000000000000010000000001000010000100100000000010000101100010011011111001000000101000000001011101100110011110110001010011011110111101111110,NNZPOICDWKVQPK-SCLBCKFNSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC3CC4(CCC3)CCCCC4,F348F9084218789A_EDD0BA6B7DA57032_6041_UN,8.368439,00000000000000000000000000000000000000000010000000000000000000000110000000000000100000010011000000100100110100011000001001000100110001110100001011010011000010101111010,RHLMILQQWZVCSO-UHFFFAOYSA-N
CC1(C)O[C@@H]2CC[C@H]1C[C@H]2OC4=C3C(=CC=C(C3=NC=C4)F)F,BAE80AC50BF432DA_FB77CEA4D6D85438_6035_UN,7.933159,00000000000000000000000000000000000000000010000000000000010000000110000010100000000000010000000001100100010110001100101011000111110010100100000101010100100011011111110,HJACKFZYEFRRJU-PSOPSSQASA-N
C1(=CC(=C(C(=C1)F)F)F)NC(COC)C2CCCOC2,239F152D5C7243DD_FDB423784EE1CDAB_7022_UN,7.9921227,00000000000000000000000000000000000000000010000000000000010000000000000000000000000000110011010101100000100101010001001000000010110011110110000011010011010111111111110,BJOKIRHETVMYJJ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)C=C,A45E458C95B257F9_EE9CE98D7FE95763_6041_UN,8.368634,00000000000000000000001000000000001000000010000000000000000000100100000000010101101101010011010010111000000100010000001011100100110001110110001011011011010110101111010,HJMPKDZCNZEYLR-IERDGZPVSA-N
C(CC2C1CC3CC(C1)CC2C3)=CC4=C[N](C)N=C4C5=CC=C(C=C5)F,A73025E533284751_17D87606D4BA73F6_7019_UN,8.129614,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010100010100000000000011101100110000100100001011001010000110101111010,WKGHXHWGXISJHT-UHFFFAOYSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3(C)CCCS3)C4,64BE0F28197EFAC2_8BABD0571E160538_6041_UN,8.168407,00000000000000000000000000000000000010000000000000000000000000000110000000010000111101101011010010101100110010011001101011100100110101010110001011011101010110101111010,AFIVRAYYXQRQMS-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2(C(CC)CCC2)C)F)CC3,31F12E6880B35B2E_5BCCB5332734F3FE_6041_UN,7.928683,00000000000000000001000000000000000000000010000000000000000000000010000000010001100001110011010010001000100110011011101011100000110001110110011010011111010110101111010,ATMSMNQDNAKLCP-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC4=NC2=C(CC3(CC2)CCCCC3)S4)F,DD2CA23F3C01E761_9D8731B7443575E4_7022_UN,7.1792574,00000000000000000000000000000000000010000010000100000000000000000110000000100100010101111001010010001100011100011001001011100100110001110100001011011111010110101111010,NIJWIDGWKFGEBV-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC3CCCC(CC)CC3,FA9E7A9B912D43CD_08D9D7B7FEBD86D7_6041_UN,8.138745,00000000000000000001000000000000000000000010000000000000000000000100000000000000101000010011000000101100010110000010101001000100110001110100001011010111010110101111010,SZKDEMSVXQJCBM-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NCC3(CC2=CC=C(C=C2)F)CC3)F)C4,4F2EF732A31EEADE_E21B7B9EDDB3C6CE_6041_UN,7.816595,00000000000000000000001000000000000000000010000000000000000000000010000000010000001001110011000000101100010110011010101001100100110001110110001011011001010110101111010,JPJNECMXQQKGPE-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@H]2[C@@H]3[C@H](C2)C4CCC3C4)F)[N]5C=CC=C5,A7C31FC9AC4416E1_52A81D6D5F4E0861_6041_UN,8.043187,00000000000100000001000000000000000000000010000000000000000000100100000000010000000101010001000010000100110100010000001001100100110001110100001011011011000010101111010,NMGMBRMHBFFEPI-MWOVNREESA-N
FC1=C(C=C(C=C1)NC[C@@H]2C[C@H](OC)CN2CC3=CC=CC=C3)C4OCCO4,6014FB92F025B299_A4E3FDCB9CE41D1E_6041_UN,8.084168,00000000000000000000000000000000000000000010000000000000010000100000000010010001001101110011010111001000000101010000101011110111110011110110001111111011110111111111110,LFLJVCJLAYVQRB-OALUTQOASA-N
COC1=CC(=C(C=C1)C)NC24CC3CC(C2)CC(C3(F)F)C4,2A59990A86980106_2E9205EE1D9B894C_7022_UN,8.072276,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010001010001000100110100011100000000000011100001110000000111000111100011101111110,JBTAJWBBCMORDP-UHFFFAOYSA-N
CN4CCC1=C(C3=C(N1CCCC2CC2(C)C)C=CC(=C3)Cl)C4,197D92B9EF34C8EB_5CD1C042EF90A6E6_6034_UN,7.9866276,00000000000000000000001000000000000000000000000000000000000000000110000000110000100101110000010010101101010110011001101011100100110000100110011011011110010110101111010,QVLAYEQBHMUYGZ-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)N[C@H]4[C@H](CC4)C5=C(C=C(C=C5)F)F,59235F3BA5E26EC9_41DA876463955886_6041_DP,8.266605,00000000000100000001000000000000000000100010000000000000000000100100000000000101100101010011010010100000110100010000101011100100110101110100001011011011000010101111010,JUZQEEKJSTXREB-LLJHKCNDSA-N
CC1=C(C=C(C(=C1)NC2=NC(=N[N]2C)[C@@H]3CCCN3)Cl)C4CC4,9BE23C0B9F8D8E0C_5835F8B1EC211328_7022_DP,8.15448,00000000000000000000001001000000000000100000000000001000000000100100000000010101101100010011011010001001101110010000001011101100010101110100001010011111010010101111010,KGGUAVYYVNOVNI-AWEZNQCLSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=C(C3=C(C=C2)N=CC=C3)Br)C4,EB19A26A6C0DA93B_939E4A363035A6E6_6035_UN,8.432803,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000010011101100010100000101001001100111110000100100001111011110110111101111110,GUKGBBCUCKDUCJ-QRDCCXFBSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NCC3C(CCC)CCC3,1D7A43B58369EB8D_C6A9AA1DFD2EFFA2_6041_UN,8.637088,00000000000000000000000000000000000000100011000000000000000000000100000000000100001100010011000010001100010110000011001001000100110101110100001000010011010110101111010,FSLOTHRVBUTBAM-UHFFFAOYSA-N
C2(=C1OC=CC1=CC(=C2)F)NC[C@@H]3CCCN(C)[C@H]3C4=CN=C[N]4C,5305ED7D7B4F72E1_AF2857CAFE4CC9E7_7022_UN,7.912003,00000000000000000000000000000000000000000010000000000000010000100100000000010101101101110011010110101100010110010001101011100100110001110110001011011111110110101111110,JBGITOQKBILNOB-KBXCAEBGSA-N
C(C1CC12CC2)=CC3=C([N](N=C3C)CC4=C(C=CC=C4Cl)Cl)C,44CCB2EB8545BEE0_A28749EF6DCF43A0_7019_UN,8.436226,00000000000000000000001000000000000000000000000000001000000000000110000000010000100100010000001010011001010110011000100011101100010000100100001010011110010110101111010,DCDQDPKBXIZDSF-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)CCC2)NC3CCN(C)C34CCCNC4,03A7E25DFEADE968_24D02FD12EE2FFEE_6041_DP,7.7835665,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101110011010010101100110110011001101011100000110101110110001011011011010010101111010,OVBYWLWOQWJCLT-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,417EFD48B29E76C3_426A92141A2F489C_6038_UN,8.263164,00000000000000000001000000000000000000000010000000000000000000000100000000000000100000010011100011100100110100110010011001000100110001100100001011010011001110101111110,GGAROHOMJWMBEY-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(C3=C(C)C=C(N=C3)F)=O,A76C473F8C574CD9_4590FB992439ACEE_6038_UN,8.623146,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010011100001111000010100100000011001000000110000100100001011010011011110101111110,IZPKNAVNKUZDLV-UHFFFAOYSA-N
C(C23CC1CC(CC(C1)C2)C3)=CC4=C[N](N=C4C5=CC=CC(=C5)C)C6=CC=C(C=C6)F,3F215830772958CE_B1B002B4EAA9413F_7019_UN,7.957952,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010000001010010100010100001000000011101100100001110100001011001010000010101111010,IVQOIKGKXMQQFG-UHFFFAOYSA-N
C1(=CC=C(C=C1)C[N]2C=NC3=C2CCCC3)NC4=CC=C(CC[Si](C)(C)C)C=C4,66D7F187EED71276_212D0D95E26B4BA3_6041_UN,7.9291053,00000000000000000000100000000010000000000000000000000000000000000100000000110101000101100000010010001100010000011001101011100100110001010110011011011101010110101111010,MWKBUEYZXGYTJR-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)F)CC#N)N[C@@H]2CNC[C@@H]2CC3=CC=CC=C3,D8E3ACE6CEDA3940_8CB17DCBD24CD1BC_6041_DP,7.62137,00000000000000000000000000000000000000000110000000000110000000000000000000000001101100110011000010001000100100010000000001000100110101110110001011000011010110100111010,MBPYWIFNRAGVCT-KBXCAEBGSA-N
N(CC1C2CCC(C1)C=C2)C(C4=C(C)N=C3C=C(C=CC3=C4)F)=O,0E0CF3FE295B0352_6B43A6F5B58ED675_6038_UN,8.364688,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010011100001111100010100100000011001000100110000100100001011010011011110101111110,IGRHJSPYRZVOIM-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3(COC3)C4=C(C=CC=C4)F,1ED1725360B57D5F_9C5D308A0FEA6A6E_6041_UN,7.9549565,00000000100100000000000000000000000000100010000000000000010000100110000000010100100101110001010110101000100111011001101011100100010001110110001011011011010011101111110,ILEPWJMHIZQINY-KRWDZBQOSA-N
CC1=C(C=CC(=C1)F)NC[C@@]23CCCN[C@H]2CCCC3,99AA3DCF0456E695_4CE192A33EC77D67_6041_DP,8.659522,00000000000000000000000000000000000000000010000000000100000000000010000000000000101000010011000000101100110110011000001001000000110101110110001011010011010110101111010,HAUNARLPJHDJIW-DLBZAZTESA-N
FC1=CC(=C(C=C1)C2CC2)NCC3C(N(C)CC3)C4=CC=CC=C4,2C5AE5A729D87CDD_F09581ED517089D6_6041_UN,8.43289,00000000000000000000001000000000000000000010000000000000000000100000000000010000101101110011010010001000000110010001101001100100110001110110001011011011010110101111010,XOCRUDFBKQRKNQ-UHFFFAOYSA-N
FC1=C(C=CC=C1)C2=CSC(=N2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,C4036C383427CA84_8186D1967C79D2D6_6041_UN,8.61298,00000000000000000000001000000000000010000010000100000000000000100100000000010101111101011011010010101000001100010000001011100100110001110110001011011011010110101111010,BUZCODWBDRLDMZ-VFNWGFHPSA-N
FC1=CC2=C(C=C1)N=CN=C2NC3CCN(C)C34CCCNC4,3FD3668BF9C94414_9911F189FCBDD0EB_6041_DP,8.652412,00000000000000000000000000000000000000100010000000000100000000000110000000010101101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,FNEMFTURRJXWPW-UHFFFAOYSA-N
CC4=CC1=C(C=C(C=C1C)NCC2CCCCN2C3CC3)[NH]4,24B077E869517F1D_9E2C399CF2345128_6041_UN,7.926629,00000000000000000000001000000000000000000000000000000100000000100100000000010001101101000011000010101100010000010000001011100100110101010110001001011111010110101111010,RHLVCWUYFOARIM-UHFFFAOYSA-N
CC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]4[C@@H](CNC4)C5=CC=C(C=C5)Cl,7B8DFAD138F952F5_1B4104583B6D6E58_6034_UN,8.020177,00000000000000000000000000000000000000100000000000000000000000100100000000010101101101110011000010001001100100010000001011100100110100100110001011011011010110101111010,CVGSIVJAKXFZQZ-XWQVQCDNSA-N
FC1=CC(=C(C=C1)C2CC2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,0BA1B65A58FCBC92_A2A4D9A6889B1D2C_6041_UN,8.504246,00000000000000000000001000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,REXKBEFLYIKVBB-OALUTQOASA-N
CC[C@H](OCCN1CCSCC1)C2=CC(=C(C=C2)C)F,F30182FAEEACB39C_DF51281B3DF62149_6039_UN,8.903332,00000000000000000000000000000000000010000010000000000000000000000000000000010000000001111000000100101000000111010010001011100010110010100110000011011110110101101111110,HZQNNHSHYCNYIQ-INIZCTEOSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CCNC4(C3)CCC4,7EE95886CA0C08CA_36E103EB760A7A38_6041_DP,7.637984,00000000000100000000000000000000000000100000000000000000000000000110000000000100001000000011000000101100110010011000001011000100110101010110011011010111010110101111010,IWYLHXHLIYXRPK-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)NC[C@H]4[C@H](C3=NC=C[N]3C)OCC4,8A2D10D5D786E488_A3B3A1CB88949CD6_6041_UN,7.467918,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101010011010111001100010101000000001011100100110011110110001010011011110111101111110,LBBQFXZXBJXKHV-SUMWQHHRSA-N
BrC1=CC2=C(C=C1)N(C=CC2=O)C[C@H]4N[C@H]3CCO[C@H]3C4,19174DC5334978C6_C94584530BDEDD0A_6034_UN,8.815672,00000000000000000000000000000000000000000000001000000000010000000100000000010001000101010011000111101100110101010100001011100101110010100110001101011001111111110111110,QVZUWJIDEREPDH-RBOXIYTFSA-N
FC1=CC(=C(C(=C1)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)F,B0CA3B0424530950_5C6FE4D9E13BD788_6041_UN,9.243832,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,HCNZHYDYOQHVGH-HOCLYGCPSA-N
C1(=CC2=C(C=C1)OCCC2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,2CD79633AF534804_B722BB626C96AAF6_7022_UN,8.350574,00000000000000000000000000000000000000000000000000000000010000100000000000010000101001110011010000101101010111010101101011100100110011110110001011011011110111101111110,BMRPPCQQRSWLDN-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CC3)C4CCC4,79829FF1A4080660_BC37E127815AD1C5_6041_UN,8.196776,00000000000100000000001000000000000000000010000000001000000000100110000000010000101100010011011010001100010100001000001011101100110001110100001000011001010110101111010,LMZPFLWRBHEPPD-UHFFFAOYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC6=C(C=C(C5=NC4=C(C=CC(=C4)C)O5)C=C6)F,75EF24E87C8CD034_31DBD293892479E4_6041_DP,8.177653,00000000000000000000000000000000000000100010000000000000010000100100000000000101100100010011100110100100110100110000011011000100010101110100001011010011100010101111110,JRXPDPZDCJZJEP-PGKMIFDNSA-N
N1CCCC2=C1C=C(C(=C2)N[C@H]4[C@H](C3=NC=C[N]3C)OCCC4)F,52B203B8512B8EBD_30940C5ACD7B58BD_6041_DP,7.5303817,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101010011010110101100110101010000001011100100100111110110001011011011110011101111110,ZHSLBTYNKNUBCM-RHSMWYFYSA-N
O=[N](=O)C2=C1C=CN=C(C1=CC=C2)NC4=C3OCCCC3=CC(=C4)F,DCE14652ADF428E8_AAAF6304890D2808_6041_UN,8.409557,00000000000000000000000010000000000000100010000001000000110000010100001100000100000000010001001100100110010101000100001111101100101011110100001011111001110011110111110,ILMQYWJVPGXXBC-UHFFFAOYSA-N
FC1=CC(=C(C=C1)CCC#N)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,FC36C4DA45291CA6_A112229A4F33E64B_6041_DP,7.5222473,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110100111010,YGIBPKCIPIIOBP-FXAWDEMLSA-N
CC1=CC(=C(S1)[Si](C)(C)C)N[C@H]2C4=C(OC3(C2)CCCC3)C=CC(=C4)F,977381D50AF416D7_AD6F9769E9C275C8_6041_UN,7.506008,00000000000000000000100000000010000010000010000000000000010000000010000000100000010100111001010011100100110100011100001010000100110011110100010011011111100011101111110,QXXQHNWQMGSBNZ-GOSISDBHSA-N
FC1=C(C2=C(C=C1)CCC2)NC[C@H]4[C@H](C3=NC=C[N]3C)OCC4,DB56BEF634CD59A1_0456257ECD0AABF8_6041_UN,7.5727677,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101010011010111001100010101000000001011100100110011110110001010011011110111101111110,OCDAZYOUDMFLMV-SUMWQHHRSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC[C@@]23CCN[C@@H]2CCC3,79CF39AA2E26676E_2F94625EEB67FC4A_6041_DP,8.063038,00000000000000000000100000000010000000000000000000000100000000000110000000100001101100100011010010101100110000011000001011000000110101010110011010011111010110101111010,YKWKMKOTSGTHDH-GDBMZVCRSA-N
FC1=CC2=C(N=C1)C(=CC=N2)NCC3CCCN(C)C3C4=CC=CS4,61CC2AAE3E55D78E_0E4A2CC202E5D386_6041_UN,8.683192,00000000000000000000000000000000000010000010000000000000000000100100000000010001111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,VFDQYIRDJMHHMZ-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)F)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,789C3A6B05F26DC5_052A40531E5135F0_7022_UN,9.011133,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,WFQVIMMLJNNMEY-BBRMVZONSA-N
C1(=C(C(=C(C=C1)F)F)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,980A90E128333553_EE3A6C1963B99B8D_7022_UN,9.011126,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,QEPFETXSZNHDRY-BBRMVZONSA-N
C1(=C(C(=C(C=C1)Cl)Cl)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,2A0D1C4B6CC6A84A_030B210BBDFB498B_7022_UN,9.011117,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,RHWRJRFMVNNPCI-BBRMVZONSA-N
CC(=O)CC1=C(C=C(C=C1)F)NCC2C3CCC(C2)C=C3,B155BF7AB3D77804_B99783B378E6328A_6041_UN,7.920978,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011000000011000010100000001001000000000110011110000000011010011111110101111110,AHRHWBVLAOHEAW-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NCC3N(C)CC4(CC3)CCC4,984C94084F946007_706F294C4D1AE835_6041_UN,7.65553,00000000000100000000001000000000000000000010000000000000000000100010000000010001001001110011010000101000010110011001101001100000110001110110001011011011010110101111010,PDPYGJBLIKNVTM-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NC2CCCC(C2)C3=CC(=C(C=C3)F)F)CC=C,9E8B0A58517F87FE_428EAADBB31E68A8_6041_UN,8.239691,00000000000000000000000000000000001000000010000000000000000000100000000000000000000000010011000000010000100100010000101000000100110001110000000011010011000110101111010,AXEYRXDUOLPNAL-UHFFFAOYSA-N
CN1CCNCC1C2=NC=CN2CC(CC)NCC3=C(C=C(C=C3)Cl)Cl,964549605BFD1C37_CDB114008C3DD588_6034_UN,8.358224,00000000000000000000000000000000000000100000000000000000000000100100000000010101101101110001010010101001100110010011101011100100110100100110001011011111010110101111010,GXFAYJXBPCHKLI-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3(CC3)C4CCC4,30D90E03D6660579_C2C2789DA258CC1A_6041_UN,7.9436646,00000000000100000000001000000000000000100010000000000000000000100110000000000100001000010011000000101100010110001000001001000100110001110100001011010111010110101111010,BJTDZEYVKNFUCP-UHFFFAOYSA-N
C[N]1C=CC2=C1N=CC(=C2)NCC3(CCOCC3)C4=CC=C(C=C4)F,DD7CB1514752B891_675602FCD4998243_6041_UN,7.3755913,00000000000000000000000000000000000000100010000000000000010000100110000000010101001101110011010010101100010101001000001011100100110011110110001001011001010111101111110,BMJREHJFEAOFTR-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CC3)C4=CC=C(C=C4)F,F7A1D034E89AB469_B43747A062DEB5E0_6041_UN,7.938038,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100000001110100001010011011000010101111010,CSXGQMJVCKFCTI-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=CC2=O)C[C@H]3[C@@H](CNC3)C4CC4,C3BA301640D5621D_C641D4F2271732BE_6034_UN,9.155918,00000000000000000000001000000000000000000000001000000000000000100100000000010000101101110011000011101100010100000100000011100101110000100110001101011011111110100111110,MZJJPBWTFPJWMI-WFASDCNBSA-N
N1CCCC2=C1C=C(C(=C2)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4)F,8DB372CA35B3FB90_1E144ADE894CCE18_6041_DP,8.09701,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101100110110010001101011100100110101110110001011011011010110101111010,ASXVMHVHBZVMMM-JXFKEZNVSA-N
FC2=C1C=CC=CC1=CC=C2NCCC4CCN(C3CCN(C)CC3)CC4,7BF22108A64A207C_B642F522E9491790_6041_UN,7.835289,00000000000000000000000000000000000000000010000000000000000000100000000000010000101001110001010000101100110100010001101011100100110001110110001011011011010110101111010,RDPKRDJSEIFFJY-UHFFFAOYSA-N
N1CC2CCC1CN2C3=CC=C(C=C3)N[C@@H]4C5=C(OC(C)(C4)C)C=CC(=C5)F,B1F5ED22A04B1000_BA630B9D2F348415_6041_DP,7.984976,00000000000000000000000000000000000000000010000000000000010000100010000000110001001001010011000001101100110100011101001011100100110111110110001011011101110011101111110,SYYUJDAIEDNENO-XTXLOEGASA-N
C[N]1C(=NC2=C1C=CC=C2F)NCC3C(CCCC3)C4CC4,0495910670DFB520_9E29E46997E43E6D_6041_UN,8.125507,00000000000000000000001001000000000000000010000000000000000000100100000000010101001101010011010010001100011110000000001011100100110001110100001011011011010110101111010,MWNUDHZTLACPFT-UHFFFAOYSA-N
CCOC(OCC)C5=NC1=C(N=CC(=C1)NCC3(CC2(CNC2)C3)C4=CC=CC=C4)[NH]5,9B841B3D344B433F_F9960B53EEB9B5E9_6041_DP,8.207298,00000000100100000000000000000000000000100000000000000000000000100110000000000101101100100011000110101100010001001010000011010110100101010110001001000101010111111111110,VHCRABHLLAYMIG-UHFFFAOYSA-N
N(CC1CC2CCC(C1)S2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,FA7F99E1A32BFBFD_1A0E3DBAB72A16AD_6038_UN,8.366161,00000000000000000001000000000000000010000010000000000000000000000100000000000000111100011011100011101100010100110010011011000100110000100100001011010011011110101111110,JPTWYFXXNMZOPC-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3C4CCC(C3)C=C4,14DD564CC044B8F7_C1229B89C0BBE97B_6041_UN,8.431504,00000000000000000000000000000000000000000010000000001000000000000100000000010000101100010011011010011100010100000000001011101100110001110100001001011001010110101111010,UIUFFPIEJVWITR-UHFFFAOYSA-N
BrC1=CC2=C(N=C1)N(C=C2C3CC3)CC(CC)C4=CC5=C(C=C4)CCCC5,87D67C7184C300BD_3B290664C2B0987B_6034_UN,8.047261,00000000000000000000001000000000000000100000001000000000000000100100000000010100000101010000000010101100010100000010101011100100110000100100001011011000010110101111010,ODVHHZFFHGCNGF-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NCC3(N2CC(C)(C)OCC2)CCCCC3,258C5C14A88F3C57_D4B2234B980F32F9_7022_UN,8.509956,00000000000000000000000000000000000000000010010000000000010000100010000000110001001001110011000100111000000111011001101011100000110011100110001001011101110111101111110,QGEVCBGNFQMPPD-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCCC3CCC(C)(C)CO3,06FE927F8577E4EA_9997DC7E5086DEA0_7022_UN,8.585821,00000000000000000000000000000000000000000010000000001000010000000110000000110000101100010001001011101000100101011001101011101100110011110110001011011111110111101111110,KODDDHIPCSUEDS-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(C3=C(C)N=C4C(=C3)C=CC=C4F)=O,E37D45367BB82020_0BDD45D16082624F_6038_UN,8.260247,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010011100001111100010100100000011001000100110000100100001011010011011110101111110,XPLFCSFAQWQPMW-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)NC4CC(C3=NC=C[N]3C)OCC4,6B4522EE52232655_8CEDE0C89076B896_6041_UN,7.594535,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010011010111100100110111010000001011100100110011110100001011011011110011101111110,CWHRPLGNMOXLJH-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CNCC3(C2)CCOCC3)F)CC4,598AA5ABE4E761FD_F4BBC288D14F649D_6041_DP,7.1512847,00000000000000000001000000000000000000000010000000000010010000000010000000010001101001110011010000101000110111011001101011100000110111110110001011011011010111101111110,NCEXHNDHARQBMR-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCCC3)C4=CC=CS4,65482182C80D4546_AE0A0DF6C0151F07_6041_UN,7.756354,00000000000000000000000000000000000010000010000000001000000000100110000000010000111100011011011010001100010100001000001011101100110001110100001000011001010110101111010,GJTGYPKRXXEMMH-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)N[C@@H]2CCCO[C@H]2C3=CC=NC=C3,D862305BFA82249C_8D5BB60D5F4A20B1_6041_UN,8.062467,00000000000000000000100000000010000010000000000000000000010000100100000000100000010100101011010110100000100001011000001011000100100011010100011011011111110011101111110,CELGJIWPDYAEFM-WBVHZDCISA-N
CC1(C)COC2=C1C=CC(=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,4C4354CE66A18841_24CDB67123C88F16_6041_DP,7.5392632,00000000000000000000000000000000000000000010000000000100010000100010000000100000101100110011000011101100110101011101001011000100110101110110001011010111110111101111110,LWZDQHAXGCHHLE-QFBILLFUSA-N
FC1=CC2=C(C=C1)N=CC(=C2)NCC3N(C)CC4(CC3)CCC4,E868C89B80BE87ED_34E328A92575786A_6041_UN,8.1823845,00000000000100000000000000000000000000000010000000000000000000000110000000010001001001110011010000101100010110011001101011100100110001110110001001011011010110101111010,JCNPHRXTRQSSDN-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C,5E5BB780E770E9D0_842FA25E626CB08B_6041_DP,8.371751,00000000000000000000000000000000000000000010000000000100000000100100000000000000101000110011000000101100110110010000001011000100110101110110001011010111010110101111010,AJSQXKOJHRSHOK-PKOBYXMFSA-N
FC1=CC(=C(C=C1)CC#N)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F,54264DF573DA09C7_924F6B81105D112F_6041_DP,8.146241,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,ZWUWQBAYMZTVLQ-DNVCBOLYSA-N
C2(=CC1=C(C(=CC=C1)Cl)S2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,EE8FA4F1A30BA9EE_64981C33C080BD62_7022_UN,8.062616,00000000000000000000000000000000000010000000000100001000010000100100000000010000111101111001011110101101010111010001101011101100110011110110001001011111110111101111110,DHZALUKEOOGFCP-RDJZCZTQSA-N
BrC1=CC2=C(N=C1)N(C=C2CC3=CC=CC=C3)C[C@H]4OC(C)(CNC4)C,6048944A184B877A_14374A142C8E3C73_6034_UN,7.999325,00000000000000000000000000000000000000100000001000000000010000000110000000110100101101110010000110101100010110001001000011100100100010100110001001001101110111101111110,CAISQFWNTOXOLE-SFHVURJKSA-N
C2(=CC1=C(C(=CC=C1)F)S2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,70289F32E4DFE833_838479C13F188F92_7022_UN,8.062627,00000000000000000000000000000000000010000010000100001000010000100100000000010000111101111001011110101100010111010001101011101100110011110110001001011111110111101111110,GFPCSKSIQNJLOT-RDJZCZTQSA-N
C[N]1N=C(C=C1NCC2(CCOCC2)C3=CC=C(C=C3)F)C4CCCC4,EBCCE6DECFD857DA_51CBB39ED9C8200C_6041_UN,8.06495,00000000000000000000000000000000000000100010000000001000010000100110000000010101101100110011011010101000000111001000001011101100110011110110001011011011010111101111110,JYTYACLGMGPBKV-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)F)Cl)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,30B2EEB608886FAB_15D111593F7D3368_7022_UN,8.992337,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,YFZGMCKSHLOCDB-BLVKFPJESA-N
C1(=C(C=C(C(=C1)Cl)Cl)Cl)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,A623F68A2F29E31B_8A56D095616F34A4_7022_UN,8.992341,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,VMPRJOAOLCIMPM-BLVKFPJESA-N
C1(=C(C=C(C(=C1)F)F)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,91BE900F18B16380_7161AA9A810E0A98_7022_UN,8.99233,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,NYSQPMNBYNVAQJ-BLVKFPJESA-N
C(C1CC2CCC1C2)=CC3=C(CC)OC4=C3C=CC=C4,5F88E497C5DA19CA_835E51084E704317_7019_UN,9.2484255,00000000000000000000000000000000000000000000000000000000010000000000000000000000000100000000000010010100010000000010001000000100110010000100000011010010100100001011110,UCSVIHDHAZYGMO-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCNC2)F)CC3,17EB2BA079104A55_DBBC6F29D73E6EFE_6041_DP,7.7899337,00000000000000000001000000000000000000000010000000000100000000000000000000010001101101110011010010001000100110010001101011100000110101110110001010011011010110101111010,MBLAOLIYINOYSS-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC5(CC4=C(C=CC=C4F)F)CCCCC5,6C17CFDB4EAB2772_2CEEFF833489135A_6041_DP,8.502033,00000000000000000000001000000000000000100010000000000000000000000110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010110101111010,AOFCBHJJLJOPRO-AQKKSAQBSA-N
FC2=C(C=C1C(=CN(C1=C2)CC3C(CNCC3)C4=CC=CC=C4)CC#N)F,E506E22882668F79_01BCBAEEA84D7CDE_6034_UN,8.09229,00000000000000000000000000000000000000000110000000000000000000100100000000010000001101110001000010101100110100010000001011100100110000100110001011011011010110100111010,STGGDKUKZZWMQD-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CC=N2)NC3CCN(C)C34CCCNC4,F2B7F21BC194256B_4DCD34AB839FE04B_6041_DP,8.563833,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,RHRJXHABMGCTRG-UHFFFAOYSA-N
CC1=C(C3=C(C=C1)N=C2CCCCC2=C3NC[C@@H]4CCCN(C)[C@H]4C5=CC=CC=C5)F,D27E4BDD7CF3FFF2_7E728BF4D4000C0F_6041_UN,7.438682,00000000000000000000000000000000000000000010000000000000000000100100000000010000101001110011010000101100010110010001101011100100110001110110001011011111010110101111010,DKPHZGPSXKSHBR-DCFHFQCYSA-N
CC1=C(C=C(C(=C1)NCC2CCCN2CC3=CC=CC=C3)Cl)C4CC4,34B9853661EF9BF8_F60AE24011213B64_7022_UN,8.318549,00000000000000000000001000000000000000000000000000000000000000100000000000010001001101110011000010001001000110010000001001100100110001110110001011011011010110101111010,OHXJATXSRAFQHX-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(C4=C(C)N=C3C=C(C=CC3=C4)F)=O,3DE6B5DCA201CD39_95ECCC55305CB8FB_6038_UN,8.272656,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010011100011101100010100100000011001000100110000100100001011010011011110101111110,MFNULKUZVXCXFG-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NCC2CCCCN2,83FB51B8ADF20E5F_5E6F0B7AAEDB1863_6041_DP,8.358115,00000000000000000100100000000010000000000000000000000010000000000100000000100001001000100011010000101000100000011000001011000000110101010110011001011101010110101111010,FPIVFMMWAXIKHQ-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,44D3242ADCB61E61_F6298AD78D03E919_6041_DP,7.5644007,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110101111010,ZWBVYLMEFYTZRP-FXAWDEMLSA-N
N1CC(C1)C2=NC=NC(=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,4E9BD2854BB6142E_3029224AC8D61C93_6041_DP,8.64051,00000000100100000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100000101110110001001011011010010101111010,ANEQVIHEISSKOE-QAPCUYQASA-N
FC1=C(C(=C(C=C1)F)CC#N)N[C@@H]2CNC[C@H]2C3=CC=CC=C3,B8D83287B62737B6_950E30134AA2F28F_6041_DP,7.810034,00000000000000000000000000000000000000000110000000000110000000100000000000000001101100110011000010001000100100010000000001000100010101110110001011000011010110100111010,RKEREARZJZPNGV-WMLDXEAASA-N
N(CCN1CC2CCC(C1)O2)C(=O)C3CCC3C4=CC(=C(C=C4)Cl)Cl,27C70F0AB661BA6F_A595643F7A132594_6038_UN,7.8748264,00000000000100000001000000000000000000000000000000000000010000100000000000010001001101110011100110101001110100110000011011100000110010100110001011011011111111110111110,QFFNMQBFODPYPK-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=NC=C1)NC[C@]23CC[C@H]2CCCN3,6EF07E2A979614E1_E2E9332F958527EF_6041_DP,8.308302,00000000000100000100100000000010000000100000000000000010000000000110000000100101001000100011010000101100110000011000001011000000110101010110011001011101010110101111010,HHZCBWASYOJIFM-SJLPKXTDSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3(CC3)C56CC4CC(CC(C4)C5)C6,7CC4E50C1CDFCC7F_FC2D5CBA4D510D1D_6041_UN,8.06285,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010010011010000100110100011000000011101100110001110100001001011001000010101111010,FGMKNKOJFOWBNH-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2N=C(C=CC2=CC=C3)Br)C4,AA391472676BC281_874674F87CE91EC6_6035_UN,8.166212,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000010111101100010100000101001001100111110000100100001101011110110111101111110,CVXPKYJJRNJUDF-QCUYGVNKSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2N=C(C=CC2=CC=C3)Cl)C4,FDDB875ECE569EAA_158DC3F73723BF63_6035_UN,8.166206,00000000000000000000000000000000000000000000000000000000000000000100000000100000000001110000010111101101010100000101001001100111110000100100001101011110110111101111110,BOETZOYETLAFMT-QCUYGVNKSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC(CC)C2CCOCC2)F)CC3,851811243AB17B5E_15533B25B251A4F8_6041_UN,7.559773,00000000000000000001000000000000000000000010000000000000010000000000000000010001100001110011010000101000100111010011101011100000110011110110001011011111010111101111110,PNJZUNBANMNBSU-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC3CC4(NCC3)CC4,B910E3B2F3079F60_7765FB78422BB773_6041_DP,7.860763,00000000000000000000001000000000000000100000000000001000000000100110000000010101101100000011011010101000110010011000001011101100110101010110001011011111010110101111010,UJJPTQILUFYLSP-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(C3=C(C=CC(=C3)C4=C[NH]N=C4C)F)=O,1F7356C9E0B6D02A_3625905DDC5312FE_6038_UN,8.497425,00000000000000000000000000000000000000000010000000001000000000100100010000000000101100010011101010011000010100100000011011001100110100100100001011010011011110101111110,WRMJRGLHTZHZRO-UHFFFAOYSA-N
CC1=C(C(=CC=C1)F)NC[C@@]23CCCN[C@H]2CCCC3,2C1FE2E50C7FAC04_1D9F78700C04CA75_6041_DP,8.88992,00000000000000000000000000000000000000000010000000000100000000000010000000000000101000010011000000101100110110011000001001000000110101110110001011010011010110101111010,BOQMPNUFBBPRGW-DOTOQJQBSA-N
CC1=C(C(=CC=C1)Cl)NC[C@@]23CCCN[C@H]2CCCC3,AC244EEA766B2EFD_A291B282C5DC90A5_7022_DP,8.889913,00000000000000000000000000000000000000000000000000000100000000000010000000000000101000010011000000101101110110011000001001000000110101110110001011010011010110101111010,WLAZYMXISQMOME-DOTOQJQBSA-N
N(C1=C2C(=CC=C1)CCOC2)[S](C4=C3[NH]C=CC3=C(C)C=C4)(=O)=O,12CF604C0E10102B_221F1050F33FCB3E_6029_UN,8.78712,00000000000000000000000000000000110000000000000000010101011111001101010001000000110100101011001011100110011001001000011011001100111111011110001011111001010011111111110,RXTFDRDNXSOURI-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC5COC4=C(C=C(C=C4F)F)C5,6BEDCCAB64D94587_9A00C2B6C8983402_6041_DP,8.500626,00000000000000000001000000000000000000100010000000000000010000000100000000000101100101010011010110100100110101010100101011100100110101110100001011011001110011101111110,ZFIFHGWHDYNGRD-VSDYLMMWSA-N
CC1=C(C=CC(=C1F)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F)C#N,092A2AAE84D6D6F7_764DE7F8BE84E9FA_6041_DP,8.049981,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010101111010,FGXOSWHJPARNGF-SJLPKXTDSA-N
CCNC4CCC1=C(C3=C(N1CC2CCSC2(C)C)C=CC(=C3)Cl)C4,0D7EC632DDB93ECA_FC3CEC74BB89A56E_6034_UN,8.039894,00000000000000000000000000000000000010000000000000000000000000000110000000110000011101011010000010001101110110011010101011100100110001100110011011011111010110101111010,GOAXVSOGZZZJRF-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=C[NH]2)NCC3CCCC(O3)C4CC4,9E5FF8EBDABFB67E_DD4226F66427B9BA_6041_UN,8.178759,00000000000000000000001000000000000000000000000000000010010000100100000000000001001100000011000110101100010010000000001011000100110111010100001011010011110111101111110,FDZKTPVALBWWTF-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NC(COC)C2CCCOC2,7F3795015B0E075A_249BB6606B53C6D8_7022_UN,7.6171565,00000000000000000000000000000000000000000010010000000000010000000000000000000000000000110011010101110000100101010001001000000010110010100110000001010001010111111111110,SQLYMNYEOUCYDZ-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)F)F)F)NCC(OC)C2CCCOC2,FD390FFE754835D0_61014608974BDEF1_7022_UN,8.2273035,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110101010100101000000111000000101000000010110011110110000011010011110111111111110,HBBWNJGNVSIGPX-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)Cl)F)NCC(OC)C2CCCOC2,737FF085F99DCEA8_8C300B1A49090CF7_7022_UN,8.227278,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110101010100101001000111000000101000000010110011110110000011010011110111111111110,QUAWTURAFBAHCH-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)F)F)NCC(OC)C2CCCOC2,E6B0F102651F46AF_8A116A42EAA3708C_7022_UN,8.227284,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110101010100101001000111000000101000000010110011110110000011010011110111111111110,MJPKHLMQOHKLIW-UHFFFAOYSA-N
BrC2=C1N(C=CC(C1=CC=C2)=O)CC45OC3(CCNCC3)C(C4)(N)C5,43F77BC8744BE01C_031989CB9832BB2F_6034_DP,8.333188,00000000000100000000000000000000000000000000001000000000010000000110000000010000001111110011000111101100110100011100001011100101110111100110001101011001111111110111110,HACGEEBQZUAKGM-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CC4(CN3)CC4,0474DC731BF9C640_812FC7A9B44D8055_6041_DP,7.864585,00000000000000000000001000000000000000100010000000000010000000000110000000000101001100010011000010101100110110011000000011000100110101110110001011010111010110101111010,GVMIZQGDWVBPDV-UHFFFAOYSA-N
N(CC2=NC1=C(C=CC(=C1)F)O2)C(CC4=CC3CCC(N3)C4)=O,8209C063DD6DDF11_F256A4A1BD99735B_6038_DP,8.410169,00000000000000000001000000000000000000000010000000100000010000000100000000001001001100010011100110111100110100110000011011000100110110100100001001010001111110110111110,GCZAXUOIYONXPD-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CCC3=C(CC2)C=CC=C3,B795E67B13EF68B7_E469161B01F4E177_6041_UN,7.5809608,00000000000000000001100000000010000000000000000000000000000000000100000000100001001000100011010000101100010000001000001001000100110001010100011011011111010110101111010,CGRXVIGJZZKIHD-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CCC2(CCCN2)CC3)F)CC4,C8CA6FEBF3FE3C7B_CFE11C298F64B229_6041_DP,7.6355534,00000000000000000001000000000000000000000010000000000000000000000010000000010001101101110011010010001000110110011001101011100000110101110110001011011011010110101111010,JROLGRDHBUFPSN-UHFFFAOYSA-N
NCCCC(OC2=C1NCCCC1=CC=C2)C3=CC=C(C=C3)F,79D8CE8054356C0C_FFD080F59FC451DB_6035_UN,7.879644,00000000000000000000000000000000000000000010000000000000000000000000000000000000001010010011000100101100110100010100001001000111100110110110001111010001110111100111110,JAEUVVXLLMWZDE-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC3=NC=C2CCCCC2=C3,BD174310A7795643_B28DDE4DCF119D70_7022_UN,8.052954,00000000000000000000100000000010000000100000000000000000000000000100000000100100000000100001010000100100010000001000001001000100110001010100011011011101000010101111010,UPRDHUAXEUDWNO-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2C3=C(CCN2)C=CC=C3,F75A3BE5781D5C49_8FD3254F8E0B2AF4_6041_DP,7.628437,00000000000000000000100000000010000000000000000000000010000000000100000000100001001000100001010000101100110000011000001011000100110101010110011011011111010110101111010,UIUJWGUDZWCIEP-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)COCC2)[S](C3=CC=CC4=C3[N](C)C=C4)(=O)=O,27CA4F8CA235D714_22F3219F70D3BD54_6028_UN,8.634187,00000000000000000000000000000000110000000000000000010001011111001101010001010000110101101001011011100110011001001000011011101100111011011110001011111001010011111111110,JECNULHARAVJHT-UHFFFAOYSA-N
NCCCC(OC1=CC=C(C=C1)C2CNC2)C3=CC=C(C=C3)F,76950EECAC3C3044_7DEF8E370D9961E4_6035_UN,8.450084,00000000100100000000000000000000000000000010000000000000000000100000000000000000001010110010000000001000100100010100001001000111000110100110001101010001110101100111110,ZZUAXCACYRUEJL-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2=NC(=N[N]2C)C3CCCNC3)Cl)C4CC4,EF74F301C8FC63F6_02C19D81F31F07C2_7022_DP,8.207369,00000000000000000000001001000000000000100000000000001000000000100100000000010101101100110011011010101001101110010000001011101100110101110110001011011111010010101111010,AEQNOEQJWVUXMI-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CCCC3(C2)OCCO3)F,AB502B4655CC0DB9_233544C2B97152C2_7022_UN,7.6934967,00000000000000000000000000000000000000000010000000000000010000000000000010100000001101110011010010001000010101001001001010110000110011110110001011011111110111111111110,UYDVWJYUGJZAIZ-UHFFFAOYSA-N
O[C@H](CF)C1=CC(=CC=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,B3CD2A821D65F566_42F4DF5C820C7D4C_6041_UN,8.617761,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101000011011010101000100000010000001011101100110111110111001011011011110111101111110,YVJXRILWUUTCMZ-HBGVWJBISA-N
CCN5CCC1=C(C(=CC(=C1)N[C@@H]3CCN(C2CC2)[C@H]3C4=CC(=C(C=C4)F)F)F)C5,B3FA3FFE4F8EEC02_D1ABD7A7048872D7_6041_UN,8.719644,00000000000000000000001000000000000000000010000000000000000000100000000000010001100101110011000010101100110110010010101011100100110001110110001011011011010110101111010,UACTXPXCJLLUEF-RPWUZVMVSA-N
CC1=C(C=CC=C1F)NCC2(CCCCC2)OC3CCCC3,89FBAFFAB5C1B8A2_19FFF398910690D6_6041_UN,8.093512,00000000000000000000000000000000000000000010000000000000000000000010000000000000001000010011000110001000000110001000001000000011110011110000000111010011110111101111110,PGVJYZRWMBNHPE-UHFFFAOYSA-N
O[C@H](CBr)C1=C(C=CC=C1)NC23CC(C)(C2)OC34CCOCC4,7E09A6BFBEF73206_7D053207E61C4432_6041_UN,8.429553,00000000000100000000000000000000000000000000001000000100010000000010000000000000000100100111000111100000110011011001001010000000110111110111000011110011110111111111110,QONDYQUGPUQIPQ-KLAILNCOSA-N
CCC[N]1C=C(C(=N1)C2CC2)NC4(CC3=C(C=CC=C3F)F)CCCCC4,BD94E0DA6592C6CF_99E2E535CEBE6B74_6041_UN,8.165513,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011001010001000100100011011001011101100110001110100001011011011010110101111010,IVRIWERJQPYMNR-UHFFFAOYSA-N
C2(=C1C=CC=CC1=CC=C2Cl)NCC3N(C)CC4(CC3)CCC4,8F0E7C4CAE1B7FE8_D6DE4B5D8F62A0D8_7022_UN,7.872955,00000000000100000000000000000000000000000000000000000000000000000010000000010001001001110011010000101101010110011001101001100100110001110110001011011011010110101111010,HYEUKVDHZJLZEZ-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NCC3CC3(C)C4=CC=CS4,6246A8D4A9F3C0AD_567F0A91F8DE9E03_7022_UN,7.943141,00000000000000000000001000000000000010000010000000000000000000100010000000000000011100011011000010001000000110001001100000000100010001110100000010010011010110101111010,JYNCSMUORHUNFY-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NCC3CC3(C)C4=CC=CS4,139357708A99271A_A2BFF89CB09D3FBC_7022_UN,7.9431424,00000000000000000000001000000000000010000000000000000000000000100010000000000000011100011011000010001001000110001001100000000100010001110100000010010011010110101111010,FBIULXWLBINIOX-UHFFFAOYSA-N
CN(CC1CCNCC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=C(C=C(C=C4)F)F,DC3D585143A0BF42_9A79B727F50E9287_6041_DP,8.40391,00000000000000000000001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010001001011100100110101110110001011011011010110101111010,QWJBQSFZBYRRIP-FUHWJXTLSA-N
CN5CCCN(CC1=C(C=C(C=C1)N[C@@H]2C4=C(OC3(C2)CCCC3)C=CC(=C4)F)F)CC5,F03EB27A15496C26_2C5A587BE9261130_6041_UN,7.864056,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110001010011101100110110011101101011100100110011110110001011011011110111101111110,NNLMTRBCAFYGKB-DEOSSOPVSA-N
CC1=C(C=C(C(=C1)NCC4=CC2=C([N](C)C(=N2)C3CC3)C=C4)Cl)C5CC5,387559777C8965FE_F2C179B01AE272D6_7022_UN,8.075539,00000000000000000000001000000000000000100000000000000000000000100100000000010101001101010000010010001101010110000000001011100100000001110100001011011111010110101111010,HZCIKBHPCLGZCW-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3CCC2(CCNCC2)CC3)F)CC4,BA96E43921134147_E02285CE1092EB0F_6041_DP,7.769739,00000000000000000001000000000000000000000010000000000000000000000010000000010001101001110011010000101000110110011001101011100000110101110110001011011011010110101111010,GRSZKXGZTSJHOL-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CCC2(CCNCC2)CC3)F)CC4,05342A9A0A9D1CD5_2E709C5DBA2F4E29_6041_DP,7.726504,00000000000000000001000000000000000000000010000000000000000000000010000000010001101001110011010000101000110110011001101011100000110101110110001011011011010110101111010,HBKYRJGXOSEDPR-UHFFFAOYSA-N
[NH]1C=CC2=C1C(=CC=C2)SC(C4=CC3=C(CCN3C)C=C4)=O,C7846EDDB0993516_BA07B4AE4BD0B295_6038_DP,9.156095,00000000000000000000000000000000000000000000000000000000000100001100000000010000010101101000010010001100010010010001101011100100000000010100001011011001011010101111110,VGUWKTALKFZWIL-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NCC4O[C@@H]3CCCC[C@H]3C4)C,088998F1E63BDA6F_80F5AF2FBE3BA0F6_6041_UN,8.216393,00000000000000000000000000000000000000000010000000000000010000000100000000000000101100010010000110101100010110000000001011000100110011110100001011010111110111101111110,IDLQRLYEUVHBGX-BZELLKQSSA-N
SC1=C(C=C(C=C1)C#N)NC(C2CNC2)C3=CC=C(C=C3)F,03D1F579F1C60DFA_2111A8602FAE3ED5_6041_DP,7.568962,00000000100100000000000000000000000000000110000000000110000100001000000000000000111000111010000000001000000100000000000001000100000101110110001011000011010010100111010,WYNPUZYARFMEMN-UHFFFAOYSA-N
FC1=CC5=C(C(=C1)C=CC3=CC(=C2OCCCOC2=C3)C4=CC=N[N]4C)OC(OC5)C6=CC=CC=C6,5E7A622E9DCF37C8_DCAF4AFB76214F99_7019_UN,8.548086,00000000000000000001000000000000000000000010000000001000010000100100000010010000100100010100011011110100010101000100001011111100000010100110101011111010110011111111110,GNFOFEXCGHOHGY-UHFFFAOYSA-N
CC1=C(C=CC(=C1)F)NC2CCN(C)C23CCCNC3,50EF22F08291265E_04383642FE3CF14E_6041_DP,7.9514966,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101110011010010101000110110011001101011100000110101110110001011011111010010101111010,RXQNKBVNYGUGOH-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC5(CC4=C(C=CC=C4F)F)CCCC5,E45B6FD2557880BB_963940AABB3002DB_6041_DP,8.559703,00000000000000000000001000000000000000100010000000000000000000000110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010110101111010,ZSFNDAIAGMJHDO-GWTOYCKXSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3(CNC3)C4=NC=C(C=C4)F,CB4022E43D29C3DB_429F6218B5171655_6041_DP,7.887288,00000000100100000000000000000000000000100010000000001100000000100110000000010101101101110010011010101000000110001000000011101100100101110110001011001111010110101111010,SQIGBIAZKRFQHM-UHFFFAOYSA-N
N(C1=CC=C(C=C1)N2CC3CCC(C2)O3)C(=O)C=CC4=CC(=C(C=C4)F)F,6A042E1EDF85784A_0EA31FC5FC6182D6_6038_UN,7.59615,00000000000000000001000000000000000000000010000000000000010000100000000000010000000101110000100110111000010100100000011011100100110011110110001011011011111011110111110,ZLBYUJRAYPANML-UHFFFAOYSA-N
N(C1=CC=C(C=C1)N2CC3CCC(C2)O3)C(=O)C=CC4=CC(=C(C=C4)Cl)Cl,47EFA1796F6E38E1_035A9811FF27B0C8_6038_UN,7.596151,00000000000000000001000000000000000000000000000000000000010000100000000000010000000101110000100110111001010100100000011011100100110011110110001011011011111011110111110,LJQXUEMONGFBPM-UHFFFAOYSA-N
FC2=C1N=CC(=CC1=CC=C2)NCC3CCCN(C)C3C4=CC=CS4,544869483822512D_384D3E81D2A8E15C_6041_UN,8.578969,00000000000000000000000000000000000010000010000000000000000000100100000000010001111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,RCRUCXGHCJAFSA-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@@H]3CNCC(O3)(C)C)Cl,CF9C11085DFEAE1A_8DD0EB27C6232836_6034_DP,8.7099285,00000000000000000000000000000000000010000000000100000000010000000110000000110110111101111011000110101001001110001001000111100100100111110110011011001111110111101111110,JDFHANKHDGFBOC-AWEZNQCLSA-N
C(C[C@]12C[C@H]1CCC2)=CC3=C[N](C)N=C3C4=C(C=CC(=C4)F)F,5F158EC2B0625E86_8AD7AF61A3BC2A15_7019_UN,8.105613,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001011011010000110101111010,KNVIKTGYXQZGEG-KUHUBIRLSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3(CC)CNCCC3)Cl,91B050D3A2C79E7B_67F74682AD97A16C_6034_UN,8.330248,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101111011000010101001101110011010101111100100110101110110001011011111010110101111010,WTGYBHDCOBRYAT-UHFFFAOYSA-N
N3[C@@H](COC1=C(C=C(C=C1)CN2CCNCC2)Cl)COC3(C)C,2ED38A8512CF4C63_68D538EF182A17F5_6035_DP,8.392743,00000000000000000000000000000000000000000000000000000000010000000000000000110001001101110111100110101001100111111100111011100011110100100110001111011111110111111111110,FKLXWCZYGLIDGJ-AWEZNQCLSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CC4(CCC3)CC4,C47C94C10350006B_DBD66775B3C1F0C8_6041_UN,7.323139,00000000000000000000001000000000000000100010000000000000000000000110000000000100001000010011000000101100010110001000001001000100110001110100001011010111010110101111010,RLEYKCPLBOWYQG-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NCC3CCCC(C)CC3,BDDA902C77B5883C_90DF1EED7B1BD5CA_6041_UN,8.147124,00000000000000000001000000000000000000000010000000000000000000000100000000000000101000010011000000101100010110000001101001000100110001110100001011010111010110101111010,KBNYSQRHORJGFL-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C,E94A0B9B1961ED01_114B490ACF54DA08_6041_DP,8.370611,00000000000000000000000000000000000000000010000000000100000000100100000000000000101000110011000000101100110110010000001011000100110101110110001011010111010110101111010,UXTUUQOLGDWKGC-FXAWDEMLSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NC34COC(C)(C3)CCC4,07A2FBAE3854882B_DB5F6FD8A64EA252_7022_UN,6.798071,00000000000000000001001000000000000000000000000000000000010000100010000000000000000100010011000111000001110111011001101000000000110011110100000011010011110011101111110,IWLKGMKASSQXOL-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NC34COC(C)(C3)CCC4,BCBCDC7309D15141_2F9F9DD5EE0D03ED_7022_UN,6.7980537,00000000000000000001001000000000000000000010000000000000010000100010000000000000000100010011000111000000110111011001101000000000110011110100000011010011110011101111110,FZFIXYDRKKQTFK-UHFFFAOYSA-N
FC2=C1SC(=NC1=CC=C2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,59C8BF0154945390_B33AC2FB6746D7A9_6041_UN,8.437794,00000000000000000000001000000000000010000010000100000000000000000110000000100100011100011011000010001100011100001001101011000100110001110100001011010101010110101111010,CVRLXVQZHGFDPI-UHFFFAOYSA-N
C1CC(CCN1)C3=CC2=C(C=CC=C2)N3C[C@H]4[C@@H](CCNC4)C5=CC=C(C=C5)F,1CD4CDFADE3F47CA_8F3E91FFC9759926_6034_UN,8.913928,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010101100110100010000001011100100110100100110001011011011010110100111010,VMJNKMZYJWXXGZ-GMAHTHKFSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,4EEE4D963493919E_D2480FFF3D98E7AF_6041_UN,8.202964,00000000000000000000001001000000000000000010000000000000000000100100000000010101101101010011010010101100011110010000001011100100110001110110001011011111010110101111010,HVNLSRNMMBNWJB-VLIAUNLRSA-N
FC1=CC2=C(N=C1)C(=CC=N2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,FDD4ED80E0E6657F_B57F3A882518A911_6041_UN,8.159732,00000000000000000000001000000000000000000010000000000000000000000110000000100001101000010011000000101100010100001001101011000100110001110100001011010101010110101111010,VVGOACVADHGGDY-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C3=CC(=N[N]3C)C4=CC=C(C=C4)F)=O,94C5C86C1D9C8EF6_55552B43DC6DCF67_6038_UN,8.026439,00000000000000000000000000000000000000000010000000001000010000100100000000010001101100010001111111001000110100110000011011101100110010100100001011011011111111111111110,AVGJPGQWDQMZTL-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CC3)C4=CC(=CC=C4)F,0C2B7A7790B0B263_DF2FF39B63950E99_6041_UN,7.81994,00000000000000000000001000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100010001110110001001011011010110101111010,OBSWZSSXULTJQU-SFHVURJKSA-N
C1(=CN=C(C=C1)C2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,253B8ABB14358EA4_F8F8E0B72EAA42B8_6041_UN,7.772243,00000000000000000000000000000000000000000010000000000000010000100100000000010001100101110011010010101000100111010001101011100100110011110110001001011011010011101111110,UTKSXSZCHLSIDI-RTWAWAEBSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2CCO[C@H]2C3=CC=CC=C3)Cl)C4CC4,0C8FE0A53FF6EABB_AAD93FD38047257B_7022_UN,8.494383,00000000000000000000001000000000000000000000000000000000010000100000000000000000001100010011000011001001000111000000001000000100110011110110000011010011110111101111110,FNEGJGOIGSAKAV-UWJYYQICSA-N
C1(=C(C=C(C(=C1)F)C#N)F)NCC(C2CCNCC2)C3=CC=CC=C3,5FA0329F7C49833C_658DEDA8E230AAAD_7022_DP,8.061535,00000000000000000000000000000000000000000110000000000000000000000000000000000000001000110001000000101000100100010000001001000100110101110110001011010011010110100111010,AURFQWYBWNJVRQ-UHFFFAOYSA-N
COCC[N]1C=CC2=C1C=C(C=C2)NCC3(CCCC3)C4=CC5=C(C=C4)OCCO5,17B715392D8A956C_4C0923CA3B138D2A_6041_UN,7.747511,00000000000000000000000000000000000000000000000000000000010000100110000010010000101101100011010110101100010001011101101011100110110011010110001011111001110111111111110,LRYFSIIVBZBXCV-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)NC[C@H]2CNCC(O2)(C)C)C#N)F,DD490F885874912D_11679E554F308EB9_6041_DP,8.641805,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110001011000111110111101111110,OQYQFYYXEDZQNS-SNVBAGLBSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CCCC(O2)C3CC3)F,0060B7FC4581EEF0_08D46AF8EB4E8ED9_7022_UN,7.628821,00000000000000000000001000000000000000000010000000000000010000100000000000100000001001110011010100101000000100000001001000100000110011110110001011011111110111101111110,UEPVBYBQDVJHPO-UHFFFAOYSA-N
CC1=C(C3=C(C=C1)N=C2CCCCC2=C3NC(CC)CC4=C[N](C)C5=C4C=CC=C5)F,A3D8D8AD0BF2015B_19B7874D87F2F3BB_6041_UN,7.748308,00000000000000000000000000000000000000000010000000000000000000000100000000010000100101010011010010100100110110010010101011100100110001110100011011011111000110101111010,RLCKIHREVYWTGH-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CNCC(C3)(C)C)Cl,3552BFFE855E512C_CBFB5C543A1ADB0F_6034_DP,8.405777,00000000000000000000000000000000000010000000000100000000000000000110000000110110111101111011000010101001001110001001000111100100100101110110011011001111010110101111010,BHEBRQXWKNGKST-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@H]3CNCC(O3)(C)C,7811184D2F3CEFEB_0F058DA1DEBD6F47_6041_DP,8.146216,00000000000000000000000000000000000000100010000000000100010000000110000000100100101000110010000100101100010110001001000011000100100111110110011011000111110111101111110,YGDANRCHBJKOGB-CYBMUJFWSA-N
N(CC1=CC2=C(C=C1)COC2)[S](C4=CC3=C(C=C(C)[NH]3)C=C4)(=O)=O,EA2CE0C9FCEA5D06_C5A4A5F820D8DAA4_6029_UN,8.921644,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100101000001010001110011001001000010011001100111100001110001011101001010111111111110,LOZAAGKCHDLYRN-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC4O[C@@H]3CCCC[C@H]3C4,BDDDBE18465E2408_2F03B99A16F6246F_6041_UN,7.7482367,00000000000000000000000000000000000000100010000000000000010000000100000000000100001100010010000110101100010110000000001011000100110011110100001011010111110111101111110,QJPWUSMYCDCYFU-YWQITRNNSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCCCC23CCNC3)F)CC4,6E4D881C1B2DC4E7_4097B6F60C4F38A4_6041_DP,7.529652,00000000000000000001000000000000000000000010000000000100000000000010000000010001101101110011010010001000110110011001101011100000110101110110001011011011010110101111010,FDVVZXCKSKGSLU-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CC2CSCC(N2)C3=CC=CC=C3)C(=CC(=C4)F)F)C5,2FFDC14E74DDD17C_0345AE34C5BD13F0_6034_UN,8.558489,00000000000000000000000000000000000010000010000000000000000000100110000000110001000101111001000010101100110100011001101011100100110000100110001011011101010110101111010,NAMFALAKGMQWED-UHFFFAOYSA-N
CC2=C1N=CC=C(C1=C(C=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5)F,3907DC4E449B208B_07C047070DD7B1AF_6041_UN,8.152515,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011111010110101111010,PJVLNPHDGNIUKM-MWTRTKDXSA-N
CC1=C(C=C(C=C1)F)NCC3OC2(CCC(C)(CC2)C)CC3,114CCAE58666A521_56B02C15A072F411_6041_UN,7.701576,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010011000110001000010110001001101000000000110011110100010011010111110111101111110,JBGDKEYAGPXBCQ-UHFFFAOYSA-N
N1CC2CCCC1C2C=CC3=C[N](C)C4=C3C=C(C=C4)F,FBD2863AC004C0DD_E0FD249C22BD0320_7019_DP,8.11413,00000000000000000001000000000000000000000010000000000000000000000100000000010000001101010011010010011100110100010000001011100100110000100100001001011001010010101111010,SUQCDBNQLNFWID-UHFFFAOYSA-N
CC1=C(C=C(C=C1)Cl)NCC3OC2(CCC(C)(CC2)C)CC3,043EE2210E7DCDD0_4D3852FDDAE5B066_7022_UN,7.7015576,00000000000000000000000000000000000000000000000000000000010000000010000000100000001100010011000110001001010110001001101000000000110011110100010011010111110111101111110,WQLGJAQMBMFEIU-UHFFFAOYSA-N
O=[N](=O)C2=C1N=CC(=CC1=CC=C2)NC4=C3OCCCC3=CC(=C4)F,7A1A3DB225DB50BC_A797D2E3C9C034EB_6041_UN,8.105139,00000000000000000000000010000000000000000010000001000000110000010100001100000001000000010001001101100110010101000100001111101100101011110100001011111001110011110111110,YCLCYARMCYKOEU-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCCC23CCNCC3)F)CC4,7DA0CBE5281DB18E_301265CF2EB45328_6041_DP,7.590893,00000000000000000001000000000000000000000010000000000000000000000010000000010001101001110011010010101000110110011001101011100000110101110110001011011011010110101111010,SARDPSUEEZCHOR-UHFFFAOYSA-N
C1NCC1C3=NC2=C(C=CC=C2)N3CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,9135057EFEB11109_836A577B48B3B887_6034_UN,8.229649,00000000100100000000000000000000000000100000000000000000000000100100000000010101101101110010000010001101110110010010100011100100110100100110001011001011010110101111010,XNPAZCAVXBUCFA-UHFFFAOYSA-N
CCCC(NC(=O)CC1CC2CCC1O2)C3=C(C=C(C=C3)F)F,77E50894CC963DAA_9F636BA646E6D216_6038_UN,8.12043,00000000000000000000000000000000000000000010000000000000010000000000000000000000000100010011100010000000110100110011011000000000110010100100000011010011101111111111110,LSCVPBVFAMPQLR-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=CC2=O)C[C@]34CNC[C@H]3CCCC4,3972ABC4CC5C87D0_308836395453B3A4_6034_UN,8.975761,00000000000000000000000000000000000000000000001000000000000000000110000000010000101101110011000011101100010100001100001011100101110000100110001101011001111110100111110,BDACLVFBWCECTM-ACJLOTCBSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=C(C)C=CC(=C2)C3=NN=C4CCCCC[N]34,BD93371E52297C80_CE47CC4646C3476D_6041_UN,8.092074,00000000000000000001100000000010000000100000000000001000000000100100000000100101100101100000011010101100010000011000001011101100110001010100011011011111010010101111010,RCVVHKLGHIWARI-UHFFFAOYSA-N
N3C[C@@H](OCCCC(C1=CC=C(F)C=C1)C2=CC=C(C=C2)F)[C@H](CC#N)C3,9E05FEF3E757EF59_81E86B1CC79FD24B_6039_DP,8.3416,00000000000000000000000000000000000000000110000000000000000000000000000000000000001100110011000111001000000101010000001001000111110010100110001101010011110101100111110,FBKQMEPXUWAUHA-XMSQKQJNSA-N
FC2=C1OC=CC1=C(C=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,0EF68B88795F09A0_9886D0FBC3C93C2D_6041_UN,8.8372555,00000000000000000000001000000000000000000010000000000000010000100100000000010101101101010011010011101100010100010000001011100100110001110110001011011011110110101111110,ODJBIHMPIQPJRR-VLIAUNLRSA-N
C[N]1C=NC(=C1)C2=CC=C(C=C2)NC3C4CC5CC3CC(C4)(F)C5,0B050A5AEA8A755E_FD84D06B2B848C29_6041_UN,7.822566,00000000000000000000000000000000000000000010000000000000000000100110000000010101000101010010010010000100010100001000000011100100100001110100001001001001000010101111010,JPUUYQMDOKAEAQ-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)OCCC2)C(C4=CC3=C(C=C[N]3C)[NH]4)=O,9524C9F17B69526A_A8B482D25D26EC45_6038_UN,8.554201,00000000000000000000000000000000000000000000000000000010010000000100000000010001100101000001110110100100010001100100011011100100100111010100001011011001111011111111110,FMFKOHSTWYYKNQ-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)C5=C4OC=CC4=CC=C5F,375DF9A021AF431E_9B354EF9708BE543_6006_DP,8.628986,00000000000000000001000000000000000000100010000000000000010000100100000000000101100101010011010011100100110100010000101011100100110001110100001011011011100010101111110,ZKWNMRBQEOGLFK-QDMKHBRRSA-N
N4C[C@@H]3CC[C@@H](OCCCC(C1=CC=C(F)C=C1)C2=CC=C(C=C2)F)[C@@H]3C4,651F9925154A86FD_BB743B2484269FA3_6039_DP,9.121591,00000000000000000000000000000000000000000010000000000000000000000000000000000000001100110011000011001100010101000000001001000111110010100110000101010001110101100111110,OASFISYSRPPLTR-CDNPAEQRSA-N
O(CC1OCCC2=C1C=CC=C2)CC3=CC4=C(C=C3)NC(=O)O4,728E0D8D3B73346A_49A685BE8B142DCE_6039_UN,8.641113,00000000000000000000000100000000000000000000000000000000010000000100000010000000000100100000000110100100011001100100011011010111110010000110100111110001111111010111110,DGHSAGMRYCJJQL-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,D757A01E98527E59_E49B2A9BB1DB5B32_6041_UN,7.83372,00000000000000000000000000000000000000000010000000000000000000000000000000000000100001110011010010001100010110010001101000100100110001110000001011011011010110101111010,KKPYVLATVDJKRM-UHFFFAOYSA-N
C(C1(CC=C)CC=CC1)=CC3=CC2=C(C=CC(=C2C)C)[NH]3,32F9B160861DA7C7_AB3BAAB884E2E757_7019_UN,8.533524,00000000000000000000000000000000001000000000000000000000000000000110000000000000000100000000000010010100010000001000000001000100010000000100000010000111000110001111010,JACCEQVZFIDAMX-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C3=C2CSCC3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,0A6F2BD8FE007C46_B416ED71C01B99F5_6034_UN,8.6876335,00000000000000000000001000000000000010000000001000000000000000100100000000010101100101111000010010101100010100010000001011100100110001100110001011011010010110101111010,YFMZSMZVRYTTMY-GYCJOSAFSA-N
CC1=C(C=NC=C1N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F)C#N,9A85F058E65A1D44_3AF86DFCEE2FCFBA_6041_DP,7.3045278,00000000000000000000000000000000000000000110000000000010000000100100000000000001101000110011000000101000100100010000001011000100110101110110001011010011010010101111010,POUQSEOLVKFZEF-SJLPKXTDSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC3O[C@@H]2CCCC[C@H]2C3,77C88D38B90978CB_9C9623B04C9F6A94_6041_UN,8.016342,00000000000000000000100000000010000000000000000000000000010000000100000000100001001100100010010110101100010000001000001011000000110011010100011011011111110111101111110,WCJIJSAIYWMHII-XWDNMSNZSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC3CNCC34CCOCC4,E23708AFD12B3026_7A42B60C54DF0F93_6041_DP,7.4707384,00000000000000000000000000000000000000100000000000001110010000100110000000010101101101100011011010101000110001011000001011101100110111010110001011011111010011101111110,XUYDJMPZFQMESU-UHFFFAOYSA-N
N5CCC1(CCC1)C(C=CC4=CC2=C([N](N=C2C)C3=CC=CC=C3)N=C4Cl)C5,7111E80B21225132_6B03292F414892B7_7019_DP,8.151438,00000000000100000000000000000000000000100000000000001000000000100110000000010101101100110001001010111101110100011000001011101100110001110110001011011011010010101111010,PXVLLFIIEUPIEP-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2C=CCCCC2,FB53B491598F4F4B_06FC45F9A6BC6CA9_6041_UN,8.335305,00000000000000000101100000000010000000000000000000000000000000000100000000100001001000100011010000111000000000001000001001000000110001010100011010011111010110101111010,FKJWQXDTVJHNKS-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NCC2=CC=CC(=C2)CN3CCN(C)CC3)C4OCCO4,956DD085A70F016F_93DFDD878D895938_6041_UN,7.6664414,00000000000000000000000000000000000000000010000000000000010000100000000010010001001101110000010010101000000101010001101011110100110011110110001011011011010111111111110,VSHBRPVZSYZSIP-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)OCCC2)[S](C4=C3[NH]C=CC3=C(C)C=C4)(=O)=O,2C3D0A3B00B423E0_BE8229157C210C58_6029_UN,8.989892,00000000000000000000000000000000110000000000000000010101011111001101010001000000111100001000001011101110011001001100011011001100101110001110001011111001110111111111110,JRNJDPSXGUZRSR-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)N[C@H]3[C@H](CCNC3)C4=CC(=CC=C4)F,42F2E87E0B70E57F_7759261BA6D469ED_6041_DP,7.918154,00000000000000000000000000000000000000100010000000000010000000100100000000010101101101110011010010101000100110010000001011100100110101110110001011011011010010101111010,RXTUTFINRZQHMG-GVYDCBATSA-N
N(CCC1CC2CCC1O2)C(C4=CC3=C(C)C=C(C=C3[NH]4)F)=O,506FD03F347EB984_334F561D97DCACA0_6038_UN,8.151823,00000000000000000000000000000000000000000010000000000010010000000100000000000001001100010001100110001100110100110000011011000100110110100100001001010001111111111111110,NIOCQTVNWCRKCY-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,FF1C0265525D2EA7_8480D4ED10FC55E2_6041_UN,8.580715,00000000000000000000001000000000000000100011000000000000000000100100000000010101101101010011010010101100010100010000001011100100110101110110001011011011010110101111010,DDTOXLFORRCFKN-VFNWGFHPSA-N
CC1=CC2=C(C=C1)C(=CN2CC=CC3=CC(=CN=C3)Br)C4CCNCC4,7749CB5E36B7CB96_24ABBEFD45EB66DC_6034_UN,8.657066,00000000000000000000000000000000000000000000001000000000000000100100000000010000001101110001000010111100110100010000001011100100110000100110001001011001010110101111010,SDJSETCOXUBXPE-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CC(=N2)NC(CC)C3CCCCC3,88B50421B1E32DEA_C598287049A19E05_6041_UN,7.959595,00000000000000000000000000000000000000100010000000000000000000000100000000000100000000010011000000100100110110010010001001000100110001110100001001010001000110101111010,VDCYRDIDEXCYFX-UHFFFAOYSA-N
C2(=C1[N](N=CC1=CC=C2)C3CCCCO3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,6E937E96DBCF3D14_C5EB50A5FC2EE85E_6041_UN,8.039173,00000000000000000000000000000000000000000010000000001000010000100100000000010001100101110011111110101100110111110001111011101100110011110110001001011011010011101111110,RZBFOLVXUNFQNQ-QFMSAKRMSA-N
FC1=CC2=C(C=C1)C(=CC=N2)NC(CC)C3CCCCCC3,A59ADF3FA8F547D3_CD10E4B7CBC8FE61_6041_UN,7.736504,00000000000000000001000000000000000000000010000000000000000000000100000000000000100000010011000000100100110110010010001001000100110001110100001001010001000110101111010,FTJGSWCYJOAUIJ-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)C=CCCC3=NC2=C(CCCN2)C=C3,FFC3453F709E1214_4271552ED3D28B45_7019_DP,7.779864,00000000000000000000100000000010000000100000000000000000000000000100000000100100001000100011010000111100110000011000001011000100100000010100011011011101010110101111010,YFEWANGVPTZLKV-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3(F)CNCC34CCC4)Cl,774606F4DAC3869A_5961AD0A6050E5AA_6034_UN,7.8662534,00000000000100000000000000000000000010000010000100000000000000000110000000010110111101111011000010001001011110001000001111100100110101110110001010011011010110101111010,RBMYJOMNIPNYQW-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC(C2=NC=C[N]2C)C3CCOCC3)F)CC4,B9ED2F2D2539D488_3780947D2B168B2F_6041_UN,8.071846,00000000000000000001000000000000000000100010000000000000010000000100000000010101100101110011010010101000000111010001101011100100110011110110001011011111010111101111110,ZDUWPQSJSRVAIB-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=NC=C1)NCC3=C2CCCCC2=CC=N3,1515ADA3CA8C277A_C279823E0FD47505_6041_UN,8.245281,00000000000000000100100000000010000000100000000000000000000000000100000000100101001000100001010000101100010000011000001011000100110001010100011011011101010110101111010,XCWWXFNICFJSQP-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CCC2CNCC2)C=CC(=C3)C)C4,5AB196528131EB1C_72B7A159CF1813F6_6034_UN,8.845488,00000000000000000000000000000000000000000000000000000000000000000100000000010000001101100011000010001100110010010010101011100100110000000110001011011101010110101111010,YHFLLLPJLKHBJQ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C(CCCC2)N3CCCC3)Cl)C4CC4,7E3BB14C8026B38B_339428B268A2B6F0_7022_UN,7.4261293,00000000000000000000001000000000000000000000000000000000000000100000000000010000101101110011000010001001000110010000001001100000110001110110001011011011010110101111010,KXRRQZVPDHSZHM-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NCC3C(CC)CCCC3,C90CA55E4FC1FDC6_87AD1AF046AE6F9E_6041_UN,7.510577,00000000000000000000001000000000000000000010000000000000000000100000000000000000001000010011000000001000000110000010101000000000110001110000000011010011010110101111010,PHEPNRUNAZKEFS-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CNCC(C)(C)C3)Cl,3552BFFE855E512C_52456A1C570729D2_6034_UN,8.673321,00000000000000000000000000000000000010000000000100000000000000000110000000110110111101111011000010101001001110001001000111100100100101110110011011001111010110101111010,BHEBRQXWKNGKST-UHFFFAOYSA-N
FC2=C1C=CN(C(C1=CC=C2)=O)CC45OC3(CNC3)C(C4)(N)C5,4020EAF30E8219DA_BF779A6D64F216BE_6034_DP,8.53772,00000000100100000000000000000000000000000010000000000100010000000110000000010000101111110011100111101100110100111100010011100101110111100110001111001011111111110111110,AKVSLNWGZRZSIP-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)F)CC#N,FCCDDA959CCD3093_84D54AE7CF4831DB_6041_DP,8.225142,00000000000000000000000000000000000000000110000000000100000000100100000000010101101101110011010010001000000110010000000011100100110101110110001010001011010110101111010,YQJGQDIWTCMLGC-WCQYABFASA-N
N(C1=CC=C(C=C1)N2CC3CCC(C2)O3)C(=O)[C@@H]4C[C@H]4C5=CC(=C(C=C5)F)F,83251A5587950C48_32A8C8B75C65AE4B_6038_UN,7.4998603,00000000000000000001001000000000000000000010000000000000010000100000000000010000000101110011100110101000010100100000011011100100110011110110001011011011111011110111110,OSHJKBXYVVLRRN-WZOJCFFYSA-N
N(C1=CC=C(C=C1)N2CC3CCC(C2)O3)C(=O)[C@@H]4C[C@H]4C5=CC(=C(C=C5)Cl)Cl,1225F462754FAFF4_9334B8F7C5F37A06_6038_UN,7.499861,00000000000000000001001000000000000000000000000000000000010000100000000000010000000101110011100110101001010100100000011011100100110011110110001011011011111011110111110,CBJQIRIQMXPWJN-WZOJCFFYSA-N
N(CC1CC2CCC(C1)O2)C(C3=C(C=CC(=C3)C4=C[N](C)N=C4)F)=O,7169FCF78CD953EA_309E635DBB45AC08_6038_UN,8.052838,00000000000000000001000000000000000000000010000000001000010000100100000000010000101100010010111010101000010100100000011011101100110010100100001011011011111111111111110,KPGKTMVCTXNARD-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=CC=C2NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C,CAD1D93B9A2729B2_59D98B5CE805A00D_6041_DP,8.174343,00000000000000000000000000000000000000000010000000000100000000100100000000000000101100110011000010101100110100010000001011000100110101110110001011010111010110101111010,CBWDGQKAKRYEBZ-PKOBYXMFSA-N
CC1=CC2=C(C=C1)C(=CN2CC4CCCN(CC3=CC=C(C=C3)I)C4)C5=CCNCC5,A8B282FA9C16DBA2_C8A9AB22C8F5937A_6034_UN,8.348398,00000000000000000000000000010000000000000000000000100000000000100100000000011000101101110001000010111100110100010000001011100100110000100110001001011001010110101111010,VZQAXIJCPNWGFT-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CCN3C4CC4,B1C733D194D5464E_615C569B4FB6B5BF_6041_UN,8.034346,00000000100100000000001000000000000000100000000000000000000000100100000000010101001001000011000000101100010010010000001011100100110001010110011011011111010110101111010,MOQWLUAPGVLQSH-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC3=CC2=C(CCCCC2)S3,ADCC461F9E18FB34_9A6CD4AA03E58782_6041_UN,7.7057285,00000000000000000001100000000010000010000000000000000000000000000100000000100001011100101000010010101100010000001000001011000100110001010100011010011111010110101111010,QKTJSQUVQQUGCQ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC(OC)C3CCCO3,D9CD41707A02961D_E1FA57DB96DEDC2D_6041_UN,7.9634724,00000000000000000000000000000000000000100010000000000000010000000100000010000100001100010001010111101100010111000000101011000110110011110110011011010111110111111111110,ABXDGBKKZSGQBD-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)NC[C@H]2[C@@H](C2)C3=C(C=CC=C3F)F)C4[C@@H]5CNC[C@H]45,20EB009FC983A7EB_2B0198145BC1FBAA_6041_DP,7.834126,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000010110010001000011100100110101110110001011001011010110101111010,RRXRQRWKOHNLSG-OLCZDCNJSA-N
FC1=C(C=C(C=C1)NC3=C(CN(C)C2CCCCC2)C=CC=C3)C4OCCO4,69F0881A67F9F320_A5B949D804696DD7_6041_UN,8.06916,00000000000000000000000000000000000000000010000000000000010000100000000010000000100101110010010010001000000111010001101010110100110011110110001011011011010111111111110,FTLYAUUDOAGJSG-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2C3(CCNC2)CCC3)F,D04674BD6B525257_FF580B50F08C5819_6041_DP,7.4241967,00000000000100000000000000000000000000000010000000000100000000000010000000100000101001110011010000101000110100011001001001100000110101110110001011011111010110101111010,KNKWKTHLMTZREI-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCOCC2C)F)CC3,4564F4057BA66228_639B2A9077C37F98_6041_UN,7.4274693,00000000000000000001000000000000000000000010000000000000010000000000000000010001101001110011010000101000000111010001101011100000110011110110001011011111010111101111110,VZCNXYJWRHQJKR-UHFFFAOYSA-N
CC1=NC(=NC(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)CC4CC4,494CFE5DFCB5B510_04ED042EB20CDCCC_6041_DP,8.207077,00000000000000000000001000000000000000100010000000000100000000100100000000000100101000110011000000101000100110010000001011000100110101110110001001010011010110101111010,BEEFOKXZUUZCCT-PKOBYXMFSA-N
C1(=NC=C(N=C1)C2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,E94B7E749FEC61BD_6F96389237557D4F_6041_UN,9.005249,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101110011010010101000100110010001101011100100000001110100001011011011010010101111010,KXJRXOAWCIVEJK-QAPCUYQASA-N
C2(=CC1=C(C=CC=C1F)S2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,8B264C01B0490120_38CC9404361A28C4_7022_UN,8.004226,00000000000000000000000000000000000010000010000100001000010000100100000000010000111101111001011110101100010111010001101011101100110011110110001001011111110111101111110,SBSFXVQZZDICBO-YJBOKZPZSA-N
FC1=CC2=C(C=C1)N=CN=C2NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,FEE47DA05A17D077_A7C255C643DB8C1C_6041_UN,8.6826515,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,RBPSVNSJEUVDFM-VLIAUNLRSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCOC(C2)C3=CN=CC=C3)F)CC4,B31B5FDFB1564B73_CBD5088719B28055_6041_UN,7.8838286,00000000000000000001000000000000000000000010000000000000010000100100000000010001100001110010010001101000100111010001101011100100110011110110001011011011110111101111110,NGDZYTVPSGYRFN-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)NC2=CC(=CC(=C2)F)C)[C@H]3C[C@@H]4CC[C@H](C3)N4,961B2F11E6FC765A_B42221008F26245A_6041_DP,7.9780216,00000000000000000001000000000000000000100010000000001000000000000100000000000101100101110011011010101000110100010001101011101100110101110100001001011101010110101111010,PFSNOTXAHDXYKH-HGKCTWBKSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,8A36B2179D908133_BB4531A2DC7FC00E_6041_UN,7.657604,00000000000000000000000000000000000000100010000000000000010000100100000000000100001100010011000011101100010111000000001011000100110011110110011011010111110111101111110,BNLRHKPGDWNOMF-AVRDEDQJSA-N
CCC4CCC1=C(C3=C(N1CC2(Br)CCC2)C=CC(=C3)C)C4,481A3785CA15BAD6_CD47B4C20DD735E1_6034_UN,7.5616035,00000000000100000000000000000000000000000000001000000000000000000110000000010000000101010000000010001100010110011010101001100100110000100100000011011100010110101111010,PBPQRTCLAQELSM-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CC2(F)CCC2)C=CC(=C3)C)C4,7BDD9B91718D6DDA_988F22330BCC0569_6034_UN,7.561594,00000000000100000000000000000000000000000010000000000000000000000110000000010000000101010000000010001100010110011010101001100100110000100100000011011100010110101111010,GIJKQFQWNIRQPR-UHFFFAOYSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NC3CCCCC3CC4CCCC4,35E626FC0470140B_24AE800860C29995_6041_UN,8.255122,00000000000000000000000001000000000000000010000000000000000000000100000000010101000101010011010010000100111100010000001011100100110001110100001011011011000110101111010,VXEMKSINFSVWPO-UHFFFAOYSA-N
C(C2CCC1(CC1)C2)=CC3=C[N](C)N=C3C4=C(C=CC=C4)Cl,1821A93313ADF5AA_9451EEDB4A13176C_7019_UN,7.7171874,00000000000000000000001000000000000000000000000000001000000000100110000000010000100100010000011010010001010100001000001011101100110000100100001010011010000010101111010,HSFNDSVHVPMEOR-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CCC2CCCCC2)C=CC(=C3)Br)C4,79B2096A567904B2_8DF7AE774ECDE780_6034_UN,7.604166,00000000000000000000000000000000000000000000001000000000000000000110000000110000000101010000000010001100010100011001101001100100110000100100000011011100010110101111010,XAJGHUAHIQYMGN-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2C3(CCC2)OCCCC3)F,66C8BB1ED9C2CD3A_A0AE08341AA27057_7022_UN,7.6313953,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110011010110101000110101011001001000100000110011110110001011011111110111101111110,JEHNQMWCXBUSAM-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCCC2CCNCC2)Cl)C3CC3,8112448D494A6540_DD7F0AE971193858_7022_DP,8.403509,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000110001000000101001100110010000001001000000110101110110001011010011010110101111010,WJBSPHGYCJKLGU-UHFFFAOYSA-N
CCC(C#N)C1=CC=C(C=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,0A31EC56D973DA3D_7D34995DAE4F3163_6041_DP,7.8827815,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010010001001000100110101110110001001010011010110101111010,VENNVGHDVMHKTO-JEWJRUSMSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@@H]3CNC[C@H]3C)Cl,DD240A148C8DA6B3_5BDD62906EB70460_6034_UN,8.04261,00000000000000000000000000000000000010000000000100000000000000000100000000010110111101111011000010001001001110000001100111100100110101110110001010001111010110101111010,OAKYHSZIWYINMY-OCCSQVGLSA-N
BrC1=CC2=C(N=C1)N(C=C2CC3=CC=CC=C3)CC5[C@@H]4C[C@@H](C4(C)C)CC5,726B0A6F55A7A1F9_3A49353E74BFB317_6034_UN,7.609551,00000000000100000000000000000000000000100000001000000000000000000110000000110100000101010000000010101100010110001000101011100100110000100100001001011100010110101111010,FZDNXFPWDQFNKA-MWRVEUOJSA-N
C1(=CC=C(C=C1)C2=C(C=CC=C2)F)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,D249AC240F7A50FF_C0E77EE68DFD2AE4_7022_UN,8.258644,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,SAUXJLDHISSLOK-CLOONOSVSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2COCCNC2)F)CC3,768C8883BFB59040_BAB88F6571D7F7A2_6041_DP,7.2573357,00000000000000000001000000000000000000000010000000000100010000000000000000010001101001110011010101001000100111010001101011100000110111110110001010011011010111101111110,JHVSLXVRTLQEEP-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NC[C@@H]2CCN(C)[C@H]2C3=CN=CC=C3)F)C4,F879D49E8ABCBCF5_07E63070C3D45173_6041_UN,8.070224,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101100010110010011101011100100110001110110001011011111010110101111010,ATACLWQTKKOSSK-AVRDEDQJSA-N
NCC1(C(CCC1)OC2=C(C(=CC=C2)C3CNCCC3)F)CC4=CC=C(C=C4)F,57D7FF4EE1AF3983_9ED26BBACF4AE6A7_6035_UN,8.1913395,00000000000000000000000000000000000000000010000000000000000000100010000000000000001010110011000011101000100100011100001001000111110110100110001111010011110101100111110,ZOFHZTXOALBUKI-UHFFFAOYSA-N
N4C[C@@H]1COC[C@]1(C=CC2=C[N](N=C2C)C3=C(C=CC=C3)F)C4,8A6893E9A58848C0_BCE9040D7C5C2086_7019_DP,8.749252,00000000000000000000000000000000000000000010000000001000010000100110000000010000101100110011001011011100010101001000000011101100110001110110001010001011010011101111110,CUDFZVDVTRZSSC-QAPCUYQASA-N
C1CCC(NC1)C3=CC2=C(C=CC=C2)N3CC5=CC(=C(N4CCN(C)CC4)C=C5)F,4C824E83B2D44A6B_CF9367A45C3F56F2_6034_UN,8.008879,00000000000000000000000000000000000000000010000000000000000000100100000000010001001101110011010010101100110100010001101011100100110001110110001011011011010110101111010,QEPRHEBOAKEFNI-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NCC3(N2CCN(C)CC2)CCCCCC3)C4OCCO4,0A627CFC645A87FF_A1F081573F1E4407_6041_UN,7.175611,00000000000000000001000000000000000000000010000000000000010000100010000010010001001101110011010010101000000101011001101011110000110011110110001011011011010111111111110,FWPKNPUMBWAXDK-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC3OCC2(CNC2)C3)F,A8637BB8F92AA834_1D863BB1764ED698_7022_DP,7.610074,00000000100100000000000000000000000000000010000000000000010000000010000000100000001101110011010111001000010101001001000011100000110111110110001010001111110111101111110,RDCLJHLZEMNVMZ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC3CCC4CN(CC2=CC=CC=C2)CC34)Cl)C5CC5,DDC67F7DA83B7D30_EF011F23D59A9996_7022_UN,8.503941,00000000000000000000001000000000000000000000000000000000000000100000000000010000100101110011000010001101110110010000001001100100110001110110001011011011010110101111010,JKHXAGKMWVGMTB-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2CNCC23CCOCC3)F,AA9184BC48FBB49C_5B719B8F14365BCA_7022_DP,7.496284,00000000000000000000000000000000000000000010000000000110010000000010000000100001101101110011010010101000110101011001001011100000110111110110001011011111010111101111110,PRKZSZBYRVSNLQ-UHFFFAOYSA-N
C(CN1CCOCCC1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,8FDF6CA9365F643F_1777445E1A033117_7019_UN,8.154548,00000000000000000001000000000000000000000010000000000000010000000000000000010000000001110000010111011000000111010000101011100000110011110110001010011010010111101111110,SKMJFSCCYFEBAU-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NC[C@@H]2OCCN(C)[C@H]2C3=CC=CC=C3)F)C4,83EB2234ADA9817B_6469753690A6D2A2_6041_UN,7.675978,00000000000000000000000000000000000000000010000000000000010000100000000000010000101001110001010100101100010111010011101011100100110011110110001011011111110111101111110,WDLPLQBXYJDYEM-GOTSBHOMSA-N
FC1=NC2=C(C=C1)C=C(C=C2)NC3(CCCCCC3)C4CC4,2907F43520BE9777_E398F7B6803B93E1_6041_UN,8.686623,00000000000000000001001000000000000000000010000000000000000000100110000000000000000000010011000000100100110100011000001001000100110001110100001001010001000010100111010,IPJMHKPEIJFEIA-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2CC2)NCC3C(N(C)CC3)C4=CC=CC=C4,61B185F545FE42BF_1F796D2AEC51D298_6041_UN,8.277564,00000000000000000000001000000000000000000010000000000000000000100000000000010000101101110011010010001000000110010001101001100100110001110110001011011011010110101111010,LNQWSVXVNPOGSE-UHFFFAOYSA-N
NCCCC(OC1=CC2=C(C=C1)CCNC2)C3=CC=C(C=C3)F,346928197FDDD2CF_8EE4020B2235B7C0_6035_UN,8.497023,00000000000000000000000000000000000000000010000000000000000000000000000000000000001010110011000000101100110100010100001001000111110110100110001111010001110101100111110,BXHYRMAXKWBWKN-UHFFFAOYSA-N
CN(CC1CCNC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=C(C=C(C=C4)F)F,9900D5F8CBC54F1A_8DA4F000B9F66140_6041_DP,8.377863,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000100110010001001011100100110101110110001011011011010110101111010,WHMKZZHVMUOMJB-BRCNOLGNSA-N
C[N]1C(=CN=C1C2CCCCN2)N[C@@H](CC)C3=CC(=C(C=C3)C)F,93EA234099114C03_6EC75B5F03E75BFE_6041_DP,8.493585,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101010011010010101000100110010010001011100100110101110100011011011111010110101111010,QOKVFPOFXOSBJA-BHWOMJMDSA-N
N(CCC1CC2CCC1O2)C(=O)C[N]3C=CC4=C3C=CC(=C4)F,D13EDB2D3BB89EF7_734149C5769F9742_6038_UN,7.928438,00000000000000000000000000000000000000000010000000000000010000000100000000010001001101010001100110001100110100110000011011100100110010100110001001011001111111110111110,KPLXJUROWFGTBK-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)CCC2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,4ED114675FD6403B_1A038B9E9184A319_6041_UN,8.338783,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,GYHXKZKCNMQKNM-ZHRRBRCNSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC4C(C)OC5=C(C=CC=C45)F,68FD4318FF3F93D2_189A683D44B871C1_6041_DP,8.538172,00000000000000000001000000000000000000100010000000000000010000000100000000000101100101010011010111100100110100010100101011100100110101110100001011011111100011101111110,TYAABERMSAOUEH-UOBONFSKSA-N
O(CC1C(CNCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Br)Br)C#N,324D1AD73C92FE4D_4632C641CB0E817E_6035_UN,8.1590805,00000000000000000000000000000000000000000100001000000000000000100000000000000000001000110001000001101000100101010100001001000111110000100110001111010011110101100111110,DZMTUFZUDYLVFW-UHFFFAOYSA-N
O(CC1C(CNCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Cl)F)C#N,325A16264616886D_CBAA3F6FC8475082_6035_UN,8.159077,00000000000000000000000000000000000000000110000000000000000000100000000000000000001000110001000001101001100101010100001001000111110000100110001111010011110101100111110,CZCBEOKXIAMALC-UHFFFAOYSA-N
N(C1=CC(=CC=C1)CCF)C(C2C3CCCC2CN3)=O,242F969C6B035E98_1A5276B5A4D80A59_6038_DP,8.2933445,00000000000000000001000000000000000000000010000000000100000000000000000000000000101100000011100011001000110000110000011001000000110101110110001001010001011110100111110,CDHKDKVHKFLHLN-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NC[C@H]2CNCC(O2)(C)C)F)C#N,90818C684A431545_247BD87C5DE2C252_6041_DP,8.029558,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110011011000111110111101111110,FEGLTXWCBCKLPO-LLVKDONJSA-N
CN4CCC1=C(C3=C(N1CC(C)C2CCCCN2)C=CC(=C3)Cl)C4,8C2AB9690A4D20C0_5739E24F10CFE398_6034_UN,7.735796,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101110011010010101101110110010001101011100100110000100110001011011101010110101111010,DNTHBGGKDUBLAA-UHFFFAOYSA-N
C(CC1CCOCC1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,FCDF8971B66B0B6B_ACB053BFB5FDE00B_7019_UN,7.8810506,00000000000000000000000000000000000000000010000000000000010000000000000000000000000001110000010010110000000111010000101000100000110011110110000011011010010111101111110,KREMWUIYAMZINZ-UHFFFAOYSA-N
CC2=C1N=C[N](C1=CC(=C2)NC3C4CCCC3COC4)C,00DD36BE7ED30265_1E261009F9A5B0A7_6041_UN,8.430972,00000000000000000000000000000000000000000000000000000000010000000100000000010101100101100011010011100100010001000000001011100100110001010110001001011101010011101111110,ZDIHZOGCNKBGTP-UHFFFAOYSA-N
CC3=NC2=C([C@H]1CCCN[C@H]1CC2)N3CC5(CC4=CC=C(C=C4)F)CCNC5,E6034959C55C20F2_530BE0D0EF9EAC7B_6034_UN,8.22719,00000000000000000000000000000000000000100010000000000000000000000110000000010101101101110011000010101100110110011000101011100100110100100110001011011011010110101111010,RKQCXPOOCPADEB-ZXTYOHMPSA-N
CN5CCCN(CC1=C(C=C(C=C1)NC2=CC4=C(C=C2)OC3(CCC3)C=C4)F)CC5,E48AD586AC8BEAE0_568AF1DA934AF38C_6041_UN,8.118887,00000000000100000001000000000000000000000010000000000000010000000010000000010001100001110000010000111100010110011101101011100100110011110110001011011011110111101111110,BATUVRMQANMYSZ-UHFFFAOYSA-N
CC4=CC1=C(C=C(C=C1C)NC[C@H]2[C@@H](OCC2)C3=CC=C(C=C3)F)[NH]4,DD645D4B9E1CF2A1_5947DA41054A1C5B_6041_UN,8.02295,00000000000000000000000000000000000000000010000000000100010000100100000000000000101100010011000011001100010101000000001011000100110111110110001001010111110111101111110,XBUKTGLDBHATPA-KKSFZXQISA-N
N(CCC1CC2CCC1O2)C(C4=CC3=C(C)C=CC(=C3[NH]4)F)=O,89981AE49D04EBD9_1B18679D385D582F_6038_UN,8.164503,00000000000000000000000000000000000000000010000000000010010000000100000000000001001100010001100110001100110100110000011011000100110110100100001001010001111111111111110,WCEGQTYMSOYUCB-UHFFFAOYSA-N
FC2=C(C=C1C(=CC=NC1=C2)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4)F,09A0F5410942A312_D4F659251E1DF9FE_6041_UN,9.02622,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101100010110010001101011100100110001110110001011011011010110101111010,FGPGNFJGIGSUQW-XOBRGWDASA-N
BrC1=CN=C(N(C1=O)C[C@H]2[C@@H](CNC2)C3=CC=CC=C3)C4CCC4,37E34224B66192D3_362493444F1D7308_6034_UN,8.2628565,00000000000100000000000000000000000000100000001000000000000000100100000000010100101101110011100011101000000100100100011011100101110000100110001111011011011110100111110,BKLVAQODDPOGPT-HOTGVXAUSA-N
CCC5CCC1=C(C4=C(N1CC3(CC2CO2)CCCC3)C=CC(=C4)C)C5,08482475B38747E1_322D6787AFA690D5_6034_UN,8.113679,00000000000000001000001000000000000000000000000000000000010000000110000000010000000101000000000010001100010011011010101011100100110010000110000011011100110111101111110,MITZUTFVMALOHI-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)COC2)[S](C4=CC3=C(C(=C[NH]3)CC)C=C4)(=O)=O,BBA8F947E3630F92_7D8BBC39BD6E7E79_6029_UN,8.687195,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100101011001010000110011001001010010011001100011101011110001011101001010111111111110,WSJQXGDNOUSZEX-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC(OCC)C2CCOCC2)F)CC3,3535413D68436FBC_3F24074C067A5417_6041_UN,7.976679,00000000000000000001000000000000000000000010000000000000010000000000000000010001101001110001010100101000000111010011101011100010110011110110001011011111110111111111110,VEYUZEMUKNGVDR-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC(CC)N3CCCC3)F,E68BCD691522DE7C_3551E640A3801DE7_6041_DP,7.3241577,00000000000000000000000000000000000000000010000000000000000000000000000000010001001101110011000010101100110110010010101011100000110101110110001011011011010110101111010,KINJEILJQGMHTC-UHFFFAOYSA-N
CCC1=C(C(=CC=C1)F)N[C@H]2[C@@H](OCC2)C3=C[N](N=C3)CC4CC4,37E48667C80FB358_EC9C0DE79D28F182_6041_UN,8.209107,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011001111001000100101010010001011101100010011110110001010011011110111101111110,YCHKUGBMGRICLO-MJGOQNOKSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NCC3(CC2(CNC2)C3)C4=CC=CC=C4,6EBE1BB6BB656F9E_122997FE6667D527_7022_DP,7.787854,00000000100100000000000000000000000000000110000000000000000000100010000000000000001000110010000000001001010100001000000001000100100101110110001011000011010110100111010,AAIRJZWPCCAOJZ-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC34CC(CO3)CCC4,CDC79940A5E84A19_0CCE62F9C5877A82_6041_UN,7.76341,00000000000000000001000000000000000000100010000000001000010000100110000000010101101100010011011110101000010101001000001011101100110011110110001011011011110111101111110,DDQUEUYPIGGDAL-UHFFFAOYSA-N
FC2=C(C=C1C(=CC=NC1=C2)NCC[C@@H]3CC[C@H]4C[C@@H]3C4(C)C)F,5767991D18FDC056_C196D1ACDCDE3DED_6041_UN,8.505525,00000000000100000000000000000000000000000010000000000000000000000110000000100000101000010001000000101100110110011000101001000100110001110100001011010111010110101111010,LLQSLVIWEPCRFO-YDHLFZDLSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC[C@@H]3CN[C@@H]4CCCC[C@H]34,3BE042EEC823761C_D62F325A12B7DEFF_6041_DP,8.578187,00000000000000000000000000000000000000000010000000001100000000000100000000010000101100010011011010001100110100010000001011101100110101110110001001011001010110101111010,ZJSIMQMYPCTDEX-XNRPHZJLSA-N
FC2=C(C=C1C(=CN(C1=C2)CC3C(C)(CNC3)C)CC#N)F,A62640FA2849B526_B7A2AE672FE8FB4A_6034_UN,8.531804,00000000000000000000000000000000000000000110000000000000000000000110000000110000101101110011000010001100010110011001100011100100110000100110001010001111010110101111010,IZOUXAHVYQPVFY-UHFFFAOYSA-N
C[N]1N=C(N=C1NC2(CCOCC2)CC3=CC=C(C=C3)F)C4CCOCC4,EAAA69A45E9371DA_EDEED8798D8F64EB_6041_UN,8.10591,00000000000000000000000001000000000000100010000000001000010000100110000000010101100100110010011011100000101101011000001011101100110011110110001011011011010111111111110,VNRGMBLKSJVWTN-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N(C(=C2)C3=CC=CC=C3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,448293EAF81E41AE_54A49214D0CB37F8_6034_UN,8.718563,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,PAQCIWVEPWPGMG-HRFSGMKKSA-N
C1(=C(C=CC(=C1)F)OCC2CCOC2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,8B9396A6870B4B0B_8BC356200018AC8A_7022_UN,8.317934,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110101011110101000000111010101101011101111110011110110001111111111110111111111110,DNJQYHHONLHOPJ-LBTAZEDMSA-N
FC2=C(C(=C1N(C=C(C(C1=C2)=O)C#N)CC3C(CNCC3)C4=CC=CC=C4)F)F,202FF6B658CF5530_0DB724B46AD15251_6034_UN,8.081882,00000000000000000000000000000000000000000110000000000000000000100100000000010000101001110001000001101100110100010100001011100101110000100110001111011011111110100111110,MPQHKECGQNLJPK-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=NC(=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,C4D55107764D4E03_A795412734BCE773_6041_UN,8.187285,00000000000000000000000000000000000000100010000000000000000000000100000000000100100001110010010000101100010110010001101001100100110001110100001011011011010110101111010,ZMEQUYZGMYPOSP-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(CC)CCOCC2)F)CC3,4300F9323E27E32A_D1FF5F465791169B_6041_UN,7.3965354,00000000000000000001000000000000000000000010000000000000010000000010000000010001101001110011010000101000000111011011101011100000110011110110001011011111010111101111110,CCZCZTJQCNFJJR-UHFFFAOYSA-N
C(C1CCCOC1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,6225796CA4856C05_89845D33BA1DD5BD_7019_UN,7.9648547,00000000000000000000000000000000000000000010000000000000010000000000000000000000000001110000010010110000000111010000101000100000110011110110000011011010010011101111110,DNTMGMLRCRZBIN-UHFFFAOYSA-N
C2(=CC1=C(C=C(C=C1)Cl)O2)NC[C@@H]3CNC[C@H]3C4=CN=C[N]4C,732FD1AC926025A5_D78F0B8B2E5727D5_7022_DP,7.6408224,00000000000000000000000000000000000000000000000000000100010000100100000000010101101101110011110010001101010110100000010011100100110101110110001010001011110110101111110,MHGMLKLNJNMNHL-GXTWGEPZSA-N
C2(=CC1=C(C=C(C=C1)F)O2)NC[C@@H]3CNC[C@H]3C4=CN=C[N]4C,998D34F92608C2A7_C4237A499C2159B4_7022_DP,7.6408114,00000000000000000000000000000000000000000010000000000100010000100100000000010101101101110011110010001100010110100000010011100100110101110110001010001011110110101111110,KRJKSLFPKJWPHS-GXTWGEPZSA-N
CC(=O)CC1=C(C=CC(=C1)F)NCC2C3CCC(C2)C=C3,3AC2C563324EE060_DD6BECF5804EFBCF_6041_UN,7.9804707,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011000000011000010100000001001000000000110011110000000011010011111110101111110,RHEUXHQAPIJWJU-UHFFFAOYSA-N
O(C2CCOC1(CCOCC1)C2)CCC3N(C)CCCC3,2DABEEF6D7842AAA_F219F59C7824F25A_6039_UN,7.0083447,00000000000000000000000000000000000000000000000000000000010000000010000000010000000001100100010001101000010011011001101011100011110010000110000101111010110111111101110,PLZZEJMKVXHQDZ-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC[C@H]2[C@H](CCCC2)N3CCOCC3)F,42885A4A49A62BEF_CB4F7833E732BB21_7022_UN,7.6934795,00000000000000000000000000000000000000000010000000000000010000100000000000110000101001110011010100101000000101010001001011100000110011110110001011011111010111101111110,JMLDQXLWAWCVTR-JXFKEZNVSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC45CC(C4)(F)C5,D6CF0A6480C518F6_57418D5099E36A61_6041_DP,8.22237,00000000000100000001000000000000000000100010000000000000000000000110000000000101100101010011010010100000110100011000101011100000110101110100001001011001000010101111010,PYFFCYVCEKORBI-NEDPOTEPSA-N
C(C1CC2CC1C3CC23)=CC4=C([N](N=C4C)C5=CC=C(C=C5)Cl)C,1DEEE8F16D8F27A6_77D9F6BE18DE8C94_7019_UN,8.7517395,00000000000000000001001000000000000000000000000000001000000000100100000000010000100100010000001010010001010100000000000011101100110001110100001011001110000010101111010,OHLKKZNBYMSDDI-UHFFFAOYSA-N
C(C1CC2CC1C3CC23)=CC4=C([N](N=C4C)C5=CC=C(C=C5)F)C,F2BF3BCA8635D3A3_5F03B19A183F8544_7019_UN,8.751738,00000000000000000001001000000000000000000010000000001000000000100100000000010000100100010000001010010000010100000000000011101100110001110100001011001110000010101111010,FKSHUUQFNNYHSO-UHFFFAOYSA-N
N4CCC1(CCC1)C(C=CC2=C(Cl)[N](C(=N2)N(C)C)C3=CC=C(C=C3)C)C4,BE92DF2D67D3E6B9_97A495B34F68D06D_7019_DP,7.5059047,00000000000100000000000001000000000000000000000000000000000000100110000000110101001101110001010010111001111100011000001011100100110001110110011011011111010010101111010,SLNSYRAXEZVUNQ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3C(CCCC3)N4CCCC4,17ED1A0B750F83A3_B22F10BDD94F7891_6041_UN,7.720159,00000000000000000000000000000000000000100010000000000000000000100100000000010100101101110011000010101100010110010000001011100100110001110110001011011111010110101111010,BRAACEDSHWHOHK-UHFFFAOYSA-N
N1CCC5(CC1)CCC2=C(C=CC(=C2)NC4=C(N3CCN(C)CC3)C=CC(=C4)F)O5,F4C5BB0D3C7110FE_89100627A3EFC27F_6041_DP,7.4194818,00000000000000000000000000000000000000000010000000000000010000100010000000010001001001110001010001101100110100011101101011100100110111110110001011011011110011101111110,PNXYUWIDSKLEEP-UHFFFAOYSA-N
CN(C)CC1=C(C4=C(N=C1C2=CC=C(C=C2)C3CCC3)C=C(C=C4)Cl)C5COCC5,1932723DEDF63FAF_4F42AE095C8CEE60_2201_UN,8.169167,00000000000100000000000000000000000000000000000000000000010000100100000000100000100101110000010010101101010101000001001011100100110010100110001011011110010111101111110,IIRMNEYFZJUXLB-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(C3=C(C)C4=C([NH]3)C=C(C=C4F)F)=O,9B487FF4FDB4FD00_A9F0E810F69F227C_6038_UN,8.189877,00000000000000000000000000000000000000000010000000000010000000000100000000000001001100010001100110001100110100110000011001000100110100100100001011010011011110101111110,BIUDJOUCROUHFD-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3CCNC34CCC4,2CB1F25D23AE0402_6D18ED122B59F4D6_6041_DP,7.5733113,00000000000100000000000000000000000000100000000000001100000000100110000000010101101101000011011010001000110010011000001011101100110101010110001010011111010110101111010,YIVPCNAYJAADRU-UHFFFAOYSA-N
CCC(NC(=O)CC1CC2CCC1O2)C3=C(C=C(C=C3)F)F,A88227E3B696EA42_499BAA882B235325_6038_UN,8.093578,00000000000000000000000000000000000000000010000000000000010000000000000000000000000100010001100010000000110100110010011000000000110010100100000011010011101111111111110,YUHLWWGKQORPIP-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC(C3CC3)C4CC4,DEA1706176DE1F14_2412607A5B4D896F_6041_UN,8.235354,00000000000000000000001000000000000000100010000000000000000000000100000000000100001000010001000000101100010110000000001001000100110001110100001011010111010110101111010,FWHWBYZRUOESTC-UHFFFAOYSA-N
O(C[C@H]1C[C@H](F)CN1CC2=CC=CC=C2)CC3CNC(CO3)(C)C,2DAD2857B242ACEA_2C70B6326FD5D26E_6039_DP,8.381674,00000000000000000000000000000000000000000010000000000000010000000010000010110000001101110011000111101000100101011001100011100010110010100110001001001111110111111111110,FSPHWHACOBSKLU-MYFVLZFPSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)CCC4CCCCN4C,8536B858BCD3FFA3_9620BC3CE02C739F_6034_UN,7.350375,00000000000000000000000000000000000000000000000000000000010000000100000000010000101101100001010110101100110011010001101011100100110010000110001001011011010111101111110,PIGAHGPUKKXWRD-UHFFFAOYSA-N
O=C1C=CN=C(N1C[C@H]2[C@@H](CCNC2)C3=CC=C(C=C3)F)C4CCOCC4,39A2661D7A04721C_D71225CB2AB38D60_6034_UN,8.221661,00000000000000000000000000000000000000100010000000000000010000100100000000010100101001110011100001101000100101110100011011100101110010100110001111011011011111110111110,AIVHDZGRXYCDAB-HKUYNNGSSA-N
CC1=CC=C(C=C1)C2=CN(C(=N2)C3NCCCC3)C[C@H]4[C@@H](CNC4)C5=CC(=CC=C5)F,78DF0742CB4A29F9_A1ED4EA8FFC24FED_6034_UN,7.93041,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101000100100010000001011100100110100100110001011011011010110101111010,DHNVZUUFKWWEKZ-GXBCDIMNSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NCC4(C3CCNCC3)CCOCC4,FC937C60DAB8556C_05CEE17578BB851E_6041_DP,8.436266,00000000000000000000000001000000000000000010000000000000010000100110000000010101001101110011010010101100111111011000001011100100110111110110001011011011010111101111110,KBTYVKMFAYLHQW-UHFFFAOYSA-N
C1CC(CCN1)C3=CC2=C(C=CC=C2)[N]3CC4(CNC4)C,4DF6DA2A56D23F84_304C5F6CCCB14E49_6034_DP,8.32641,00000000100100000000000000000000000000000000000000000000000000100110000000010000101101100011000010101100110000011001001011100100110100000110001011011011010110101111010,QUENUAXAODHUHF-UHFFFAOYSA-N
FC2=C(C=C1C=CC=NC1=C2)NC3CCN(C)C34CCCNC4,6BE39B0374E4C03B_A12C7664EF5035B9_6041_DP,8.522751,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001011011011010010101111010,XREUTZHQTFQXJE-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)N[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)F)F,3E30AB66D802BF5A_7F3507552939F589_6041_DP,8.578144,00000000000000000001000000000000000000100010000000000000010000100100000000000101100101010011010111100000110101010000101011100100110111110100001011011011110011101111110,NOIQJBPIKRXTMY-NVOMTMBPSA-N
FC2=C(C=C1C(=CN(C1=C2)C[C@@H]3CNCC[C@@H]3C4=CC=CC=C4)CC#N)F,2BFC2B88B8BC7FC2_805D8246A89C4752_6034_UN,7.916212,00000000000000000000000000000000000000000110000000000000000000100100000000010000101101110011000010101100110100010000001011100100110000100110001011011011010110100111010,SYJMXSYSBNXZMV-ZWKOTPCHSA-N
NC1=C[N](C2=C1C=C(C=C2)Br)CC3C(CCN3)C4CC4,B8E572255AF19B53_D3E077FECDB502AA_6034_DP,8.697562,00000000000000000000001000000000000000000000001000000000000000100100000000010001101111010011000010001100110100010000001011100100110101110110001000011011010110100111010,FMYCIYSIJRZJFQ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC2=CC=CC(=C2)C3CCN(C)CC3)C4OCCO4,8E3146496DC1EA0E_22A5849E4D149316_6041_UN,7.3217983,00000000000000000000000000000000000000000010000000000000010000100000000010010000000101110000010010101000000101010001101011110100110011110110001011011011010011111111110,ZPIMJPPWRBVKIO-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(=O)C3=C[NH]C4=C3C(=CC=C4)F,63C7510E354295E3_128502433DA5798D_6038_UN,7.661217,00000000000000000001000000000000000000000010000000000100010000000100000000000000101100010010100011101100010100100000011011000100110110100100001001010001111111110111110,UFQNPBAYJSUMTB-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CC4(CC)CCN(CC3=CC=CC=C3)CC4)C5=CCNCC5)F,85D1539F757D3B6B_505935C5283EBED3_6034_UN,8.649749,00000000000000000000000000000000000000000010000000100000000000100110000000011000001101110001000010111100110110011010101011100100110000100110001011011011010110101111010,XHUPZVVBQSAPAK-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC3=CC2=C(CCSC2)S3,E5BC6628A1579C64_67C64883BC45F183_6041_UN,7.9581323,00000000000000000000100000000010000010000000000000000000000000000100000000100001011100101000010010101100010000001000001011000100110001010110011011011111010110101111010,YJLKBRUETHHWIC-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)NCC2CCC(CN2)(C)C)C#N)F,B09ED36EA741C9F4_C17D52E378A7DC48_6041_DP,8.488484,00000000000000000000000000000000000000000110000000000010000000000010000000100001101000010011000000101000100100011001101001000000110101110110001011010111010110101111010,PFPIVIUYNZBJPL-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3C4CCCC3COC4,A3703A17495A5357_1211BC6DAE2121E9_6041_UN,8.092658,00000000000000000000000000000000000000000010000000001000010000000100000000010000100100110011011011100100010101000000001011101100110001110110001001011001010011101111110,XSOADCWEVUCQPU-UHFFFAOYSA-N
FC1=CC=C(C=C1)CC2=NN=C(S2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,6C4FC1A6FD01E931_0E421602A17265FA_6041_UN,8.512433,00000000000000000000001000000000000010000010000100001000000000000110000000100101111100011011001010001100011100011001101011001100110001110100001011010101010110101111010,DSOOCTQKVHBYPW-UHFFFAOYSA-N
C(C1=NC(=CS1)C2CC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,BD4FB65268E680F9_CC194E9C2CB0246D_7019_UN,8.331166,00000000000000000000001000000000000010000010000100000000000000100100000000000000010101011000010010010000000110010000101011100100010001110100001010011010000010101111010,SBBVFTUACMICDB-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC=C3CCSCC3,004D3FA923834147_CF5C921580F34EC8_6041_UN,7.552533,00000000000000000000000000000000000010100010000000100000000000000100000000001100001000111001000000111100010110000000001011000100110001110110001011010111010110101111010,NJZKAFDENQXCLE-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C=C(Cl)C=C2)NCC3N(C)CC4(CC3)CCC4,68BE988D936F4220_C3A5986B59BEEF35_7022_UN,7.9678574,00000000000100000000000000000000000000000000000000000000000000000010000000010001001001110011010000101101010110011001101001100100110001110110001001011011010110101111010,LFLCCSRUNMTBBH-UHFFFAOYSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)CC34C(C3)CNC4,1290E6AA28587304_27C1046534174364_6034_UN,8.809437,00000000000000000000001000000000000010000000000100000000000000100110000000010110111101111011000010101001011100011011000111100100110001110110001011001111010110101111010,GKYKKSVALSWCAB-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NC[CH]4C[C]3(C[C](C)(C3)C)C4,3E173F570614D09A_C13523CDD5247CFD_7022_UN,8.342642,00000000000100000000000000000000000000000010000000001000000000000110000000110000101100010010001010001000010110011001000011101100100001110110001010001111010110101111010,CONGPFUDKYQWHJ-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,8C5971FA1C013186_E3A92702F0DEFB4A_7022_UN,8.355645,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,KJJHEWGRCNYKCY-VGSWGCGISA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,FE2F687EDA18FE26_1769D50FB89D5AF5_7022_UN,8.355625,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,XVEGAVFKVHXKGW-VGSWGCGISA-N
C[N]1N=C(N=C1N[C@H]2C3=C(CCC2)C=CC(=C3)F)C4CCOCC4,997213E153800FA2_15BF6E06B302E52A_6041_UN,8.100193,00000000000000000000000001000000000000100010000000001000010000100100000000010101100100110011011010100100111101010000001011101100110011110110001011011011010011101111110,KDMZSPIFCGWQID-MRXNPFEDSA-N
N(C1=CC2=C(C=C1)COC2)[S](C4=C3[NH]C=CC3=CC=C4)(=O)=O,A0A508AB9809E32A_00235E9A0A92FA09_6029_UN,8.980341,00000000000000000000000000000000110000000000000000010101011111001101010001000000110100101001001011000110011001001000010011001100011101011110001011101001010011110111110,DODMKDAPSVWPIM-UHFFFAOYSA-N
CC4CC1=C(C=CC(=C1)NCC2CCCN(C)C2C3=CC(=CC=C3)Cl)O4,7ACCEB56E74D890A_FCB05FE7D3D20990_7022_UN,7.984762,00000000000000000000000000000000000000000000000000000000010000100000000000010000101101110011010010101101010110010101101011100100110011110110001011011111110111101111110,JRKINEPLFNCXPB-UHFFFAOYSA-N
O(CC1CCOC2=C1C=CC=C2)CC3=CC4=C(C=C3)NC(=O)O4,DA13F612E6093403_B0FACE28F9914FD7_6039_UN,8.775949,00000000000000000000000100000000000000000000000000000000010000000100000000000000000100100000000110100100011001100100011011010111110010000110100111110001111111010111110,HJXNKYTYOOZVNX-UHFFFAOYSA-N
BrC1=CN(C(=O)C2=C1C=CN=C2)CC3(N)CCC4=C3C=CC=C4,E1B5B2D87700A1CD_FCCA5D8B70DC83FD_6034_UN,8.439497,00000000000000000000000000000000000000000000001000000000000000000110000000010001100011010011100011101100110100111100011011100101110001100100001111011011011110100111110,UCBGMPFMFSQDKU-UHFFFAOYSA-N
CC2=C1C=C[NH]C1=C(C=C2)NCC3N(C)CC4(CC3)CC4,3A2931CA88C4F118_B7EF779381F5B6D2_6041_UN,8.078228,00000000000000000000001000000000000000000000000000000010000000000110000000010001001101100011010010101100010010011001101011100100110101010110001001011111010110101111010,VCACEPYFTKSNEW-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC4=C3OCCCC3=CC(=C4)F,26EB2E6717E707F6_5569D1DBD231406C_6041_DP,7.263056,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101010011010110101100110111010100001011100100110111110110001011011011110011101111110,XVNTVZZQSCRDAS-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4,53EDA6833F7A806E_6D36988E08108DDC_6041_UN,8.099189,00000000000000000000000000000000000000000010000000000000000000100000000000010000101001110011010010101100010110010001101001100100110001110110001011011011010110101111010,XVYVQMORUUWMCU-AVRDEDQJSA-N
CN(C)CC1=C(C=C(C=C1)NC3=NC=C(CC2COCC2)S3)F,37B1F5A2E55935A0_E6C3250601FC1444_7022_UN,8.272288,00000000000000000000000000000000000010000010000100000000010000000100000000100100010101111001010010001000001101000001001011100100110011110110001010011111010111101111110,OSPHUYUZMBQKDM-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)F)NCC(OC)C2CCCOC2)F,6A5BB5AE1DB62897_C8E88D65973C85BF_7022_UN,7.677148,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110101010100101000000111000000101000000010110011110110000011010111110111111111110,ZXCVGVULAAXBOY-UHFFFAOYSA-N
CC2=C(C=C1[N](C=NC1=C2)CC3=CC=C(C=C3)NC4C5CC6CC4CC(C5)(F)C6)C,A2880E6C3124BFD8_A7A80E9C5292095C_6041_UN,8.025868,00000000000000000000000000000000000000000010000000000000000000000110000000010101000101010010000010001100010100001000000011100100100001110100001011001111010110101111010,RWKCKFQFYTWQER-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC3CNCC4(C3)CCC4,62BC79E77C73AF86_A63F558BDB0A6236_6041_DP,7.745826,00000000000100000000000000000000000000100000000000001010000000100110000000010101101101100011011010101000110000011000001011101100110101010110001011011111010010101111010,JYHMUZWFBLIHBU-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NCC3CC4CCCC(C3)C4,0F9A478AB5E3DB4E_E8E325A3C7006CD9_6041_UN,8.385555,00000000000000000000000001000000000000000010000000000000000000000100000000010101001101010010010010001100011110000000001011100100110001110100001011011011010110101111010,NUQIQAPCKYKLPQ-UHFFFAOYSA-N
C1(=CSC=C1Br)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,6B53462A9E943710_ABEC6E04CA252012_7022_UN,7.8838835,00000000000000000000001000000000000010000000001000001000000000100100000000010001101101011011011010101000000100010000001011101100110001110110001010011011010110101111010,GMECXRBUHKRUAN-PXAZEXFGSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CC3(C2)CCOCC3,B3C2A45E41558EAE_912B30F159DB6ED2_6041_UN,7.32272,00000000000100000000100000000010000000000000000000000000010000000110000000100001001000100010010000101000010001001000001011000000110011010110011011011111010111101111110,BSSYKFLWBVWMMG-UHFFFAOYSA-N
C1(=CSC=C1Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,1F6A947225C226D5_125ADC47456B39B8_7022_UN,7.883861,00000000000000000000001000000000000010000000000000001000000000100100000000010001101101011011011010101001000100010000001011101100110001110110001010011011010110101111010,ZIXDAXJDNVEFSQ-PXAZEXFGSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)F)CC4,8C87C5F021774596_A24CEF883730FF62_6041_DP,8.262829,00000000000000000001000000000000000000000010000000000100000000100100000000010101101101110011010010001000000110010001101011100100110101110110001010011111010110101111010,LTZKCCGIUBQGMO-AZUAARDMSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3CCC2(CCOCC2)CO3)F)CC4,BA83266E3CA15991_CAA09E7787CEE149_6041_UN,6.958619,00000000000000000001000000000000000000000010000000000000010000000010000000010001101001110011010100101000010111011001101011100000110011110110001011011011110111111111110,PTHNSDMUJXNBQZ-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C(=CC=C2)NC[C@@H]3CC[C@@H](O3)C4CC4)C,6A6BC7018FB2E064_B7F7C5EC7116B4EA_6041_UN,7.9308457,00000000000000000000001000000000000000000000000000000010010000100100000000000001001100000011000110001100010000000000001011000100110111010100001010010111110111101111110,LHLVXUKXMJLGGV-WMLDXEAASA-N
N(CC12CC(C1)CO2)C(=O)C3(CCCC3)C4=C(C=C(C=C4)F)F,23F67C39A248F04A_B58950E75A2BB8CB_6038_UN,7.8708143,00000000000100000000000000000000000000000010000000000000010000100010000000000000001100010011100110001000010101101000011000000000110010100110000010010011111111110111110,VNDHJKYOTDFJOH-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NCC3CCN(C)C3C4=CC=CS4,B56BA708B1695082_32DA2D45D354939E_6041_UN,8.648479,00000000000000000000000000000000000010000010000000000000000000100100000000010001111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,ZQPFFOISSJZFPI-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC4(CC3=CC=C(C=C3)F)CCCC4,CE5252AD9EED1777_9C388CE12350AB62_6041_UN,7.9223175,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100110001110100001010011011000110101111010,CXUKIFLNYJGJLO-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC4(C3CCNCC3)CCOCC4,5B04682438B2925A_39593A24563F0EE3_6041_DP,7.8386574,00000000000000000000000000000000000000100010000000000000010000100110000000000100001000110011000000101100110111011000001011000100110111110110001011010111010111101111110,ISYXRJCTMOCPKH-UHFFFAOYSA-N
FC1=C(C(=CC=C1)F)C4(C=C[C@@H]2CCO[C@H]2C3=CC=N[N]3C)CCC4,E53B73E9D62DC9BB_042941364A8D2B86_7019_UN,8.373472,00000000000100000000000000000000000000000010000000001000010000100110000000010000100100010000011111010000000101001000001011101100000010100100001010011010110011101111110,SDVDHRKQPLGXKN-AUUYWEPGSA-N
CCNCC1=CC2=C(C=C1)N(C=C2)CC(N3CCNCC3)C4=CC(=CC=C4)Cl,D05B59C69E30043E_9AD6477F615FB938_6034_UN,8.334637,00000000000000000000000000000000000000000000000000000000000000000100000000010001001101110001000010101101110100010010101011100100110100100110001001011001010110101111010,IKXOQRJOAZYKCL-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)N[C@H]3C5=C(OC4(C3)CCC4)C=CC(=C5)F,18180B2CA8A406BA_7AEF1D3FD8FEC965_6041_UN,7.9983635,00000000000100000000000000000000000000100010000000001000010000100110000000010101100101010001011011100100110100011100001011101100110011110100001011011111100011101111110,LQTIBAAJNOPZEM-LJQANCHMSA-N
CO[C@@H]1C[C@H](NC1)C2=NC=CN2CC3(CCNC3)C4=CC(=CC=C4)F,C34A0C655A521A7B_4D2A427BA857E9F9_6034_UN,8.095518,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101110011010111001000100100011000101011100111110110100110001110011011110111101111110,FUJGTRNFNHSCES-FQZXCLDYSA-N
FC1=CC2=C(C=C1)C=NC(=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,691FDC7289E77C4B_13046172BCE1EF4B_6041_UN,8.636109,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,WUHSIHVUSUXFHI-ZHRRBRCNSA-N
BrC2=NC=C(CC1=CC=CC=C1)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,2F44A370859C9714_A352F9677D5236EF_6034_UN,8.242981,00000000000100000000000000000000000000000000001000000000000000000110000000110101000101010000000010001000011110011000101011100100110000100100001011011110010110101111010,YAZGETBDLJBKCB-YLGOGADGSA-N
C[N]1N=CC(=C1)C2=NC(=CS2)C=CC4=NC3=C(CCCC3)[NH]4,FBF423F56538D40B_FC419175167CA2D3_7019_UN,8.234131,00000000000000000000000000000000000010100000000100001000000000100100000000010101110100001011011010010100110000010000001011101100110000000100001010011001000010101111010,OZHJWAHLAYJMNV-UHFFFAOYSA-N
FC1=CC(=CC=C1)C2=CSC(=N2)C3=CC=CN3CC4(CC)CNCCC4,AABDF4107DF705E2_FDE055769A54B829_6034_UN,8.223256,00000000000000000000000000000000000010000010000100000000000000100110000000010001111101111011000010101000100110011010101011100100110000100110001011011011010110101111010,SCRDHALXGXQVNC-UHFFFAOYSA-N
BrC1=CC(=CC=C1)C2=CSC(=N2)C3=CC=CN3CC4(CC)CNCCC4,682A73CC322AC00C_19C10AB7A4961D3F_6034_UN,8.223227,00000000000000000000000000000000000010000000001100000000000000100110000000010001111101111011000010101000100110011010101011100100110000100110001011011011010110101111010,PTYGSIYHBFEMHN-UHFFFAOYSA-N
FC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]5[C@H]4CNC[C@H]4C5,E992C293F01A1537_7A0BC44487E6CDC8_6034_UN,8.901904,00000000000100000001000000000000000000100010000000000000000000100100000000010101001101110011000010001000110100010000001011100100110100100110001010011011010110100111010,BBUXIBUPRKXEDH-RNDFSMAPSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NC3C5CCC3CC4=C(C=CC=C4)C5,1914A3F62E1F438C_12CF808EC2E33316_6041_UN,7.917711,00000000000000000001000001000000000000000010000000000000000000000100000000010101000101010011010010000100011100000000001011100100110001110100001011011011000010101111010,ZWRZNCIYTHFGRS-UHFFFAOYSA-N
CC1=C(C=CC(=C1)NCC2N(C)CC3(CC2)CCC3)C#C,2EE29BA410BEA7B2_2E3CF767B4A3FCA3_6041_UN,8.045648,00000000000100000100000000000000000000000000000000000000000000000010000000010001001001100011010000101000010010011001101001100000110001010110001011011111010110101111010,NQMITALUAILHAZ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3COC2(CCCC2)O3)F)CC4,7047A3CD0EC21768_1BB3888812E33544_6041_UN,6.91617,00000000000000000001000000000000000000000010000000000000010000000000000010010001101101110010010111001000010111011001101011110000110011110110001010011011110111111111110,PPKSLLZVHOICRV-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC3C4CCCC3COC4,D5F40925E36023E7_FD0882A88F7DEE3E_6041_UN,7.751711,00000000000000000000000000000000000000100010000000001000010000100100000000010101100100110011011011100100010101000000001011101100110001110110001011011011010011101111110,VDSZHYGHLCMBCP-UHFFFAOYSA-N
CC1=C[NH]C2=C1C=CC(=C2)NCC3N(C)CC4(CC3)CC4,B0A05742B1432505_5E53E14AF5E21F2B_6041_UN,7.957314,00000000000000000000001000000000000000000000000000000100000000000110000000010001101101100011010010101100010010011001101011100100110101010110001001011111010110101111010,SVJHTYXSKKUOBR-UHFFFAOYSA-N
C2(=C1[N](N=CC1=CC=C2)C3CCCCO3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,6E5DFE83422B1B59_230CE480B1C1D316_6041_UN,8.630633,00000000000000000000000000000000000000000010000000001000010000100100000000010001100101110011111110101100110111110001111011101100110011110110001011011011010011101111110,NZKYCXQKFZBWGJ-QFMSAKRMSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC4(C3CNCC3)CC4,C8F9DD14B8373432_6BCD600069C684EC_6041_DP,8.506508,00000000000000000000001000000000000000000010000000000100000000100110000000100000101100110011000010101100110100011000001011000100110101110110011011010111010010101111010,SMWRZNQFISMEEI-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)CCC2)NC(CC)C3CCOCC3,5B1B388591EDF526_8067A92CA839532A_6041_UN,7.6707563,00000000000000000000000000000000000000000010000000000000010000000000000000000000000000110011000010100100110111010010001000000000110011110110000011010011010111101111110,LJYBVZCTRWNQIF-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NCC(C3CCNCC3)F)C,AC6B351F3C66ED3F_0FCB7300C89D7421_6041_DP,8.860771,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000110001000000101100110110010000001011000100110101110110001011010111010110101111010,RPLGJKASSQNOLM-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)C=C[C@@H]2CCCO[C@H]2C3=CC=N[N]3C)OC(OC4)C5=CSC=C5,D7963FC16CF6F7BE_9C2BE251EB8997D2_7019_UN,8.601245,00000000000000000000000000000000000010000010000000001000010000100100000000010000100100011100011111110100010101000100001011111100100010100110001011111010110011111111110,SQNOFGGLSKBSQP-KTFIESSTSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3(CCC3)C4CC4,159BB09CB40148FA_EEAE4704637E8738_6041_UN,7.9666767,00000000000100000000001000000000000000100010000000000000000000100110000000000100001000010011000000101100010110001000001001000100110001110100001011010111010110101111010,FDPAREINXBKRSI-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)N[C@@H]3C5=C(OC4(C3)CCC4)C=CC(=C5)F,0EC15478C55DDF51_A0691DCF639CAAC3_6041_UN,7.9752398,00000000000100000000000000000000000000100010000000001000010000100110000000010101100101010001011011100100110100011100001011101100110011110100001011011111100011101111110,LQTIBAAJNOPZEM-IBGZPJMESA-N
O(CC2COC1(CCCC1)O2)CCN3CCN(C)CC3,CB9C2DAB37F25F80_9677FF5BC7FC4928_6039_UN,7.146854,00000000000000000000000000000000000000000000000000000000010000000000000010010001000101100100010110101000010001011001101011110010110010000110001000111000110101111101110,BPCPAYQAHXPYKI-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC(C2CCC2)C3CCOC3)F)CC4,1007EB512C3F8F49_A94338C06873CF8D_6041_UN,7.7724323,00000000000100000001000000000000000000000010000000000000010000000000000000010001100101110011010011001000000111010001101011100000110011110110001010011011010111101111110,KBTVHZDBZMUJJC-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC34COC(C)(CC3)C4,0CE4523F3F6F46A7_D97D06C74C1E99BC_6041_UN,7.2564673,00000000000000000000000001000000000000000010000000000000010000000110000000010101001101010011010011101100011111001001101011100100110011110110001011011111110111101111110,QOKWHVOKMXPVTB-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C3=C(C)C4=C([NH]3)C=C(C=C4F)F)=O,511EB81F6CB61624_CE410106F0104B81_6038_UN,8.081963,00000000000000000000000000000000000000000010000000000010010000000100000000000001001100010001100110001100110100110000011011000100110110100100001011010011111111111111110,DLFCQGUYPNLBSJ-UHFFFAOYSA-N
CC1=CC=C(C=C1)C2=CN(C(=N2)C3NCCCC3)C[C@H]4[C@@H](CNC4)C5=CC=C(C=C5)Cl,6A0E9BF6463918E0_884C633D507AF8A4_6034_UN,7.9617305,00000000000000000000000000000000000000100000000000000000000000100100000000010101101101110011000010101001100100010000001011100100110100100110001011011011010110101111010,JTKIGJNFWQBEKA-GXBCDIMNSA-N
C2(=CC1=C(C(=CC=C1)F)S2)NC[C@@H]3CCCN(C)[C@H]3C4=C[N](N=C4)C,3E475D4B8EC4F322_AABFF3DBAD25F123_7022_UN,7.9217687,00000000000000000000000000000000000010000010000100001000000000100100000000010000111101111011011010101100010110010001101011101100110001110110001001011111010110101111010,JOUIKKTZJAATKW-KBXCAEBGSA-N
FC2=C1C=C[N](C1=CC=C2)CC45OC3(CCNCC3)C(C4)(N)C5,B929037E8121096E_A4CAC81B8FED019A_6034_DP,8.661252,00000000000100000000000000000000000000000010000000000000010000000110000000010000001111110011000111101100110100011000001011100100110111100110001001011001110111100111110,KZBLEUUDKOEIPB-UHFFFAOYSA-N
BrC2=C1C=C[N](C1=CC=C2)CC45OC3(CCNCC3)C(C4)(N)C5,37871D961F69143B_8C4B8F64488006F0_6034_DP,8.661203,00000000000100000000000000000000000000000000001000000000010000000110000000010000001111110011000111101100110100011000001011100100110111100110001001011001110111100111110,JSJAXWIEAZBQPO-UHFFFAOYSA-N
ClC2=C1C=C[N](C1=CC=C2)CC45OC3(CCNCC3)C(C4)(N)C5,A7209B33C76D24CD_461D5735C648A43C_6034_DP,8.661197,00000000000100000000000000000000000000000000000000000000010000000110000000010000001111110011000111101101110100011000001011100100110111100110001001011001110111100111110,GKXGDRABFDIEFH-UHFFFAOYSA-N
FC2=C1C(=C[NH]C1=CC=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,76686E0E6B375286_F7B492145C3C9F05_6041_UN,8.049317,00000000000000000000001000000000000000000010000000001110000000100100000000010001101101010011011010101100010100010000001011101100110101110110001011011011010110101111010,APXWOEDPAOXSFN-SZNDQCEHSA-N
O[C@H](CF)C1=CC(=CC=C1)NC23CC(C)(C2)OC34CCOCC4,62A5E208FC211C51_6C92084FDF80E241_6041_UN,8.346231,00000000000100000000000000000000000000000010000000000000010000000010000000000000000100100111000111100000110011011001001010000000110111110111000001110001110111111111110,GMTYPXKCBZQWGT-KLAILNCOSA-N
O[C@H](CCl)C1=CC(=CC=C1)NC23CC(C)(C2)OC34CCOCC4,ACBD7378D9E2A300_213CD4CEE85B4916_6041_UN,8.346218,00000000000100000000000000000000000000000000000000000000010000000010000000000000000100100111000111100001110011011001001010000000110111110111000001110001110111111111110,FTIVVZVQYAZYKJ-KLAILNCOSA-N
NCC(COC1=CC(=C(C)C=C1C2CNCC2)Cl)CC=C,324AF669116A6581_A0CBD97FFCB91BB4_6035_UN,9.006443,00000000000000000000000000000000001000000000000000000000000000100000000000000000001110110011000011011001100101010100001001000011010100100110001110010011110101101111110,PYIGRNKUBOGTEL-UHFFFAOYSA-N
C1CC(CCN1)C2=CN(C3=C2C=CC=N3)CCC4CCCN(C)C4,8548C1DC90E4E6EE_98F7A1BDD1397F83_6034_UN,7.850911,00000000000000000000000000000000000000100000000000000000000000100100000000010100001101100001010010101100110010010001101011100100110000000110001001011001010110101111010,AXUJQVUKERQXCK-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,3135CE848660A168_2505B01E8B7D0B76_6038_UN,8.150346,00000000000000000001000000000000000000000010000000000000010000000100000000010001101101110001100111101100110100110010011011100100110010100110001011011011111111111111110,FWKGIONLZDUCRB-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CC3(OCC2)CCC3)F,F3E0E0ED24140EB1_A650564A647985F0_7022_UN,7.5772123,00000000000100000000000000000000000000000010000000000000010000000010000000100000001001110011010000101000010101001001001000100000110011110110001011011111110111101111110,HLLOLKQGHIHKDR-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C2CC2)NC[C@H]4[C@H](C3=NC=C[N]3C)OCC4,3CD1B34859307F2F_818E487DD6D7DC52_6041_UN,8.245615,00000000000000000000001000000000000000100010000000000000010000100100000000010101001101010011010111001000000101000000001011100100110011110110001010011011110111101111110,PUOGACXOCFBNQO-SUMWQHHRSA-N
O=[N](=O)C1=CC2=C(C=C1)C=C(C=N2)NC4=C3OCCCC3=CC(=C4)F,45E8F81C852E9CDD_F8E4DE8E5583826D_6041_UN,8.248969,00000000000000000000000010000000000000000010000001000000110000010100001100000001100000010001001100100110010101000100001111101100101011110100001011111001110011110111110,IFWYQGZNVWWRPL-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC3CCNC34CC4,CC95E8AFC8E7337C_9A6697A16A3F6ABA_6041_DP,7.84173,00000000000000000000001000000000000000100000000000001100000000100110000000010101101100000011011010001000110010011000001011101100110101010110001010011111010110101111010,AXZFVIWXVGQLOK-UHFFFAOYSA-N
N(CC1CC2CC1C=C2)C(=O)[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,F30ADDDB8D4417DD_065CCF8DDF9B0FC4_6038_UN,7.6844506,00000000000000000000000000000000000000000010000000000000010000100000000000000000001100010111100011011000010101100000011000000000110010100110000011010011111111110111110,IBCAFVYWVMFMMH-GMOOWRAOSA-N
N(CC1CC2CC1C=C2)C(=O)[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)Cl)F,C01A9BAD58EBCD06_65C92EAFDA7EF641_6038_UN,7.6844444,00000000000000000000000000000000000000000010000000000000010000100000000000000000001100010111100011011001010101100000011000000000110010100110000011010011111111110111110,HJAWFIYYQNKRCH-GMOOWRAOSA-N
ClC1=C(C=CC=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]5[C@H]4CNC[C@H]4C5,3DFE913DAEB47E28_DA700734061FEB01_6034_UN,8.976142,00000000000100000001000000000000000000100000000000000000000000100100000000010101001101110011000010001001110100010000001011100100110100100110001010011011010110100111010,PBBFJQNBTXQWNH-BJCQCYBXSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NC[C]3(C[C]2(C[CH2]C2)C3)C4=NC=CC=C4,D14690791716900D_FF88201F7E8545C4_6041_UN,8.043953,00000000000100000000100000000010000010000000000000000000000000100110000000100000111100101010010010101000010000001000001011000100110001010100011010011111010110101111010,MYUDUDLDHJRXDJ-UHFFFAOYSA-N
NCCCC(OC1=C2C(=CC=C1)OCCNC2)C3=CC=C(C=C3)F,0033CCB17F7F0D99_9D477800700CEE82_6035_UN,8.116055,00000000000000000001000000000000000000000010000000000000010000000000000000000000001010110110000101001100110101010100001011000111110110100110001111010001110101110111110,JCPIUGPJOASOEI-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NCC4=C(CN(C)C3CCCCC3)C=CC=C4,D620BFDA390BACC7_ED4D79E7AD61C208_6041_UN,7.7023077,00000000000000000000000000000000000000000010000000000000000000000000000000000000001001110011010010001100010110010001101000100100110001110010001011011011010110101111010,GWVQQBJIBSCETG-UHFFFAOYSA-N
FC2=C1C=C[NH]C1=CC=C2NCC3CCCN(C)C3C4=CC=CS4,C47ED97A78FE6138_18C4F464D6C9EBC4_6041_UN,8.314739,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110101110110001011011011010110101111010,TYKINGYNXSSVMA-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCCCC2N3CCOCC3)F)CC4,5233708FC2D5B1D2_86450B4160CD3008_6041_UN,7.4451637,00000000000000000001000000000000000000000010000000000000010000100000000000010001100001110011010100101000100111010001101011100000110011110110001011011011010111101111110,LJQZNORYMJCGIT-UHFFFAOYSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NCCCC3COCC3)C4,41F174B2300C0810_3110B89201868E91_6041_UN,7.40365,00000000000000000000000000000000000000000000000000000000010000000100000000010000101101100011010010101100110001010001101011100100110111010110001011011001010111101111110,PTHRTQNZMBFFTB-UHFFFAOYSA-N
C2(=C1OC=CC1=CC(=C2)F)NC[C@@H]3CNC[C@H]3C4=CN=C[N]4C,BC2644825AA4999E_954FFD0337107B76_7022_DP,7.7547865,00000000000000000000000000000000000000000010000000000100010000100100000000010101101101110011010110001100010110000000000011100100110101110110001010001011110110101111110,AYRMPAKEBHWBJT-GXTWGEPZSA-N
O=[N](=O)C2=C1N=CC=C(C1=CC=C2)NCC3C4=C(CC3)C=C(C=C4)F,15EB8F21E0EFF0A2_C6EE30B1A152B017_6041_UN,8.399321,00000000000000000000000010000000000000000010000001000000100000010100001100000001101000010011001011101110010100000000001101101100111001110100001011011001010110110111110,SSGZILJIQVLXQS-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)N[C@H]3[C@@H](C3)C4=CC5=C(C=C4)OCCO5,6FFF7C3DE0EDD91F_A8A41A62965D30AB_6041_UN,8.145775,00000000000000000000001000000000000000100010000000001000010000100100000010010101100100010010011010100100110101010100001011101100000011110110001011011011110011111111110,NMHSXAHGGNPJNV-GOEBONIOSA-N
N(C1CC2(C1)C3CCC(C2)C3)C(C4=C(CC)[N](N=C4)C5=CC=C(C=C5)F)=O,F05987230F494714_F8CFEEEF2C2CCEF7_6038_UN,8.003795,00000000000100000000000000000000000000000010000000001000000000100110000000010000100100010001101011000000110100111010011011101100110001110100001011011011001110101111110,DPOJKHLNYMFSIO-UHFFFAOYSA-N
C[N]1N=C(N=C1N[C@H]2C3=C(CCC2)C=C(C=C3)F)C4CCOCC4,2740953CFCB2538F_971D81ACE2029301_6041_UN,8.127083,00000000000000000000000001000000000000100010000000001000010000100100000000010101100100110011011010100100111101010000001011101100110011110110001011011011010011101111110,SWZBXIXBEIXVEP-MRXNPFEDSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3C(CCC3)C4CC4,C7B6757F0A019FF0_A4584820C19E86C5_6041_UN,8.203222,00000000000000000000001000000000000000000010000000000000000000100100000000000001001000010011000010101100010110000000001001000100110001110100001011010011010110101111010,TUQFNEFEXNKJOH-UHFFFAOYSA-N
CC(OCC1=NO[C@@H]2COC[C@H]12)C3=C(C=CC=C3F)N4CCOCC4,60636B64C71BB45D_2F2E1979E6B2726A_6039_UN,7.9933662,00000000000000000000000010000000000000000010000000000000010000100000000110010010000101110100001111101110010101010000101111101010110011110110101011111010110111111111110,LGAMSLOREHWQFI-QQGYXAEISA-N
C1(=CC2=C(N=C1)[NH]C=C2C3CC3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,53055B383C5B3D53_AD9A2FAF005DFA2F_6041_UN,9.0061245,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101110011010010101100110110010001101011100100000101110100001011011011010010101111010,XDAVGUCZUJMQHX-UXHICEINSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CCC3)C4=C(C=CC=C4)F,B52CF962A1984D9D_DE047F0037F3A9A5_6041_UN,7.859924,00000000000100000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,RAMHFGXJAKUPTH-IBGZPJMESA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCCC3=C2N=CC=C3)F)CC4,ACA45B287498091E_CA6D584777E30B45_6041_UN,7.8382025,00000000000000000001000000000000000000000010000000000000000000000100000000010001101001110011010000101100010110010001101011100100110001110110001011011011010110101111010,PIEZXVUDDDHMAQ-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C=C2Br)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,1E5F4F9A31ABAA80_BEAC9235AD2CA342_6034_UN,8.640831,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011110010110101111010,ZRLKQHFHAAMGJO-ZHRRBRCNSA-N
N(CC1C2CC(CC1)OC2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,F805BD69CB1C5D5D_818BE58CE6559EBA_6038_UN,8.16384,00000000000000000001000000000000000000000010000000000000010000000100000000000000101100010011100011101100010101110010011011000100110010100110001011010011111111111111110,LGCZHGDWRMNARE-UHFFFAOYSA-N
C[N]1C=CN=C1C(NC(=O)CC2CC3CCC2C3)C4=CC(=C(C=C4)F)F,8D7AF8060EC7754A_D73B766127974431_6038_UN,8.268516,00000000000000000000000000000000000000100010000000000000000000000100000000010101000101010001110010000000110100110000011011100100110010100100001011011011001110101111110,KSFVSBSDCRYVJY-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCCC2CCSC2)F)CC3,61FC0A31F7B8594F_38688470C32515C3_6041_UN,7.739153,00000000000000000001000000000000000010000010000000000000000000000000000000010001101101111001010010001000100110010001101011100000110001110110001010011011010110101111010,LABKSOSDQSMIAG-UHFFFAOYSA-N
FC2=C1C=CC=NC1=C(C=C2)NC3CN(C)C4(C3)CCOCC4,5D170779A22FEB16_A1D81A0E06AF6B17_6041_UN,8.133238,00000000000000000000000000000000000000000010000000000000010000000110000000010001100101110001010011101100110111011001101011100100110011110110001001011001010011101111110,UHUATESFXAVMSO-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CNC(C2CC3CNC2C=C3)=O)F,053B631DFB849FB7_AB4100BC98FBF34A_6038_DP,7.979925,00000000000000000000000000000000000000000010000000000100000000000000000000000000101000010010100001111000010100100000010001000000100100100110001011000011011110101111110,WNYIATDMBKAKES-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)C[C@@H]3CNC[C@H]3C)Cl,DAC4EC64352D2774_BEFCC33EFC1896CB_6034_UN,8.084302,00000000000000000000000000000000000010000000000100000000000000000100000000010110111101111011000010001001001110000001100111100100110101110110001010001111010110101111010,JRSXEKKWSGFXOV-OCCSQVGLSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2C[C@H]3CNC[C@@H]23)Cl)C4CC4,485902406E9E2899_52AB71308842F836_7022_DP,8.571414,00000000000100000001001000000000000000000000000000000000000000100000000000000000001100110011000010001001010110000000000001000000110101110110001010010011010110101111010,LVGWKOQNGCANTJ-KCQAQPDRSA-N
CN3CCC(CNC(C1CC2CNC1C=C2)=O)C3C4=CC(=C(C=C4)Cl)F,1FD0F9F605698C77_81F0EA84657CC9B3_6038_DP,7.8965855,00000000000000000000000000000000000000000010000000000100000000100000000000010000101101110011110011111001010110110001111011100000110100100110001011011011011110101111110,KWEGXPYGEOAPJG-UHFFFAOYSA-N
C[N]1N=C(N=C1N[C@H]3C2=CC=CC(=C2CC3)F)C4CCOCC4,3CF6272BB269F3B5_53785BF8E83DB481_6041_UN,8.073337,00000000000000000000000001000000000000100010000000001000010000100100000000010101100100110011011010100100111101010000001011101100110011110110001011011011010011101111110,LNWNDGGUHHUDCN-OAHLLOKOSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2N=CC=CC2=C(C=C3)Cl)C4,6A7DD52F209BC947_0EC68A5619018BBB_6035_UN,8.309203,00000000000000000000000000000000000000000000000000000000000000000100000000100000000001110000010111101101010100000101001001100111110000100100001101011110110111101111110,KFDPCZSBNJVNCM-QRDCCXFBSA-N
FC1=C(C=CC(=C1)C2CC2)NCC3=C(C=N[N]3C)C4CC4,BD9258F1C5AF6904_6B47401BF12BBA4D_6041_UN,8.247806,00000000000000000000001000000000000000000010000000001000000000100100000000010001101100010000011010001000000100010000101011101100100001110100001010011011010110101111010,WTNGUNKTJFNUMA-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)C5=C4OC=CC4=CC=C5F,027FD3A2400574B0_FD398874886EFFDD_6004_DP,8.603955,00000000000000000001000000000000000000100010000000000000010000100100000000000101100101010011010011100100110100010000101011100100110001110100001011011011100010101111110,FWHBRDFVRDLDOD-QDMKHBRRSA-N
N4CCC1(CCC1)C(C=CC2=C(Cl)[N](C(=N2)N(C)C)C3=CC=C(C=C3)F)C4,61F1809B19CE08A7_5C5BAB7F5F1615DD_7019_DP,7.5266523,00000000000100000000000001000000000000000010000000000000000000100110000000110101001101110001010010111001111100011000001011100100110001110110001011011111010010101111010,YNXKBFRUXQDUST-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)CCC2)NC4CC(C3=NC=C[N]3C)OCC4,21A29332047B0BBC_2B08647DD5E88FB8_6041_UN,7.7572575,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010011010111100100110111010000001011100100110011110100001011011011110011101111110,AJGJNLZICNSEEZ-UHFFFAOYSA-N
FC2=C1SC(=NC1=CC=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,B12B62BFFE0530D1_F2916BB16D379660_6041_UN,8.34422,00000000000000000000001000000000000010000010000100000000000000100100000000010101111101011011010010101100011100010000001011100100110001110110001011011011010110101111010,KHEDMMVBWXEFTL-ACJLOTCBSA-N
C1(=CC(=CS1)F)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,55AFF7140AD9FF95_8EFCAF52499EF7FF_7022_UN,8.211996,00000000000000000000001000000000000010000010000100000000000000000010000000100000011100011011000010001100010100001001101000000100110001110100000011010101010110101111010,HRYHXWXDNCWMPQ-UHFFFAOYSA-N
C1(=CC(=CS1)Br)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,F564ED72D9B15278_A186DBA77E50CD6E_7022_UN,8.211998,00000000000000000000001000000000000010000000001100000000000000000010000000100000011100011011000010001100010100001001101000000100110001110100000011010101010110101111010,VWNBKGFUEPYNIW-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3C4(C3)CCOCC4,A54A9A982251F24B_85C80AC95AA5F8CB_6041_UN,7.2717104,00000000000000000000001000000000000000100010000000000000010000000110000000000100001000110011000000101100010111001000001011000100110011110110001011010111010111101111110,VXTSAVBTZZGGEM-UHFFFAOYSA-N
CC1=C(C=CC=C1Br)NCCN(C)CC2COCCC2,3B5D255855CC35ED_2886DD5B6E4FDFD6_7022_UN,7.084054,00000000000000000000000000000000000000000000001000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001011011111010111101111110,QFNHMJPKCCHCJN-UHFFFAOYSA-N
CC1=C(C=CC=C1F)NCCN(C)CC2COCCC2,17DE14330DFFFBC6_252E84ECD1DDB5C6_6041_UN,7.084053,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001011011111010111101111110,ANXOMOADTAXPFR-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NCCCC3=NC2=C(CCCN2)C=C3,F5401F55FF5FCBCE_E78F6DC4EACD282F_7022_DP,7.451585,00000000000000000000100000000010000000100000000000000000000000000100000000100100001000100011010000101100110000011000001011000100100101010110011011011101010110101111010,DHNLDYYCECXUHC-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCCN(C)CC2COCCC2,61E400301E3BBB4E_F4858F47C7014BE4_7022_UN,7.0840445,00000000000000000000000000000000000000000000000000000000010000000000000000000001001001110001010001101001100111010001101000100000110011110110001011011111010111101111110,VJOHNWXBYVQYJV-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC3=C2CCCCC2=NC4=C(C)C=CC=C34,277E5994AE6AF384_803FF40E97E3E5DE_6041_UN,8.034277,00000000000000000000100000000010000000000000000000000000000000000100000000100000100000100011010000100100010000011000001001000100110001010100011011011101000010101111010,OVAUIBDMVUYYRB-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(CCC3)C4CC4,02A38A188BDC940E_54DD41B13F976564_6041_UN,7.712342,00000000000100000000001000000000000000100000000000000000000000100110000000000100001000000011000000101100010010001000001001000100110001010100011011010111010110101111010,IPZGQJXKEOMQQF-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=C1)NC3=CC2=C(CCNC2)C=C3,9E201A1D656A096D_ED4A4907294D2F22_6041_DP,7.7325754,00000000000000000000100000000010000000000000000000000000000000000000000000100000001000100001010000101100110000011000001001000100110101010110011011011111010010101111010,IUYLJBVETNABPM-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2C3=C(CCNC2)C=CC=C3,FE01F6F220AC1B64_752B91EAB0F560E2_6041_DP,7.8722816,00000000000000000001100000000010000000000000000000000010000000000100000000100001001000100001010000101100110000011000001011000100110101010110011011011111010010101111010,FRFARHURDCWLGE-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)C4CC4,062C4FA63C4598DD_A719AA0EADB07E7C_6041_UN,8.699044,00000000000000000000001000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,NKACRPKIDWHJTG-OALUTQOASA-N
C2(=C1C=CC=CC1=CC(=N2)N3CCCC3)NC4=C[N](C[Si](C)(C)C)N=C4,F5E1308B90754E70_83A0DF60D53352DD_6041_UN,7.6896596,00000000000000000000100000001010000000100000000000001000000000100100000000110101100101100001011010101100010000011001001011101100010001010110011001011101010110101111010,RMIMRTTVUSQSMI-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,BD1BCA638FFB87D7_64C7FFE9776B3ED0_6041_UN,8.386037,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011111010110101111010,CWKWEGYZZJRBIS-HXOBKFHXSA-N
FC1=CC2=C(C=C1)C(=CN2CCC3N(C)CCOC3)C4=CCNCC4,C3B8AB135ECE7E90_BFDAD5CAF48B6878_6034_UN,8.00022,00000000000000000000000000000000000000000010000000100000010000100100000000011000101101110001010110111100110111010001101011100100110010100110001001011011010111101111110,POKHZRPRMSTVJW-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3(CC2CC2)CCCC3)F)CC4,0A49D5CF6DA0D214_554EE07A25C622DC_6041_UN,8.196945,00000000000000000001001000000000000000000010000000000000000000000010000000010001101001110011010010001000000110011001101011100000110001110110001010011011010110101111010,WSHUBEMMJQLVSN-UHFFFAOYSA-N
C1(=C(SC=C1)Cl)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,80225EC757911C5C_3E034C6E24D0F149_7022_UN,8.330695,00000000000000000000001000000000000010000000000000000000000000100100000000010101111101011011010010101001000100010000001011100100110001110110001010011011010110101111010,DEYFPOKBSBRESF-WBMJQRKESA-N
C1(=C(C=CC=C1)C2CCC2)NC3=C[N](C[Si](C)(C)C)N=C3,B54E70759C79451A_025ADAA9A3F84A5F_6041_UN,7.3705387,00000000000100000000100000001010000000000000000000001000000000100100000000110001100100100001011010001000000000011001001011101100000001010100011010011111010110101111010,YJWLTJUFKBHMLZ-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC(=C2)NCC3CCCCN(C)C3,6E9C7B0109659C96_10733472F9E7148A_6041_UN,8.422714,00000000000000000001000000000000000000000010000000000000000000000100000000010000101101110011010010001100010110010001101011100100110101110110001000011001010110101111010,AMZGZZQSOLYVNN-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2CCCCN2CC3=CC=CC=C3)Cl)C4CC4,6AF3A0E2DB921072_72E069423F1A1C08_7022_UN,8.170433,00000000000000000000001000000000000000000000000000000000000000100000000000010001001001110011000000101001000110010000001001100100110001110110001011011011010110101111010,VPLYWFKVBULXDP-FQEVSTJZSA-N
N(CC1CC2CCC(C1)O2)C(=O)C[N]3C=CC4=C3C=C(C=C4)F,7ADC6429C7B38385_5132A35BD25117D2_6038_UN,7.8431563,00000000000000000001000000000000000000000010000000000000010000000100000000010001001101010010100110101100110100110000011011100100110010100110001001011001111111110111110,NBVVZXWGDSIPFS-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4C(C)OC5=C(C=CC=C45)F,58977B6074E08F42_66B3C338933F2CC4_6041_DP,8.443821,00000000000000000001000001000000000000100010000000000000010000000100000000000100100101010011010111100100111100010100101011100100110101110100001011011111100011101111110,QOLQDBIAEIKJOF-LBMZPXBWSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2CC3CCN(C)C3C4=CC=CC=C4)C5CCNCC5)F,BA6FD6234A8BB723_EC11532DC60F5254_6034_UN,8.5397835,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110001010010101000100110010001101011100100110000100110001011011011010110101111010,KJBUHGBOTSERGY-UHFFFAOYSA-N
FC2=C(C=C1C=CC=CC1=N2)NC3CN(C)C4(C3)CCOCC4,F765FB23A0E50EEB_0619F163FBB0734F_6041_UN,8.053151,00000000000000000000000000000000000000000010000000000000010000000110000000010001100101110001010011101100110111011001101011100100110011110110001011011011010011101111110,RLHSGCCYWCURJF-UHFFFAOYSA-N
N(C1=CC(=CC(=C1)F)F)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,04AE29B68C7CADDF_523A653A2153FE6C_6038_DP,7.716428,00000000000100000000000000000000000000000010000000000010000000100010000000000001001100010011100110001000110100111000010001000000010101110100001000000001011010100111110,OUJBWQOGGUBZPJ-LNVNLZDRSA-N
CC1=C(C=C(C(=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)F)[N]5C=CC=C5,7A0453504D22B784_04D3F176860D4090_6041_UN,8.106703,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011111010110101111010,WUNUBVNLEFSHRK-KOSHJBKYSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2CC4(CC3=CC=C(C=C3)F)CCNC4,21216FA1A7010A2D_AAE9D1F6CDFC09EB_6034_UN,8.408321,00000000000000000000000000000000000000000010001000000000000000000110000000010000101101110011000010001100110100011000101011100100110000100110001011011111010110101111010,SRKVXGDPJYZVMF-UHFFFAOYSA-N
N1CCOC(C1)C2=CC=C(C=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,94E8EBE81BD2ED2F_068B6ECC4A65F7FA_6041_DP,8.186339,00000000000000000000000000000000000000000010000000000000010000100000000000010001101101110011010110101000100111010001101011100100110111110110001001011011110011101111110,RKLZKORGCGMGKV-TYVLQRECSA-N
CC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]4[C@@H](CCNC4)C5=CC=C(C=C5)F,C8001B37476F76E2_42373C0FA7CC0D43_6034_UN,8.029637,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101000100100010000001011100100110100100110001011011011010110101111010,MVGQPGDVVKVXEO-GXBCDIMNSA-N
FC2=C1C=CC=NC1=C(C=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,7320411E98AD86FF_DF743B42736557C0_6041_UN,8.550266,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,WBAJZSOIYPMLTH-QRQCRPRQSA-N
C[N]1C=CC2=C1N=CC(=C2)NCC(N3CCOCC3)C4=CC=C(C=C4)F,0E2EA29F23866C30_38871C8D603C0A62_6041_UN,7.510891,00000000000000000000000000000000000000100010000000000000010000000100000000010101001101110001010110101100010101010000001011100100110011110110001001011001010111101111110,CLFWSOGGJWODDY-UHFFFAOYSA-N
CC1=NC4=C(C(=C1C2CC3CCC2C3)CC)C=CC=C4,D0E8125997EDD789_38615141FDB24CFD_2201_UN,8.97039,00000000000000000000000000000000000000000000000000000000000000100100000000000000000000000000000010100100010010000010001001000100110000000100000011010110000110001111010,TVBZOTJNZMVEAD-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2CC=CCC(C)C)C3CCNCC3)F,E9C5785292B73171_44B315F270DB4920_6034_UN,9.03382,00000000000000000000000000000000000000100010000000000000000000100100000000110101001101110001000010111000100100010001001011100100110000100110001011011111010110101111010,LOYSELIWAKFQTC-UHFFFAOYSA-N
OC(CBr)C1=CC=C(C=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,5DB994D282889956_8EC6502EC142360C_6041_UN,9.030342,00000000000000000000000000000000000000000000001000001000010000100100000000010000101101100001011110101000100011010001101011101100110111110111001001011111110111111111110,HKNIDHVRRUXFBU-FQECFTEESA-N
OC(CF)C1=CC=C(C=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,18420D064AE78123_F91833A963C9E167_6041_UN,9.030334,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101100001011110101000100011010001101011101100110111110111001001011111110111111111110,YBMBQGJHHTUYBH-FQECFTEESA-N
FC2=C(C=C1C(=CN(C1=C2)CCNC(CC)C)C3=CCNCC3)F,B51A8FA5898043A7_F72C9B0309172DFD_6034_UN,8.692879,00000000000000000000000000000000000000000010000000100000000000100100000000011001001101110001000010111100110110010011101011100100110100100110001011011111010110101111010,XTABRSBLBHUSDE-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC3=C2CCCCC2=NC4=C(C)C=CC=C34,CADC2253629AC892_D2FD96B5E1A18C4D_7022_UN,8.031209,00000000000000000000100000000010000000000000000000000000000000000100000000100000100000100011010000100100010000011000001001000100110001010100011011011101000010101111010,JGFIQABMGUWMGS-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC34CC(OC3)CCO4,2C716E2A76FDD715_9C22DEF593F2A1FB_6041_UN,7.971572,00000000000000000001000000000000000000000010000000001000010000000110000010010000101100010111011111101100010101001000001011101100110011110110001001011001110111111111110,DEXYVDBFYMEEIO-UHFFFAOYSA-N
C(C1(CC1)C2CCCO2)=CC3=C[N](C)C4=C3C=CC(=C4)Cl,C4FA5B0DB811BFCD_4E5EE8804EC7D5BD_7019_UN,8.213638,00000000000000000000001000000000000000000000000000000000010000100110000000010000000101010000010010010101010101001000001011100100110010100100000000011000110011101111110,FEIQLJFXKAZCQN-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1C[C@@H]2CNCC[C@@H]2C3=CC=CC=C3)C(=CC(=C4)F)F)C5,3F6B83996F210543_C39E4B3A09ED5F44_6034_UN,8.218918,00000000000000000000000000000000000000000010000000000000000000100110000000110000101101110011000010101100110100011001101011100100110000100110001011011111010110101111010,LCWMWMKUUYGLBR-AZUAARDMSA-N
CC1=C(C=C(C=C1)F)NCC3(C)CCOC2(CCC2)C3,3336C67B8D4B68ED_3B1DE2112C0C979A_6041_UN,7.89083,00000000000100000000000000000000000000000010000000000000010000000010000000000000001000010011000000101000010111001001101000000000110011110110000011010111110111101111110,HBTONGJEMVQHIB-UHFFFAOYSA-N
CC1=C(C=C(C=C1)Cl)NCC3(C)CCOC2(CCC2)C3,E35A9B7B905217BC_20959CF9569BD3ED_7022_UN,7.8908205,00000000000100000000000000000000000000000000000000000000010000000010000000000000001000010011000000101001010111001001101000000000110011110110000011010111110111101111110,WNPRNMOBFFIZRE-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1C[C@H]3[C@H]2CNC[C@H]2OC3)C=CC(=C4)Br)C5,A4A5B985E99B8A06_8CB22D0246847E3E_6034_UN,8.546558,00000000000000000000000000000000000000000000001000000000010000000110000000110000001101110001000111001100010101011001101011100100110010100110001011011101110111101111110,VAWQXSADSBESDZ-YXKFXFPPSA-N
CC1=C(C=C(C(=C1)NCC(CC)C2CCOCC2)F)F,85B74724A158F2D5_628517FFBC6EBE58_7022_UN,8.14402,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110011000000101000000111000010101000000000110011110110000011010111010111101111110,IPHCBEJJBLKYNS-UHFFFAOYSA-N
FC2=C1C=NC=CC1=CC(=C2)NC3CCN(C)C34CCCNC4,9F136965B6A64C0F_2DE23CACB51CA966_6041_DP,8.526632,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,JNFZECVSTBVGAE-UHFFFAOYSA-N
N(CCC1C3CC2CC(CC1C2)C3)[S](C4=C[NH]C5=CC=CC(=C45)F)(=O)=O,A703788F0BAD4C32_45318FA6B36DAA02_6029_UN,7.9634295,00000000000000000000000000000000110000000010000000010101001111001101010001000000111100011000001011001110111100011000011001001100111100101100001001011001010110110111110,WIQSYFAVLKEOHT-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC3CC4CCC(C3)O4,1200E72F02281355_D41A3D72361D210D_6041_UN,7.80698,00000000000000000001000000000000000000100010000000001000010000100100000000010101101100010010011010101000010100000000001011101100110011110100001011011011110111101111110,ZYVMGOHUIPQXIT-UHFFFAOYSA-N
FC2=C1C=CN(C1=CC=C2Br)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,E4E254A555A38D45_80FEB7F6CD9D03C3_6034_UN,8.907639,00000000000000000000001000000000000000000010001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,YIQSIBPSCIAUIZ-SZNDQCEHSA-N
FC2=C1C=CN(C1=CC=C2Cl)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,74F055352E07BC61_FA21A4BE44640910_6034_UN,8.907637,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101101010100010000001011100100110001100110001011011010010110101111010,YLVYXTRCPUEDNJ-SZNDQCEHSA-N
FC1=C(C(=CC=C1)C2CC2)NCC3N(C)CC4(CC3)CC4,4FE6AF3C3090D186_D7A443BAB635E144_6041_UN,7.782706,00000000000000000000001000000000000000000010000000000000000000100010000000010001001001110011010000101000010110011001101001100000110001110110001011011011010110101111010,AVKNWMZBZLRITH-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3CCCCCC3C4=CC=CC=C4,A58B99B64660FE29_86EDBE6BC854B6CE_6041_UN,8.123359,00000000000000000001000000000000000000000010000000001000000000100100000000010000100100010011011010000100110100010000001011101100110001110100001001011011000010101111010,QMDUKNUUPZOGTH-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2C(C)(CCCO2)C)F)CC3,E7B361C7423487F1_A5B463476116EBB8_6041_UN,7.685546,00000000000000000001000000000000000000000010000000000000010000000010000000110001101001110001010100101000000111011001101011100000110011110110011011011111110111101111110,QKIAPKMHOVJTNH-UHFFFAOYSA-N
C(C1CC2CCC1CC2)=CC5=CC3=C([N](N=C3C)C4=CC=CC=C4)N=C5Cl,B87622E887395EFE_206648DECDB7048B_7019_UN,8.138756,00000000000000000000000000000000000000100000000000001000000000100100000000010101100100010000001010110101010100000000001011101100110001110100001011011010000010101111010,PDFLHTGJFQUTBO-UHFFFAOYSA-N
CC1=NN=C(O1)C2=C(C=C(C=C2)NC4C[C@H]3CCC[C@H](N3C)C4)F,9A3E77836AF05AFF_8A872099A5CBE203_6041_UN,8.45883,00000000000000000000000000000000000000000010000000001000010000100100000000010000100101010001111110100100110110110000111011101100110001110100001011011111000010101111110,ULOXNKZEIBQZBK-GOOCMWNKSA-N
CC1(C)CCSC2=C1C=C(C=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,A9BD933401B2FB67_B5015EB8915B84D4_6041_DP,7.473401,00000000000000000000000000000000000010000010000000000100000100100010000000100000111000111011000000101100110100011001101011000100110101110110001011010111010110101111010,XRUICFKPSLZVGQ-FXAWDEMLSA-N
CC1=C(C=CC(=C1)F)N[C@H]2[C@@H](OCC2)C3=C[N](N=C3)CC4CC4,99098BB0CD244840_5F3C9892958EF921_6041_UN,8.6365,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011001111001000100101010000001011101100010011110110001010011011110111101111110,MCVJFWNSRRONCU-MSOLQXFVSA-N
FC2=C(C=C1C=C[NH]C1=C2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,B483B1CD9D7D3DDB_14B941EC6000F834_6041_UN,8.284171,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110001010110101100010111010001101011100100110111110110001011011011110111101111110,VUPDOOCTOSXCJR-PMACEKPBSA-N
FC1=CC=C(C=C1)C(CCC=C[C@@H]2CCO[C@H]2C3=NC=C[N]3C)C4=CC=C(C=C4)F,28F9A718362359A6_8917655CEEA7AA3F_7019_UN,8.45177,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010000010110010000000101000000001011100100100010100100001011011010110111101111110,KISBEDALMUQDSJ-HYBUGGRVSA-N
O[C@H](CCl)C1=CC=C(C=C1)NC23CC(C)(C2)OC34CCOCC4,42C31E4E53168A25_AE5772D41F10F2E0_6041_UN,8.327462,00000000000100000000000000000000000000000000000000000000010000000010000000000000000100100111000111100001110011011001001010000000110111110111000001110001110111111111110,DRRZLHRZOKQYQK-KLAILNCOSA-N
FC2=C(C=C1C(=CN(C1=C2)CC(CC)N(C)C)C3=CCNCC3)F,1D9A962997346937_4C5F15008B9AAA66_6034_UN,8.201155,00000000000000000000000000000000000000000010000000100000000000100100000000111001001101110001010010111100110100010010101011100100110000100110011011011111010110101111010,JZAKZYGWWLAZHO-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CC4(NCC3)CC4,75BACA0F8DDA2923_D82FDBF02FB9D2CE_6041_DP,7.6717434,00000000000000000000001000000000000000100000000000000000000000000110000000000100001000000011000000101100110010011000001011000100110101010110011011010111010110101111010,LCNUCPAEJOOGJK-UHFFFAOYSA-N
C[N]1C=CN=C1C(NC(=O)C2CC3CCC2C3)C4=CC(=C(C=C4)F)F,ABC6A8740082C195_CA2D35AB6A05912F_6038_UN,8.345315,00000000000000000000000000000000000000100010000000000000000000000100000000010101000101010011110010000000010100100000011011100100110000100100001011011011001010101111110,SUKQFQMZPCWHBO-UHFFFAOYSA-N
CC1=C(C3=C(C=C1)N=C2CCCCC2=C3NC(CC)C4CC4C)F,91FBF4A81B9ECAE2_84315EB099672EFA_6041_UN,8.164994,00000000000000000000001000000000000000000010000000000000000000000100000000000000100000010011000000100100110110010011101001000100110001110100011011010111000110101111010,JXJVNITUASFNRS-UHFFFAOYSA-N
N4CCC1(CCCC1C=CC2=C(Cl)[N](C(=N2)N(C)C)C3=CC=C(C=C3)C)CC4,5F080B10D059293E_546A07686B201B37_7019_DP,7.510045,00000000000000000000000001000000000000000000000000000000000000100110000000110101001101110001010010111001111100011000001011100100110001110110011011011111010010101111010,SZZXTNHNDBFVGF-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3CC2CCNCC2CC3)F)CC4,2D90DAB05B9C69CA_28E91B1BD5CCE46E_6041_DP,8.2873125,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010000101100110110010001101011100000110101110110001011011011010110101111010,GONUINQJPQNIOV-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)CCOC2)[S](C4=CC3=C(C(=C[NH]3)CC)C=C4)(=O)=O,10E637B24ABC6113_E96747A1CA98D1E7_6029_UN,8.748004,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100101011001010101110011001001010011011001100111110001110001011111001010111111111110,MXOMRAJJNUUCHP-UHFFFAOYSA-N
FC1=CC(=CC=C1)C2=CSC(=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,2F2048347DFD81A7_00532E3D6C4D1399_6041_UN,8.549717,00000000000000000000001000000000000010000010000100000000000000100100000000010101111101011011010010101000000100010000001011100100110001110110001011011011010110101111010,IQGWMCACSGGAOC-HXOBKFHXSA-N
CC1=CC(=C(C(=C1)NCC3(CC2(CNC2)C3)C4=CC=CC=C4)F)C#N,F4DF6CF95B7FBB1A_203AB6D7572EC352_6041_DP,7.713658,00000000100100000000000000000000000000000110000000000000000000100010000000000000001000110010000000001000010100001000000001000100100101110110001011000011010110101111010,IWIICXTUEVWNCE-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4C(C)(C4)C5=C(C=CC(=C5)F)F,7FDAEB07EB8CED1E_68BEC5DD8C5073C5_6041_DP,8.367615,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011001100011100100110101110110001011001111010010101111010,HNWKCCSGWNJOPQ-PXIGHNNKSA-N
CCNC4CCC1=C(C3=C(N1CC2CCNC2(C)C)C=CC(=C3)Cl)C4,8DA6ACC2CCB5A9ED_4FDD40EC67CBA373_6034_UN,8.109377,00000000000000000000000000000000000000000000000000000000000000000110000000110000101101010011000010001101110110011010101011100100110101100110011011011111010110101111010,BZFDQKJFJGGJAA-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NCC3CCC34CNC4,C0F0F56095839935_C3907D5B8FA27E37_6041_DP,8.207785,00000000100100000000000000000000000000000010000000000000000000000110000000100000101000110011000000101100010100001000001011000100110101110110011011010111010110101111010,ACBQFGBPMLAKLP-UHFFFAOYSA-N
FC1=CC2=C(C=C1)[NH]C=C2NCC4CC3(CCN3C)C4,A91FE0CA0CB929D1_F49A30259D4F2798_6041_UN,8.384921,00000000100100000000000000000000000000000010000000000110000000000110000000010001101101110011010010001100010100011001101011100100110101110110001000011001010110101111010,PTFRDLLZDCZFIC-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC[C@@H]2CCCN(C)[C@H]2C3=CC=CC=C3)C4CC4,82BA00470A6B9DCD_479DDE8197B2109A_6041_UN,8.387039,00000000000000000000001000000000000000000010000000000000000000100000000000010000101001110011010000101000000110010001101001100100110001110110001011011011010110101111010,XZTKFFYMLURYMG-AVRDEDQJSA-N
CN3CCN(CCOCC2COC1(CCOCC1)O2)CC3,FB64F0802C97E599_3BA32A05961B32DC_6039_UN,7.019068,00000000000000000000000000000000000000000000000000000000010000000000000010010001000101100100010110101000010001011001101011110010110010000110101001111000110101111101110,YUMJWXDANVTSQB-UHFFFAOYSA-N
FC2=C(C=C1C=C[NH]C1=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,84AF15F5A9CC3CEF_17618B6AE32FFDFA_6041_UN,8.518956,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110101110110001011011011010110101111010,LHIMXEYDWVPONI-VFNWGFHPSA-N
CC1=C(N=C(S1)NCC[C@@H]2CC[C@H]3C[C@@H]2C3(C)C)C4=CC=C(C=C4)F,604AA14DCDA6D4FA_F55CFAA859E00DF4_6041_UN,8.186209,00000000000100000000000000000000000010000010000100000000000000100110000000100100011100011001000010001000111110011000101011000100110001110100011011010111010110101111010,CUTWUFBGYVFQRO-ZVZYQTTQSA-N
N4CCC1(CCC1)C(C=CC2=C(Cl)[N](C(=N2)N(C)C)C3=CC=CC=C3)C4,5FA474B2CECAAC79_0B761C1D84788EF1_7019_DP,7.201727,00000000000100000000000001000000000000000000000000000000000000100110000000110101001101110001010010111001111100011000001011100100110001110110001011011111010010101111010,NYDRUDBLIRCXOA-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2CCOCC23CCCCC3)F,FC0B8531276DC485_7E4711E05ABE4858_6041_UN,7.433093,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110011010001101000110101011001001000100000110011110110001011011111010111101111110,ZDVNZNJZCRIWQZ-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CC3)C4=C(C=C(C=C4)F)F,76F8B532D889D552_227B1AACB4852E05_6041_UN,7.9987736,00000000000000000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100010001110100001010011011010110101111010,LABWHXOSIUCJBP-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C([N]1CCC2CCCNC2)C=CC(=C3)Br)C4,5A91ED4803BD7D3E_7EFE9E7D4B93F91E_6034_DP,8.022627,00000000000000000000000000000000000000000000001000000000000000000110000000110000001101110011000010101100110100011001101011100100110000100110001011011101010110101111010,ZKUPOELBBSZNGQ-UHFFFAOYSA-N
O([C@@H]2CC[C@@H]3CN(CC1=CC=CC=C1)C[C@H]23)CC4COCC(C)(C)O4,C33FA132C983355F_4EF69D10017CD9AB_6039_UN,8.503771,00000000000000000000000000000000000000000000000000000000010000000010000010110000000101100100000011101100010011001001001011100011110010000110000101111100110101111111110,SPYGCBJFTAAQTI-ZZQCPNMFSA-N
C1(=CC2=C(N=C1)C(=CC=C2)F)NCC3C[Si](C)(CC3)C,3C206F3A8CCAFDD4_DB01C6D885147816_7022_UN,7.667448,00000000000000000000100000000010000000000010000000000000000000000100000000100001001100110011010010101100010110001001101011000100110001110110001001011101010110101111010,RYNBXJRFWABPNI-UHFFFAOYSA-N
C1(=CC2=C(N=C1)[NH]C=C2C3CC3)NC4CCCC5=C4C=C(C)[N]5C,16632656D5ABCD58_DD24FE03DA3BB4EB_6041_UN,8.434889,00000000000000000000001000000000000000100000000000000000000000100100000000010101100101000011010010100100110010010000101011100100100101010100001011011111000010101111010,QNPIBBIHPZYFBA-UHFFFAOYSA-N
C[N]1N=C(N=C1NC2=CC(=C(C=C2)N3CCCCCCC3)F)C4CCOCC4,CA26F5D0DFF43BDB_CC2604CEFD06AD26_6041_UN,7.8779817,00000000000000000000000001000000000000100010000000001000010000100100000000010101100101110000011010101100001101010000001011101100110011110110001011011011010011101111110,VBKMKSMNUNRGNR-UHFFFAOYSA-N
FC1=C(C=C(C=C1)CC=C)NC2CN(C)C3(C2)CCOCC3,4AC645E2330DED67_7AC05B02018A03D4_6041_UN,7.421531,00000000000000000000000000000000001000000010000000000000010000000010000000010001100101110001010011111000110111011001101011100000110011110110001011011011010111101111110,IWUSXKORBAEULZ-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NCCC3CNCC(C)O3)C,938A4EE1A9017C94_3341873E294119D5_6041_DP,8.451537,00000000000000000000000000000000000000000010000000000000010000000100000000000000101000110011000101101100110110010001001011000100110111110110011011010111110111101111110,VBZNGBMUGHATON-UHFFFAOYSA-N
CC(C)(C#N)C1=C(C=C(C=C1)NCC23CC2CNC3)F,94E8FA6D21A9AF10_F55F9F22DF4F3BF3_6041_DP,8.2158785,00000000000000000000001000000000000000000110000000000100000000000010000000100000101100110011000010101000010100001000000001000000110101110110001011000111010110101111010,LGNXTSGPYMGKOK-UHFFFAOYSA-N
CC(OCCC2COC1(CCCC1)O2)CC3CCCCN3C,EC9B2AC42880538E_63B692DFC2B51737_6039_UN,7.474169,00000000000000000000000000000000000000000000000000000000010000000000000010010000000101100100010011101000010011011001101011110010110010000110000000111110110111111101110,BWFFNKAFFSPERH-UHFFFAOYSA-N
C(CC1CCCCO1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,7780DC66155C4434_BD42B0CA875AB7C5_7019_UN,7.966564,00000000000000000000000000000000000000000010000000000000010000000000000000000000000001010000010010110000000111010000101000100000110011110100000011011010110111101111110,ONETZUPFEUWBTE-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3CC4(CC3)CCCCC4,6DC68A810A10685D_F19FB5CE7A2B9C88_6041_UN,7.895645,00000000000000000000000000000000000000000010000000001000000000000110000000010000100100010011011010000100110100011000001011101100110001110100001001011001000010101111010,JTBQOPPCOUBXRN-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)C#N)F)NC(C2CNC2)C3=CC=C(C=C3)F,EEF8CF1B768CAE93_8B512C6F12ACA847_6041_DP,8.102643,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110010000000001000000100000000000001000100000101110110001011000011010010100111010,ONXQTPVEVAFUAF-UHFFFAOYSA-N
FC1=C(C=CC=C1)C2=CN(C(=N2)C3CCCN3)C[C@H]5[C@H]4CNC[C@H]4C5,930180318839023E_4FC725F872CF2C11_6034_UN,8.862114,00000000000100000001000000000000000000100010000000000000000000100100000000010101001101110011000010001000110100010000001011100100110100100110001010011011010110100111010,IXQDCJRDOYERJL-BJCQCYBXSA-N
CC2=C1[NH]C=CC1=CC(=C2)NCC3N(C)CC4(CC3)CCC4,6E76E013D4C415FC_A480EE7597BD92AE_6041_UN,7.832839,00000000000100000000000000000000000000000000000000000000000000000110000000010001001101100011010010101100010010011001101011100100110101010110001001011111010110101111010,CYNBJICFKSARGD-UHFFFAOYSA-N
C1(=C(C=CC=N1)Cl)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,F94A04DD2B7A9D67_94CE2913445704F0_7022_UN,8.308584,00000000000000000000001000000000000000100000000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,PQBKHQQVAYDJQC-DYVFJYSZSA-N
FC1=CC4=C(C(=C1)NC2CCN(C)C23CCCNC3)C=CO4,76BCDA29C99C0E23_74164792420A8BC3_6041_DP,8.248102,00000000000000000000000000000000000000000010000000000100010000000010000000010001101101110011010011101100110110011001101011100100110101110110001001011001110010101111110,UTPGACRSRCGAGX-UHFFFAOYSA-N
C1(=CN=C(C=C1)NCC2CCCO2)C3=CC(=C(C=C3)F)CN(C)C,00FA40BA3895ED2D_AE5E19AF332D1564_6004_UN,7.6230597,00000000000000000000000000000000000000100010000000000000010000100100000000100100001101110011010110101000000101000001001011100100110011110110001011011111110111101111110,GZPAWCSZJVYVJN-UHFFFAOYSA-N
FC2=C1C=NC=CC1=C(C=C2)NC3CN(C)C4(C3)CCOCC4,2E0ACB39EBDE16BC_19FCC25EE1642BE1_6041_UN,8.334932,00000000000000000000000000000000000000000010000000000000010000000110000000010001100101110001010011101100110111011001101011100100110011110110001001011001010011101111110,MHJNFXDIWIEVEF-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)OCCC2)C(C4=CC3=C([N](C)C=C3)C=C4)=O,ACBF9C3E6D37B996_579ADF8AFE2E6E15_6038_UN,8.901237,00000000000000000000000000000000000000000000000000000000010000000100000000010000000101000001110010100100010001100100011011100100100011010100001011011001111011111111110,JFXVPLUEWWQGNE-UHFFFAOYSA-N
C2(=C1C(=CSC1=NC(=N2)CN3CCCCC3)C4=CC=CS4)NC5CC[Si](C)(CC5)C,37916E251A9ABECA_797246CBFD1FBCDF_6041_UN,8.256777,00000000000000000000100000000010000010100000000100000000000000100100000000110101110101101011010010101100110000011001101011100100110001010110001001011101010110101111010,KHNBRMPZJURLHA-UHFFFAOYSA-N
N(C1C4C2CC5C3CC(C1C23)C45)C(C6=C(OCC)OC(=N6)C7=CC=C(C=C7)F)=O,CA9157B9A9C427C1_21C631F3BC0D138B_6038_UN,8.561404,00000000000000000001000000000000000000000010000000000000010000100100000000000001000100010101100111000100010101100110010011010111110001100100001111100011011111111111110,RETHOUWOSRHRFA-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C=C)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,6665CB5B59A93AFB_00FD9ADA677557FE_6041_UN,8.65907,00000000000000000000001000000000001000000010000000000000000000100100000000010101101101010011010010111000000100010000001011100100110001110110001011011011010110101111010,DLKSMNMRIQPKOX-IERDGZPVSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC4(CCCC4)C5=C(C=CC=C5F)F,8256390D269A3960_D3412CFB246C9EE3_6041_DP,8.228273,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010010101111010,NPCBXTVCCKBNEW-RAKKMVLPSA-N
FC1=C(C=C(C=C1)C3=C2C=CC=CC2=C(N=N3)NC[C@@H]4CNCC(O4)(C)C)F,ED6F676BC0574083_712DED1DAF19F01A_6041_DP,8.282413,00000000000000000000000000000000000000100010000000001100010000100110000000100101101000110010001100101100010110001001000011001100100111110110001011000111110111101111110,WEIBUBVFOIHGJM-AWEZNQCLSA-N
N4C[C@@H]1COC[C@]1(C=CC2=C[N](N=C2C)C3=CC=C(C=C3)F)C4,7827AA9217D22560_7A16E292A46C0E39_7019_DP,8.559702,00000000000000000000000000000000000000000010000000001000010000100110000000010000101100110011001011011100010101001000000011101100110001110110001010001011010011101111110,ZIFBBVWTHWLHQV-QAPCUYQASA-N
FC1=C(C(=CC=C1)NC3CCOC(C2=CN=C[N]2C)C3)C4CC4,4EF9551D1EA7CC66_EDED97B225A48966_6041_UN,7.676783,00000000000000000000001000000000000000000010000000000000010000100100000000010101000101010011010111100000100111010000001011100100110011110100001011011011110011101111110,ZOUJPIKGJHCLDW-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,7C0654F9F90AD468_C12475587A974E98_6041_DP,8.148149,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101110011010010101000110110010001101011100100110101110110001001011111010010101111010,IZCRJSVIXKDYOR-BVBVCZNISA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CC23CCNCC3)F)CC4,EA72D1345EAC4898_0B23B80D665F780F_6041_DP,7.603445,00000000000000000001001000000000000000000010000000000000000000000010000000010001101001110011010000101000110110011001101011100000110101110110001011011011010110101111010,NECKXCMWCGQJHH-UHFFFAOYSA-N
N1C4CCC1CC(C=CC2=C[N](C)N=C2C3=CC(=CC=C3)F)C4,EBDE6CE49771EECF_5CE5E593A1039DE2_7019_DP,7.599463,00000000000000000001000000000000000000000010000000001000000000100100000000010000100100010011011010110000110100010000001011101100110000100100001011011011000010101111010,YLOQLXMRNZNZOR-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NC2CN(C)C3(C2)CCCC3)N=CC=C4,D8EC34B5C28858EA_6BF1DA2E898AAB4A_6041_UN,8.08739,00000000000000000000000000000000000000000010000000000000000000000110000000010001100101110001010010101100110110011001101011100100110001110100001001011001010010101111010,YRVLNZHSEJSZFW-UHFFFAOYSA-N
O=[N](=O)C2=C1N=CC=CC1=C(C=C2)NC4=C3OCCCC3=CC(=C4)F,B863D9DFF73BEEDB_8D220472677206DF_6041_UN,8.294238,00000000000000000000000010000000000000000010000001000000110000010100001100000001100000010001001101100110010101000100001111101100101011110100001011111001110011110111110,SWPBYYSIPXRWAH-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(COC3)C4=C(C=CC=C4F)F,022DA6CF024904A9_A0E93C533B7D7BAB_6041_UN,8.336254,00000000100100000000001000000000000000000010000000001000010000100110000000010001100100110001011110000000100101011000000011101100000001110110001010011011010011101111110,PTWPCKPDIJHDMO-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=NC=C1)NCC[C@@H]2CCCN2,29A4065EB039FF40_DC60C21B659B78A7_6041_DP,8.354507,00000000000000000100100000000010000000100000000000000100000000000100000000100100101100100011010010101000100000011000001011000000110101010110011000011101010110101111010,QOHKXAMOBBZRFK-HNNXBMFYSA-N
FC2=C1N=CC=CC1=CC(=C2)NC3CCN(C)C34CCCNC4,84A75DB020D35CDA_99F68E7C77C55471_6041_DP,8.43392,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,DAVKCRPCEVSOPH-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2OCC3(C2)CCOCC3)F,1671CEE24528D602_E7C1BD97560F4B1E_7022_UN,7.3635044,00000000000000000000000000000000000000000010000000000000010000000010000000100000001101110011010110101000010101001001001010100000110011110110001011011111110111111111110,DOJPSPOEBNCNCN-UHFFFAOYSA-N
N(C(CF)C1=CC=C(C=C1)C#N)C(C2C3CCCC2CN3)=O,EDB5B4BDD1951F8C_F3BED6647415E1EF_6038_DP,8.578143,00000000000000000001000000000000000000000110000000000100000000000000000000000000101100000011100011001000110000110000011001000000110100100110001001010001011110100111110,FPFZHVUWNBPMQS-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)C[C@@H]3C[C@H]3C4CCNC4)Cl,1E08A7F979E4F559_AB85C237A2347413_6034_DP,7.839882,00000000000000000000001000000000000010000000000100000000000000100100000000010110011101111011000010001001101110010000001111100100110101110110001010011011010110101111010,OZVVUGILKASERY-ZWBSKUQPSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC3CCCN(C)C3C4=CC=CS4,7906D186CCA4F248_A56158C77B3A32EC_6041_UN,8.162665,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011111010110101111010,MKSMHXXTUDLYEH-UHFFFAOYSA-N
FC2=C(C=C1OC=CC1=C2)NC4C[C@H]3CCC[C@H](N3C)C4,0F065A96A94E896C_D4D13F36D8A1042E_6041_UN,8.276832,00000000000000000000000000000000000000000010000000000000010000000000000000010000100101010001010011100100110110010000101011100100110001110100001011011011100010101111110,QYRMCDRJVDQGMG-AGUYFDCRSA-N
ON=C1CCCC2=C1C4=C([N]2CCC3CNC(C3)(C)C)C=CC(=C4)Cl,429336A83FBB5A07_EE0D5C98179ECF96_6034_DP,7.9102545,00000000000000000000000010000000000000000000000000000000000000000110010100110010101101010011001010001111110110011001101111101100110101100111001011011101010110101111110,FRRSAAAKHAUARW-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2C3(OCCC2)CCC3)F,DCCF45F265D3AC25_CEB9F3FD01264822_7022_UN,7.583837,00000000000100000000000000000000000000000010000000000000010000000010000000100000000001110011010100101000110101011001001000100000110011110110001011011111110111101111110,XZXZLTFJLWHTTG-UHFFFAOYSA-N
CC1=C(C4=C([N]1CC2(CC23CCNCC3)C#N)C=CC=C4Br)C,CDA4E21F79E4374B_33D9488221CBA860_6034_DP,8.392272,00000000000000000000001000000000000000000100001000000000000000000110000000010000101101110001000010101100110110011000101011100100110000100110001011011111010110101111010,XKNPOXMFNDNVLM-UHFFFAOYSA-N
CC1=C(C=C(C=C1)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F)CC=C,042B848AC741A284_890BA8C58FF8B6C7_6041_DP,8.745221,00000000000000000000000000000000001000000010000000000010000000100000000000000001001000110011000000111000100100010000101001000100110101110110001011010011010110101111010,UOOATRQJVLJJGN-NHCUHLMSSA-N
FC2=C1OC=CC1=C(C=C2)NCC3CCCCN(C)C3,FE0AA9B77E70FFB1_94DC488DC8ACF42A_6041_UN,8.138197,00000000000000000001000000000000000000000010000000000000010000000000000000010000101101110011010011001100010110010001101011100100110001110110001000011001110110101111110,APKPHWIWWPDKLU-UHFFFAOYSA-N
O[C@H](CCl)C1=CC=C(C=C1)NCC2N(C)CC3(CC2)CC3,8C459994F0008476_A158A8785013E5A2_6041_UN,8.358344,00000000000000000000001000000000000000000000000000000000000000000010000000010001001001100011010000101001110010011001101001100000110111110111001001011011110111101111110,GIHVJTMJIAGOFU-OEMAIJDKSA-N
CC1(C)COC2=C1C=CC(=C2)CC3=C(C4=C(N=C3)C=C(C=C4)Cl)C5COCCC5,4869CB1682B59305_162D0D0439D810A0_2201_UN,8.208932,00000000000000000000000000000000000000000000000000000000010000100110000000100000000100110000000010100101010101001101001011000100110010100110000011010110110111011111110,KMSHIKYOMWRWBL-UHFFFAOYSA-N
CC3=NC2=C([C@H]1CCCN[C@H]1CC2)N3CC4(CC(F)C4)C5=CC=CC=C5,E59A158EF3974908_A624E972CA2A37AF_6034_UN,8.239269,00000000000100000000000000000000000000100010000000000000000000100110000000010101101101010011000010101100110110011000101011100100110000100110001011011011010110101111010,CWSBWPMZZJZVJU-DBAFAGGRSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NCC3CCCCN(C)C3,CE339396FD789764_88DA4C9B1B999DE5_6041_UN,8.332801,00000000000000000001000000000000000000100011000000000000000000000100000000010100101101110011010010001100010110010001101011100100110101110110001000011001010110101111010,YNQLPTQUXQEGQH-UHFFFAOYSA-N
O(C(CC1=C(C=C(C=C1)F)F)C#N)CC3CCC2(CCNCC2)CO3,755ABE6BD37DA0E3_84EF7230C6A4AED5_6039_DP,8.242774,00000000000000000000000000000000000000000110000000000000010000000010000010000000001000110001000100101000110101011000001011000010110010100110001011010011110101110111110,YXMSUONRNQPEFX-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC3CCCC3N4CCOCC4,EECCF0537237BB75_162AAA0A0792D6D2_6041_UN,8.613252,00000000000000000000000000000000000000000010000000000000010000100100000000010000101001110011000110101100010101010000001011100100110011110110001011011011010111101111110,PZVGRQMCZHGORK-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCCC(C)CC3,8757739F127CF19C_B16A7BBD38280F7B_6041_UN,7.963815,00000000000000000001000000000000000000100010000000000000000000000100000000000100001000010011000000101100010110000001101001000100110001110100011011010111010110101111010,WUJPMCYSBADZHW-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC(N3CCCC3)C4=CSC=C4,50A009E32DF884C4_88D317436B4D003C_6041_UN,8.187666,00000000000000000000000000000000000010100000000000000000000000000100000000010101001101101001000010101100010010010000001011100100110001010110011011011111010110101111010,GCUCCJZUADZRDP-UHFFFAOYSA-N
CC1=C(C=CC(=C1)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,ED5228385F34F7A7_BD9E603A16E08609_7022_UN,8.127162,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110011011011111110111101111110,ZAYJNQSALOPYDG-IRXDYDNUSA-N
CC1=C(C=C(C(=C1)NCC3OC2CCCC2C3)Cl)C4CC4,C37AC63440BC7A08_40DA76FF8A7E30E5_7022_UN,7.822052,00000000000000000000001000000000000000000000000000000000010000100000000000000000001100010010000110001101010110000000001000000000110011110100000010010011110111101111110,ORBQXZHZUMHTBO-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCCC(C)C3,F8C0DBAA695F8BF8_91D3D6252D5BDC2A_6041_UN,8.290511,00000000000000000000000000000000000000000010000000001000000000000100000000010000101100010011011010001100010110000001101011101100110001110100001001011101010110101111010,KSQVVUQVACKOPW-UHFFFAOYSA-N
CN(CC1CNC1)C2=NC(=CN=C2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,85907B0B2FA13151_19E065D27D4827F8_6041_DP,8.1653385,00000000100100000000001000000000000000100010000000000000000000100100000000000101101001110011010000101000000110000001000011100100110101110110001011001011010110101111010,SIYULIIVICOAGQ-UONOGXRCSA-N
BrC1=C[N](C2=C1C=CC=C2)CC45OC3(CCNCC3)C(C4)(N)C5,3F3DF193CD0E7444_3017C31D59A7E2DB_6034_DP,8.744026,00000000000100000000000000000000000000000000001000000000010000000110000000010000001111110011000111101100110100011000001011100100110111100110001001011001110111100111110,CJPZQJZCMBSFPU-UHFFFAOYSA-N
ClC1=C[N](C2=C1C=CC=C2)CC45OC3(CCNCC3)C(C4)(N)C5,B776C681A6B9C8A6_D39B4F796DEF9DD7_6034_DP,8.744029,00000000000100000000000000000000000000000000000000000000010000000110000000010000001111110011000111101101110100011000001011100100110111100110001001011001110111100111110,MBLGEJHRTCFUEN-UHFFFAOYSA-N
IC1=C[N](C2=C1C=CC=C2)CC45OC3(CCNCC3)C(C4)(N)C5,A6C8ED933A9BE60F_4383D4729EF47247_6034_DP,8.744022,00000000000100000000000000010000000000000000000000000000010000000110000000010000001111110011000111101100110100011000001011100100110111100110001001011001110111100111110,ZMVRATUSYKNNRC-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CCC2CCCCN2)C=CC(=C3)C)C4,82C5A4B1C57E4F02_16A202C271C5563D_6034_UN,8.655804,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101000011000010101100110010010010101011100100110000000110001011011101010110101111010,BTVNVWYDHWQZIC-UHFFFAOYSA-N
CCC4CCC1=C(C3=C([N]1CCC2CCCCN2)C=CC(=C3)C)C4,82C5A4B1C57E4F02_3FBD21C3B5BFB8B1_6034_DP,8.655801,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101000011000010101100110010010010101011100100110000000110001011011101010110101111010,BTVNVWYDHWQZIC-UHFFFAOYSA-N
FC2=C(C=C1C=COC1=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,3BD486243F80BD36_99888364DAD369F4_6041_UN,8.407713,00000000000000000000000000000000000000000010000000000000010000000000000000000000100101110010010010001100010110010001101000100100110001110100001011011011110110101111110,GTVGRDVXGHJGNG-UHFFFAOYSA-N
FC1=C(C(=CC=C1)N[C@H]3[C@H](C2=CC=N[N]2C)OCC3)C4CC4,51B643D30E4BB498_53311D248B692F6B_6041_UN,8.638227,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011011111000000100101010000001011101100000011110100001010011011110011101111110,XWQLDPKNGPHCDU-RHSMWYFYSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)CC5=CC(=C(N4CCN(C)CC4)C=C5)F,4448C7AF0E0C5429_C7C16EAED8FF89FF_6034_UN,7.843399,00000000000000000000000000000000000000000010000000000000010000100100000000010001001101110001010110101100110101010001101011100100110011110110001011011011010111101111110,WBAROAXPOGRVFP-UHFFFAOYSA-N
NCCCC(OC1=CC=C(C=C1)C2CCNCC2)C3=CC=C(C=C3)F,0D40087D8BD8CBE7_EAD42056E4CC8969_6035_UN,8.449905,00000000000000000000000000000000000000000010000000000000000000100000000000000000001010110011000000101000100100010100001001000111110110100110001101010001110101100111110,MBDNSTRVYPUPSB-UHFFFAOYSA-N
C[N]1N=C(N=C1N[C@@H]2C3=C(CCC2)C=CC(=C3)F)C4CCOCC4,4ADFCAB816D7CAD7_D8151ECE838BBE46_6041_UN,8.133489,00000000000000000000000001000000000000100010000000001000010000100100000000010101100100110011011010100100111101010000001011101100110011110110001011011011010011101111110,KDMZSPIFCGWQID-INIZCTEOSA-N
FC1=CC(=CN=C1)C2=C6C(=CC(=C2)C=CC4=CC(=C3OCCCOC3=C4)C5=CC=N[N]5C)OCO6,63E8C56E2DF01822_2D1D981A16B432ED_7019_UN,8.515268,00000000000000000001000000001000000000000010000000001000010000100100000010010000100100010100011011110100010101000100001011111100000010100110101011111010110011111111110,QTWBVWOZJDRSOX-UHFFFAOYSA-N
C1(=C(C(=CC=C1)Cl)F)NC34CC2CC(CC(C)(C2)C3)(C4)C,FB137467B3247AFE_AC0FB88BF17F3205_7022_UN,8.09403,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010001000000000101110110011001000000000000100001110000000011000111000010101111010,RVFIAWOENBPPRT-UHFFFAOYSA-N
BrC1=CC(=CC=C1)N2C=CN(C2=O)C[C@H]4N[C@H]3CCO[C@H]3C4,7AF880913DB23E0D_1E19F57CB81CEFEC_6034_UN,8.5130005,00000000000000000000000000000000000001000000001000000000010000100100000000010101000101010011000111001100111101110100011011100101110011110110001110011011111111110111110,PEYKPGBBXMEMBZ-QEJZJMRPSA-N
ClC1=CC(=CC=C1)N2C=CN(C2=O)C[C@H]4N[C@H]3CCO[C@H]3C4,4CC6666E58E0CB80_4983E7BAE2E59FF3_6034_UN,8.512978,00000000000000000000000000000000000001000000000000000000010000100100000000010101000101010011000111001101111101110100011011100101110011110110001110011011111111110111110,HGFINMRNUZPNOE-QEJZJMRPSA-N
NCCC2=NC1=C(C=CC(=C1)F)N2C[C@H]3[C@H](CC(C)(C)C)CNC3,9A18DF359096B893_1368E7ECFE121CDD_6034_UN,8.269632,00000000000000000000000000000000000000100010000000000000000000000110000000110101101111110011000010001100110110011001001011100100110100100110011010011111010110101111010,ZASYFLUHFTVHAM-KGLIPLIRSA-N
NCCC2=NC1=C(C=CC(=C1)Cl)N2C[C@H]3[C@H](CC(C)(C)C)CNC3,A532188819D17EFE_865A0C0BAFAA7FAB_6034_UN,8.269636,00000000000000000000000000000000000000100000000000000000000000000110000000110101101111110011000010001101110110011001001011100100110100100110011010011111010110101111010,XMWHTIFHFOLQOC-KGLIPLIRSA-N
C(C2CCCC1(CC1)C2)=CC3=C(Cl)[N](C(=N3)N(C)C)C4=CC=C(C=C4)C,EE63B2CBB014BE34_B87D3C0295257F6F_7019_UN,7.3643713,00000000000000000000001001000000000000000000000000000000000000100110000000110101000101110000010010010001011100001000001011100100110001110100011011011110000010101111010,OJYCHXUISGGPKS-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC2CC23CCOCC3)C=CC(=C4)Cl)C5,557AE1BB3753B476_E57BFA57967020E8_6034_UN,7.0011916,00000000000000000000001000000000000000000000000000000000010000000110000000010000100101110000010010101101010101011001101011100100110010100110001011011000010111101111110,ZKKMYZHCBZXOKA-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(C)C3=C(CCO2)SC=C3)F)CC4,1CBD44C9BAAC49E1_39008F949B29E3E1_6041_UN,8.10653,00000000000000000001000000000000000010000010000000000000010000000010000000010001111101111001010110101100010111011001101011100100110011110110001011011111110111101111110,SQIRUTHLFBEYEM-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1C[C@]2(C)COC[C@@H]3CCCN23)C=CC(=C4)Cl)C5,C346FBEB27EAEADE_885938887267641F_6034_UN,7.7251196,00000000000000000000000000000000000000000000000000000000010000000110000000010001100101110000010111101101010111011001101011100100110000100110001011011100010111101111110,OWWPBFPTQJRRHQ-HRAATJIYSA-N
ClC1=C(C=CC=C1)CNC3=NC2=C(C=CC=C2)N3CC4CNCCC45CCN(C)CC5,43AAFAD03F61E433_CED2AABD9B45B3E7_6034_UN,8.040674,00000000000000000000000001000000000000000000000000000000000000000110000000010101101101110011010010101101111100011001101011100100110101110110001011011011010110101111010,OMQNJDQBLXCYSQ-UHFFFAOYSA-N
C1(=CN=C(C=C1)C2OCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,ECB238D675F59BA3_D828B3D89E47A9A2_6041_UN,8.190209,00000000000000000000000000000000000000000010000000000000010000100100000010010001100101110011010110101000100111010001101011110100000011110110001001011011010011111111110,HOKYRAUULZTEPX-AEFFLSMTSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(C)CCCCC3,528F1EF0700A9011_EE5AB9910B61DDE7_6041_UN,7.489094,00000000000000000000000000000000000000100000000000000000000000100110000000010100101101100011010010101000000010011001101011100000110001010110001001011111010110101111010,JQFLWFOCFKTYRY-INIZCTEOSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CC3)C4=CC=C(C=C4)F,83BCA5D72584F658_5B4E32A9D655BFF6_6041_UN,7.8217335,00000000000000000000001000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100010001110110001001011011010110101111010,FEVINXDYNRWNJA-SFHVURJKSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CCOC2(CCSCC2)C3)F)CC4,F4914C3129D52CA6_46D0EBDF79C5BC11_6041_UN,7.0645475,00000000000000000001000000000000000010000010000000000000010000000010000000010001100001111011010001101000110111011001101011100000110011110110001011011011110111101111110,PMGSRXRYQNRNRH-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[NH]C=C2NC3C4CC5CC3CC(C4)(F)C5)C,6D1C6909FD4E47AB_29A2DED2048C59FD_6041_UN,8.474041,00000000000000000000000000000000000000000010000000001110000000100110010000000001100100010010001010000100010100001000000011001100100101110100001011000111000010101111010,WMHVMURGUAZCMA-UHFFFAOYSA-N
CC1=C(N=C(N1CC2COC(CI)C2)C3CCCN3)C4=CC=CC=C4,C8A5E6E6E51C32D7_04A2850D9256419A_6034_UN,8.345803,00000000000000000000000000010000000000100000000000000000010000100100000000010101001101000011000011001000100001010000101011100100110010100110001010011011110111101111110,BPHWWXDVXUZLJO-UHFFFAOYSA-N
FC1=CC(=C(C(=C1)F)F)NCC(OC)C2CCCOC2,D57910308EDB684F_0D61BEA2CA867C65_6041_UN,8.027003,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110101010100101000000111000000101000000010110011110110000011010011110111111111110,IVAWFNMGDZXCMZ-UHFFFAOYSA-N
O[C@H](CBr)C1=CC=C(C=C1)C2=CC=C(C=C2)NCC3CC4(C3)C5CCC(C4)C5,6088FF8DAAAF0E01_88D0446A0AA55F53_6041_UN,8.130833,00000000000100000000000000000000000000000000001000000000000000100010000000000000001000000010000010001000110000001000001000000100110111110011000001010001110111100111110,VZRNDTNCNISEMN-LPCMBXMBSA-N
O[C@H](CCl)C1=CC=C(C=C1)NCC2N(C)CC3(CC2)CCC3,5B3AABBC7FB95406_D251D79E3866840D_6041_UN,8.205891,00000000000100000000000000000000000000000000000000000000000000000010000000010001001001100011010000101001110010011001101001100000110111110111001001011011110111101111110,ACJANYXWWKNYAN-ZYMOGRSISA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CC34CCC4,C0DA3C3BCECF100D_2E89577BAB76FC18_6041_UN,7.4991894,00000000000100000000001000000000000000100010000000000000000000000110000000000100001000010011000000101100010110001000001001000100110001110100001011010111010110101111010,DAFRQSPIDDCSQT-UHFFFAOYSA-N
CCNC5CCC1=C(C4=C([N]1C[C@@H]2CNC[C@H]2C3=CSC=C3)C=CC(=C4)Cl)C5,F8C05B5561582964_98ED6A544E470EA8_6034_DP,7.875705,00000000000000000000000000000000000010000000000000000000000000100100000000010000101101111011000010001101110110010010001011100100110101100110001011011011010110101111010,YCHFNKFFXHDSFF-PGHIUSFISA-N
O(C(CC1=C(C=C(C=C1)F)F)C#N)CC3CCC2(CCNCC2)O3,F6F3BE819C760602_E20D9321BA4F72C0_6039_DP,8.2819,00000000000000000000000000000000000000000110000000000000010000000010000010000000001100110001000111101000110101011000001011000010110010100110001011010011110101110111110,LKSDONYDBWMEGW-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@H]3[C@H]2CCCO[C@H]2C3)Cl)C4CC4,73875E0C0C8B4E02_1F77ACD5D66B76F0_7022_UN,8.654795,00000000000100000000001000000000000000000000000000000000010000100000000000000000000000010011000001100101110111010000001000000000110011110100000011010011110011101111110,YGCFNPRCBISUHR-VMGRFDJRSA-N
C(CN1CC2CCC(C1)O2)=CC3=C[N](N=C3C)C4=CC=C(C=C4)F,A26793EA4CC964B5_635E3382857585B0_7019_UN,8.229862,00000000000000000001000000000000000000000010000000001000010000100100000000010000100101110000001110111000010100000000001011101100110011110110001011011010110111101111110,JHQROEPJNKLKHN-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=NC=C1)NCC2CCCC3CCCN23,49313F260421D575_5612D8F8C1A3C323_6041_UN,8.246934,00000000000000000100100000000010000000100000000000000000000000000100000000100101001101100011010010101100010000011000001011100000110001010110011001011101010110101111010,SUELEVQKGNZLOZ-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=C(N=CC(=C2)F)Br)C3,17994562D2573133_A2181637E4D5040C_6035_UN,8.155883,00000000000000000000000000000000000000000010001000000000000000000100000000100000000001110000010111101000010100000101001001100011110000100100001111011110110111101111110,JVUQPGZWENPOLD-HEQLZXTPSA-N
CC1=C(C2=C(C=C1)C=C[NH]2)NCC4OC3(CCC(C)(CC3)C)CC4,26124BEDB0D17AA0_EA260B38AD7A706A_6041_UN,7.4959807,00000000000000000000000000000000000000000000000000000010010000000110000000100001001100000011000110001100010010001001101011000100110111010100011011010111110111101111110,WNTUSKQDGXHTHB-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=C(N=CC(=C2)Br)F)C3,F3504F821BF8AD9A_C30405CF6550CF1F_6035_UN,8.155877,00000000000000000000000000000000000000000010001000000000000000000100000000100000000001110000010111101000010100000101001001100011110000100100001111011110110111101111110,UGSSFTRNHFJJMN-HEQLZXTPSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=C(N=CC(=C2)Br)I)C3,A17DC5D31E077BD9_B26F7E089BC22D75_6035_UN,8.155874,00000000000000000000000000010000000000000000001000000000000000000100000000100000000001110000010111101000010100000101001001100011110000100100001111011110110111101111110,QOMQGUFJMHGPEH-HEQLZXTPSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=C(N=CC(=C2)F)F)C3,2EC66BFC86630365_88A998ED3507557F_6035_UN,8.155865,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010111101000010100000101001001100011110000100100001111011110110111101111110,WGZAMHYGKMGNNA-HEQLZXTPSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=C(N=CC(=C2)Cl)Br)C3,17070163A87AA8DE_A76341CF1853997E_6035_UN,8.155854,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000010111101001010100000101001001100011110000100100001111011110110111101111110,KXRAOWVIHLPBJL-HEQLZXTPSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=C(N=CC(=C2)Cl)I)C3,FA52B0DF7C7B7228_F4DEB49C5340AAA9_6035_UN,8.155849,00000000000000000000000000010000000000000000000000000000000000000100000000100000000001110000010111101001010100000101001001100011110000100100001111011110110111101111110,HUSKFVAFZRJSAM-HEQLZXTPSA-N
CC2=CC1=C(C=CC=N1)N2CC3CCCN3CC4CCCN4,03726BF97D356DC0_E3555264A353EF08_6034_UN,8.159996,00000000000000000000000000000000000000000000000000000000000000000100000000010001101101100011000010101100110000010000101011100100110000000110001010011011010110101111010,SLWIAZVNAHQPEK-UHFFFAOYSA-N
CCOC(OCC)C1=C[N](N=N1)C2=CC(=C(C=C2)F)NCC3C(N(C)CC3)C4=CC=CC=C4,B769F5F7A769DFB8_6A9E44BF646850BB_6041_UN,8.352669,00000000000000000000000000000000000000000010000000001000000000100100001000010101101101110011011111001000000111010011101011111110111001110110011011011111010111111111110,RNJQFQUQVOGIHQ-UHFFFAOYSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC3=C(N=C4[N]3C=C(C)C=C4)C5=CC=C(C=C5)F,C1CC45C71A103E55_CFE873E2957A3A8A_7019_UN,8.839714,00000000000000000000001000000000000000100010000000000000000000100100000000000101000101010000000010110100010100000000000011100100110000100100001011011010000110001111010,ZTVULMANPKCYGS-QUCCMNQESA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC34CC(COC)(C3)CO4,22A206C2E287DEAE_010E043721306031_6041_UN,7.076128,00000000000100000000000000000000000000100000000000000000010000100110000000010100101101100111010110101000010011011001101011100010110011010110001000011111110111111111110,REYWHMSYETYLQQ-ZLPCBKJTSA-N
C2(=CC1=C(C=CC=C1)O2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,44B439445462E51B_05A4B329BB103467_7022_UN,8.471258,00000000000000000000000000000000000000000000000000000000010000100000000000010000101101110011110010101101010110110001111011100100110001110110001001011011110110101111110,YZEZTUAESNTNHR-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NC3C4CCCC3COC4,6EDAA6865CC460DC_FBDEB09184E33FF8_6041_UN,7.9431267,00000000000000000000000001000000000000000010000000000000010000000100000000010101000101110011010011100100011101000000001011100100110001110110001011011011010011101111110,UOFXPNCMHHHTTA-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NCC3CCCN(C)C3C4=CC=CS4)C,2EC5D82B9C339FB1_857ED8581C213125_6041_UN,8.37275,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110011011011111010110101111010,INCBRZSAHZSQTH-UHFFFAOYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC[C@@H]4OCCN(C)[C@H]4C5=CC=CC=C5,160CC0D3C6430A10_A10965E4B8DF4010_6041_DP,7.5875077,00000000000000000000000000000000000000100000000000000000010000100100000000010101101101100011010110101000110011010001101011100100110111010110001001011011110111101111110,CDDOPBAFUCLCHY-ZZEDZQHJSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)N[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,711ADF6D76098E06_7E3CCD733DDC5AB9_7022_DP,7.790311,00000000000000000000001000000000000000000110000000000010000000100010000000000001001000110011000000101000100100011000001001000100110101110110001011010011010010100111010,IIRMRZLBBQIMHZ-YLJYHZDGSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCC34CNC4,A99BBF7684B9219B_D844936F6770249B_6041_DP,7.871994,00000000100100000000000000000000000000100010000000000000000000000110000000000100001000110011000000101100010110001000001011000100110101110110001011010111010110101111010,YLHPWBUOHXOBGT-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC[C@@H]3CCCN(C)[C@H]3C4=C[N](N=C4)C,7ACF3A18BDBE2584_98DA9A4CA936043C_6041_UN,7.9087887,00000000000000000000000000000000000000000010000000001000010000100100000010010000101101110011011010101000000111010001101011111100110011110110001011011111010111111111110,YAJCBSDHNJWTAM-HNAYVOBHSA-N
CC1=C(C=CC(=C1F)N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,0E4AC1AB08532B67_8FFCB3E58BBB6638_6041_DP,8.001471,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010101111010,OQXMDLRPUNOREK-SJLPKXTDSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC5CN3CC4CC3(C4)CO5,4746E6349717688A_665F3AE9A762021C_6041_UN,7.7830224,00000000000100000000000000000000000000100010000000001000010000100110000000010101101101110011011110101100010101011000000011101100110011110110001011001011110111101111110,WAOAWTDTVRPFTK-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CN(C2=O)C[C@H]3[C@@H](CNC3)C4CCOCC4,558BC618CEF134C9_88367CAE22FCF2FC_6034_UN,8.546431,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011100010101100010101100100011011100101110010100110001111011011011111110111110,FLPWCSYKERMORX-YJBOKZPZSA-N
CN(C)CC1=C(C=C(C=C1)NC3CCCC2(CCC2)C3)F,37093BEDC5FA0FCD_3601B34A664180DF_7022_UN,7.980054,00000000000100000000000000000000000000000010000000000000000000000010000000100000000001110011010000001000110100011001001000100000110001110000001011011111010110101111010,KIFZFRKOBQPEIQ-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2=C(C=NC=C2)OCC3CCOC3)F,6FFF93DF6F2E3E01_6995F023DF0BC01A_7022_UN,7.948394,00000000000000000000000000000000000000000010000000000000010000000100000000100000001101110100010111101000000101000101001011100111110011110110001111011111110111111111110,KGPBSYCNJQNOCY-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC23COC(C)(C2)CCC3)F)CC4,29D26AA9608F364C_50E275ECBADFF4D6_6041_UN,7.259458,00000000000000000001000000000000000000000010000000000000010000000010000000010001101101110011010011001000010111011001101011100000110011110110001011011111110111101111110,HVFSQRCZXGYEQJ-UHFFFAOYSA-N
C(C12CC(C1)OC2)=CC3=C[N](C)N=C3C4=CC(=CC=C4)F,4E5D0EAD02BBA174_7F84E8048C248898_7019_UN,7.1454673,00000000000100000000000000000000000000000010000000001000010000100110000000010000100100010000011010010000010101001000000011101100110010100100001010001010110011101111110,BBCQSOIACDUYGE-UHFFFAOYSA-N
CN1C(CCCC1)CC=CC2=CC(=C(C=C2)N3CCOCC3)F,F4E9145CEB4DB5FB_17C96622AFB7C968_7019_UN,8.380231,00000000000000000000000000000000000000000010000000000000010000100000000000010000000001110000010100111000000111010001101011100000110011110110001011011010010111101111110,ZMUXRVGDKGNRNF-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC3C(CCCC3)N4CCCC4,6BA35923E3892E34_D17E6AF6D6473492_6041_UN,8.237527,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010101100010100010000001011100100110001110110001011011011010110101111010,JADSQDMZZAUHTI-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC3=CC2=C(CCCN2)C=C3,88CAED6CADFFEAF9_892AAC0C086B2FE6_7022_DP,7.7248163,00000000000000000000100000000010000000000000000000000100000000000000000000100000101000100011010000101100110000011000001001000100100101010100011011011101010010101111010,LYAVGBOAAXRNEU-UHFFFAOYSA-N
N1CCC(CC1)C2=NC=C(C=N2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,998345984BC8C694_B672586453F75FE6_6041_DP,8.443741,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100110101110110001001011011010010101111010,FGEROONHYQUPKD-MOPGFXCFSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3NCCC3)C[C@@H]4C[C@H](C)CCN4,08C1B3123426FD4E_B0EFB3ACC50BDD58_6034_UN,8.391525,00000000000000000000000000000000000000100000000000000000000000100100000000010101001101000011000010101100110010010001101011100100110100000110001011011111010110101111010,FFMFLZLWXFEIAN-YSPPHNQVSA-N
FC2=C(C=C1C=C[NH]C1=C2)NC3CCN(C)C34CCCNC4,A25602A3A27A0E4B_29B22F255C49A10D_6041_DP,8.272992,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001011011011010010101111010,BEMOVTISWDXVIH-UHFFFAOYSA-N
C1(=CC2=C(C=C1)COCC2)NC3=C[N](C[Si](C)(C)C)N=C3,1524A04F66420ABC_04192ED1C7D2398C_6041_UN,6.9089823,00000000000000000000100000001010000000000000000000001000010000000100000000110001100100100001011010101100010001011001001011101100110011010110011011011101010111101111110,MAOPIXBIBQNHER-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC[C@H]3O[C@H](CC3)C4=CC=CC=C4,D0BF54EFDFFBC6CC_A8AE4116981CF53B_6041_UN,8.292429,00000000000000000000000000000000000000000010000000001000010000100100000000010000101100010011011110001100010100000000001011101100110011110100001001011001110111101111110,BODIWPYDKWQDQI-FUHWJXTLSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC[C@H]4[C@@H](C4)C5=C(C=CC=C5F)F,6AE218A1BE5730F3_C10584465ECA980E_6041_DP,8.045113,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000010110000000000011100100110101110110001011001011010110101111010,KZVSTNSMAJETOH-FOFSIYPYSA-N
CC1=C(C=C(C(=C1)NC(CC)C2CCOC2)Cl)C3CC3,AF1070CD6797A15E_C5402C7967B5C309_7022_UN,7.6422853,00000000000000000000001000000000000000000000000000000000010000100000000000000000000100110011000011000001100111010010001000000000110011110110000010010111010111101111110,VMAGNGGABHKDCP-UHFFFAOYSA-N
CN(C)C4CCN(CC1=CC=C(C=C1)NCC23CC(CNC2)(F)C3)C4,9F87C172EE830DAA_179943605CD3EDAD_6041_DP,7.5084753,00000000000100000000000000000000000000000010000000000100000000000010000000110001101101110010010010101000010110011000101011100000110101110110001001011101010110101111010,WWIUCTLPACKXQN-UHFFFAOYSA-N
C2(=C1C(=CSC1=NC(=N2)C3CC3)C4=CC=CC=C4)NC5C(CC)CN(C5)C,C855524C41614F37_1AB4AD2635DD6FD7_6041_UN,8.623763,00000000000000000000001000000000000010100000000100000000000000100100000000010101110101101011010010101100110010010011100011100100110001010110001001011111010110101111010,LPXYVLLJHLFLKP-UHFFFAOYSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NCC6C4(C5=C(C(C)(CC4)C)C=CC=C5)C6,322BE73617E392E4_C826FE00CC244D0C_6041_UN,8.003274,00000000000000000000001000000000000000100010000000000000010000100110000000100101001101110011000010101100010101001001101011100100110011110110001011011101010111101111110,BMSGBWHXAMFCEA-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@]23[C@@H](CCC2)OCC3)F)[N]4C=CC=C4,0063F1E4973223AB_5C0B352E666F4313_6041_UN,8.231482,00000000000000000000000000000000000000000010000000000000010000100110000000010000001101010011000011001100010101001000001011100100110011110110001010011011110111101111110,OGDCWYWXUGTECZ-RTBURBONSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NC[C@H]3[C@H](CCCC3)N4CCOCC4,943A3789B89C4F7C_8E7C7044F66D95A5_6041_UN,8.232856,00000000000000000000000000000000000000000010000000000000010000100100000000010000101001110011000100101100010101010000001011100100110011110110001011011011010111101111110,XCSJWJWRKXXQBG-HKUYNNGSSA-N
C1(=C(C=CC(=C1)C(F)F)Cl)NC[C@H]3[C@H](C2=NC=C[N]2C)OCCC3,7C6D1AA632CEB5D7_0D3279BEE150B127_7022_UN,8.351135,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101010011010111101001000101000000001011100100110011110110001011011011110111101111110,AXCYTKKNDRKGRZ-SWLSCSKDSA-N
FC1=C(C2=C(C=C1)C=CO2)NCC4(N3CCN(C)CC3)CCCCCC4,45297F960FE82938_C6A6CE767BB6CCA3_6041_UN,7.6626883,00000000000000000001000000000000000000000010000000000000010000100010000000010001001101110011010110101100010100011001101011100100110001110110001011011011110110101111110,WNJUXKLVWQCJOC-UHFFFAOYSA-N
O(C1C2CCC1C3CNCC23)C4=CC=CC(=C4NC)F,296969F5D8934081_E475605FD48BA66B_6035_UN,8.011248,00000000000000000000000000000000000000000010000000000000000000000000000000000000001100110001010110001100010100000100001001000011110101110110001111010011110011101111110,TZICJYZYWLMBAY-UHFFFAOYSA-N
FC1=CC(=CC=C1)CC2=CN(C=N2)CC3CNCCC34CCN(C)CC4,C50472C5679FC344_BB992DF2D6A5C0F3_6034_UN,7.823758,00000000000000000000000000000000000000000010000000000000000000000110000000010101101101110011010010101000110100011001101011100100110000100110001001011001010110101111010,DOGRMYYYVWEDKY-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCOC(C2)C3=CC=NC=C3)F)CC4,B5EF3AC5FC1A2372_CAB1140AF1730591_6041_UN,7.8415656,00000000000000000001000000000000000000000010000000000000010000100100000000010001100001110010010001101000100111010001101011100100110011110110001011011011110111101111110,SYDHXUMLGCDSJQ-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NC3CC(C2=NC=C[N]2C)OCC3,EB30EDB77422D188_6D8E5194D9558470_7022_UN,8.147687,00000000000000000000000000000000000000100010010000000000010000100100000000010101000101010010010111110000100111010000001011100100110011100100001011011011110011101111110,QLEUKFWBEDBZHL-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)NC[C@@H]2CNCC(O2)(C)C)F)C#N,4959DE55ADC281C7_9942758BBA563049_6041_DP,7.921187,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110011011000111110111101111110,LXPQOIUABPGECW-LBPRGKRZSA-N
CC1=C(C=C(C(=C1)NCC2C3(C2)CCOCC3)Cl)C4CC4,1BFD8B2B41902A4A_047332C6EB4836AA_7022_UN,7.4759727,00000000000000000000001000000000000000000000000000000000010000100010000000000000001000110011000000101001010111001000001000000000110011110110000011010011010111101111110,YNYVDXZSLLGJOA-UHFFFAOYSA-N
O(C3CCOC2(CCN(CC1=CC=CC=C1)CC2)C3)CCC(C)F,EF6B63350F53788A_92DCC792D2FC53EA_6039_UN,8.175113,00000000000000000000000000000000000000000010000000000000010000000010000000010000000001100100000001101000010101011001101011100011110010100110000101011000110101111111110,BJZQNAQJAOQBMM-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2N(C)CC3(CC2)CCC3)F)F,59DCC54A2893ACBF_EBB3F2AE2A97DB42_7022_UN,8.00503,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011111010110101111010,BMZNMNDGEYFAQO-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(CNC3)C4=NC=C(C=C4)F,C86D7F6C73566A81_FFBD3B12B740C2D7_6041_DP,8.045753,00000000100100000000000000000000000000100010000000000100000000100110000000000100101000110010000000101100010110001000000011000100100101110110011011000111010110101111010,GSARIUGGIPUDTO-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3NCC3(C)C)Cl,1421C938B580297B_F9B0C280FF702AC7_6034_UN,8.675316,00000000100100000000000000000000000010000000000100000000000000000110000000110111011101011011000010001001101110011001100111100100110101110110011010001111010110101111010,XGFLECLMXXZVJB-UHFFFAOYSA-N
C1(=C[NH]N=C1CC2CC2)NC3CCCC4=C3C=C(C)[N]4C,032D40B79BEB5CDE_C3F63874344F913F_6041_UN,8.380216,00000000000000000000001000000000000000000000000000001110000000000100010000010001100101000011011010000100110010010000101011101100110101010100001010011111000110101111010,YFVHAMZRWXWTEJ-UHFFFAOYSA-N
C2(=C1C(=CSC1=NC(=N2)CN3CCCCC3)C4=CC=CS4)NCC5C[Si](C)(CC5)C,F69AB4D299EDF44B_54EEE1CE92304358_6041_UN,8.671834,00000000000000000000100000000010000010100000000100000000000000100100000000110101111101101011010010101100010010011001101011100100110001010110001001011101010110101111010,KTOXJEJHTUZUEU-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NCCC3CNCC(C)O3)C,3AF767B31D8972EC_A6256C6A84797356_6041_DP,8.491308,00000000000000000000000000000000000000000010000000000000010000000100000000000000101000110011000101101100110110010001001011000100110111110110011011010111110111101111110,FECLEDDLUATGMJ-UHFFFAOYSA-N
C(C1CCCC12CCOCC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,44350DA9BCA9D2E1_E6B59AEB18AB3391_7019_UN,7.9728146,00000000000000000000000000000000000000000010000000000000010000000010000000000000000001110000010010110000010111011000101000100000110011110110000011011010010011101111110,GEKRIUIYOOTRIX-UHFFFAOYSA-N
CC1=C(C(=CC=N1)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,D5F567152BE19D95_34E8EAA86372191B_6041_UN,8.575985,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000110010000001011100100110001110110001011011111010110101111010,MBTQNOPJBHDDNE-KUHUBIRLSA-N
FC1=C(C=C(C=C1)N[C@@H]2CCN(C)[C@H]2C3=CC=C(C=C3)F)C4OCCO4,388E70E0EECCEABA_90CCBC315388EBE7_6041_UN,8.498686,00000000000000000000000000000000000000000010000000000000010000100000000010010001100101110011010010001000100111010001101011110100000011110110001011011011010011111111110,XJNSOSKYUPSCPR-MOPGFXCFSA-N
FC1=CC2=C(C=C1)N=CC(=C2)NCC3CCCC(CC)CC3,826FB6262EDA7913_7FD60892D3B73FDA_6041_UN,8.526953,00000000000000000001000000000000000000000010000000000000000000000100000000000001001000010011000000101100010110000010101001000100110001110100001001010001010110101111010,TWIBALOOYRREDQ-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC3CCN(CCN2CCOCC2)C3)F,0CD2EB0DCB884D5E_1EE333174DA38BBC_7022_UN,7.8056283,00000000000000000000000000000000000000000010000000000000010000000000000000110001101101110011010110101000000101010001001011100000110011110110001011011111010111101111110,ABZVVDASCNSHFE-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CC3C[C@@H]2CCCC[C@H]2O3)C=CC(=C4)Br)C5,4833DDC7F8394AEB_0B3FDCF838C242A6_6034_UN,7.9828377,00000000000000000000000000000000000000000000001000000000010000000110000000110000000101010000000110001100010100011001101011100100110010100100000011011100110111101111110,ZIRZQORCMKNRCW-SSMNUEENSA-N
CC1=C(C=C(C(=C1)NCC2CCCC(CC2)C3=CC=CC=C3)Cl)C4CC4,CF49D599759F8628_EE7E915ECDCD86B8_7022_UN,7.7310963,00000000000000000001001000000000000000000000000000000000000000100000000000000000001000010011000000001001000110000000001000000100110001110000000011010011010110101111010,LZORIGIPPJPOJP-UHFFFAOYSA-N
C(C1(CC1)C2CCCCO2)=CC3=C[N](C)N=C3C4=C(C=CC(=C4)F)F,28F7CB1C20C68D68_0EA6075F2C5E3342_7019_UN,8.133194,00000000000000000000001000000000000000000010000000001000010000100110000000010000100100010000011010110000000101001000001011101100110010100100001011011010110011101111110,YYUGOBDWUVFUOE-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NC3CCN(C)C34CCCNC4,EC67277E3476EE43_5A145BA6C80D6227_6041_DP,8.082536,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001011011111010010101111010,SILRVCJJHZXZOQ-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NC(CC)C3CCCC3,9C78B56ED24C3E90_1CC89CE8365E6D69_6041_UN,8.239594,00000000000000000000000000000000000000000010000000000000000000000100000000000001000000010011000010100100110110010010001001000100110001110100001011010011000110101111010,CBWJHRXVSOLLQB-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)OCC2)[S](C4=CC3=C(C=C[N]3C)C=C4)(=O)=O,CDF73F9C17005E3B_D5B24A1FE0C0818A_6029_UN,8.845113,00000000000000000000000000000000110000000000000000010001011111001101010001010000011101001000011010001110011001001100011011101100101010001110001011111001110111111111110,PJRXALQJHWYTAL-UHFFFAOYSA-N
N4C[C@@H]3CC[C@H](OCCCC(C1=CC=C(F)C=C1)C2=CC=C(C=C2)F)[C@@H]3C4,9AA904AE0A2483F7_058026626088955E_6039_DP,9.107131,00000000000000000000000000000000000000000010000000000000000000000000000000000000001100110011000011001100010101000000001001000111110010100110000101010001110101100111110,OASFISYSRPPLTR-NMNUPHIUSA-N
CC1=C(C=C(C(=C1)NCC2N(C)CC3(CC2)CC3)F)[N]4C=CC=C4,BF962DCF0A938873_C6D78CFE4E0D20E4_6041_UN,7.699806,00000000000000000000001000000000000000000010000000000000000000100110000000010001001101110011010010101000010110011001101011100100110001110110001011011111010110101111010,CEAWIQSYIODKEL-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2(CC)COCC2)F)CC3,BA8C0E4F56530135_AE57B4914BD6C0DF_6041_UN,7.3165903,00000000000000000001000000000000000000000010000000000000010000000010000000010001100101110011010111001000100111011011101011100000110011110110001010011111010111101111110,QZVXWIWNMKSZDR-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=NC=C1)NCC2CCCCN2,E9B34B811AA1D031_06E921958EE95ACF_6041_DP,8.359177,00000000000000000100100000000010000000100000000000000010000000000100000000100101001000100011010000101000100000011000001011000000110101010110011001011101010110101111010,RNAVSQCQMFRTFO-UHFFFAOYSA-N
C[N]1C=C(Cl)C(=N1)C=CC2=CC=C(C=C2)C3CCCCC3,A99A109C6B2B6C25_5412F1A028EC5DAE_7019_UN,8.495213,00000000000000000000000000000000000000000000000000001000000000100100000000010000100100010000011010010001000100000000001011101100110000100100001011011010000010101111010,ZMLGSPAITPZART-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[NH]C3=C2CCCCCC3)NC4=CC=C(CC[Si](C)(C)C)C=C4,EFFB88978B109B37_F3474446B1C5FE0A_6041_UN,7.7227945,00000000000000000000100000000010000000000000000000000000000000000100000000100000000100100011010010000100110000011001101001000100110101010100011011011101010110101111010,XVHDAFBWDHITDN-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC(CC)CC3=C[N](C)C4=C3C=CC=C4)F,68F09D81402A6185_120581659D556319_6041_DP,7.5897346,00000000000000000000000000000000000000000010000000000000000000000100000000010000001101010011010010101100110110010010101011100100100101110100001011011111010110101111010,BYDWIJCNSXQLNG-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CCC2(CCCCO2)CC3)F)CC4,4EB984019E69025B_3EA5BC26BC81918E_6041_UN,7.1738386,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110010010000101000110111011001101011100000110011110110001011011011110111101111110,LTKAESRBXIZESL-UHFFFAOYSA-N
CNC2=NC1=C(C=C(C=C1)F)N2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,0369ADFC7A1F6968_C7B929E8FA26B024_6034_UN,7.354052,00000000000100000000000001000000000000000010000000000000000000000110000000110101000101010011010010001100011110011000101011100100110001110100011011011111010110101111010,AFHPYEMTDHCKEB-GZBFAFLISA-N
CNC2=NC1=C(C=C(C=C1)Br)N2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,9CE885F08BF75B2A_77B73DF00B5CF264_6034_UN,7.35403,00000000000100000000000001000000000000000000001000000000000000000110000000110101000101010011010010001100011110011000101011100100110001110100011011011111010110101111010,DYPOHQGEXNFMSJ-GZBFAFLISA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2CCCC3=CC=CC(=C23)C,730216CE9EBDF3E3_57DC882997760156_6041_UN,7.966571,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100011010000100100110010011000001001000100100001010100011011011111000010101111010,NNLROBMUTFNSNT-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)NCC2CNCC(O2)(C)C)C#N,7B7F8D39D85F4C59_7E713A6204AF7DC0_6041_DP,7.7560854,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110011011000111110111101111110,ZSRQFVKHXMFBDG-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)N[C@H]4[C@@H](C4)C5=C(C(=CC=C5)F)F,F806D16DD8A2B141_82676FA03E26B5AA_6041_DP,8.417654,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000110110010000000011100100110101110110001011001011010010101111010,RBDOZUUSVSJWJM-KHPYRJPYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC(C4=NC=C[N]4C)C5=CC(=C(C=C5)F)F,2D4B1D1817694D7E_96F6570252007F95_6041_DP,8.306885,00000000000000000000000000000000000000100010000000000000000000100100000000010101100101010011010010100000110100010000001011100100010101110100001011011011000010101111010,LCARIEQUYAUVMI-XWRAKQQISA-N
FC2=C1N=CC=CC1=CC(=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,9585B1A217B22BC5_908A4F1481768863_6041_UN,8.405205,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,SPDQYVOJXUXBKV-ZHRRBRCNSA-N
N1CC[C@@H]2CN(CC[C@H]12)C3=NC(=CN=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,EC7CCFC8FA77F7D5_C89F5841EAEC0C75_6041_DP,8.740174,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101100110110010001101011100100110101110110001001011011010010101111010,LNKCDCXNGNWRSI-TXXUCJGISA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCCN(C)C3C4=CC=CS4,C9BA295071F9C2C3_C119BC033AD6C2E0_6041_UN,8.061714,00000000000000000000000000000000000010000010000000001000000000100100000000010000111101111011011010101100010110010001101011101100110001110110001001011111010110101111010,IUQIFCWYWQUIJV-UHFFFAOYSA-N
BrC1=CN=C(N(C1=O)C[C@H]2[C@@H](CCNC2)C3=CC=C(C=C3)F)C4CCC4,3DEAE7E7F1A34CCC_84535E3151A72A18_6034_UN,8.338199,00000000000100000000000000000000000000100010001000000000000000100100000000010100101001110011100001101000100100110100011011100101110000100110001111011011011110100111110,QSLCDFRMKFVPBA-RDJZCZTQSA-N
CC1=CC2=C(C=C1)C(=CN2CC4(CC3=CC(=CC=C3)Br)CC4)C5CCNCC5,0C7A0E4242B7CB9B_E1B68E8AED298331_6034_UN,8.400986,00000000000000000000001000000000000000000000001000000000000000100110000000010000001101110001000010101100110100011000001011100100110000100110001001011001010110101111010,WEBPGJXTPKHZRI-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C2CC2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4,20913EB6E1F7E830_A2E774DDBBCF0A65_6041_UN,8.436876,00000000000000000000001000000000000000000010000000000000000000100000000000010000101001110011010000101000000110010001101001100100110001110110001011011011010110101111010,FYHGBHYLCGVXRN-AVRDEDQJSA-N
FC1=CC(=CC(=C1)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)C4(CC4)C#N,5D5CFCD7476768C7_A1C9B6B322132B3B_6041_DP,7.755119,00000000000000000000001000000000000000000110000000000010000000100010000000000001001000110011000000101000100100011000001001000100110101110110001011010011010010100111010,JJSMZXZMBZSPLU-YLJYHZDGSA-N
CC1=CC2=C(C=C1)C(=CN2CC3(CCNC3)C4=CC(=CC=C4)F)C5CCNCC5,F736E7B759F39C78_9835E50AC07AA503_6034_UN,8.434986,00000000000000000000000000000000000000000010000000000000000000100110000000010000101101110011000010101100110100011000001011100100110100100110001001011001010110101111010,SPVLNSWWGLYPMU-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCC3)C4=CC=C(C=C4)F,BC66825E8C4BBABA_4404B2D293EAD777_6041_UN,7.950801,00000000000100000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100000001110100001010011011000010101111010,CZYHFACWZOBRAX-UHFFFAOYSA-N
FC2=C1C=C(N=CC1=CC=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,636475382D450966_2F97A7C3825E53B3_6041_UN,8.466892,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,BSMAHYSYVUZTJR-ZHRRBRCNSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC3=CC2=C(CCCN2)C=C3,6E5406A18AFB5CEA_DBE8CEB77E294675_6041_DP,7.6960196,00000000000000000000100000000010000000000000000000000100000000000000000000100000101000100011010000101100110000011000001001000100100101010100011011011101010010101111010,RIVUQJCAQFMEKI-UHFFFAOYSA-N
CC2=C(C=C1N(C(=NC1=C2)Cl)CC4(CC3=CC=C(C=C3)F)CCNC4)C,1213BADF44C2A5C0_9F8397BE442BCDA2_6034_UN,8.266738,00000000000000000000000000000000000000000010000000000000000000000110000000010101101101110011000010001101111100011000001011100100110000100110001011011111010110101111010,LEEFQQYGISYLJK-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)F)NCC2CCCN(C)C2C3=CC=CS3)F,EAFA1A1020388204_8032274F4C803202_7022_UN,8.061317,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101000000110010001101011100100110001110110001011011111010110101111010,AJZRUETUUMXTQT-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CCCCN3C4CC4,8E23AA4010AC8A83_7C2ED27F2B018D7D_6041_UN,7.6347756,00000000000000000000001000000000000000100000000000000000000000100100000000010101001001000011000000101100010010010000001011100100110001010110011011011111010110101111010,CNFBAHWYKLIQCB-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CSCCO2)F)CC3,9D0F4735A1AE32EB_4A44A29E4FB9BAA3_6041_UN,7.3216686,00000000000000000001000000000000000010000010000000000000010000000000000000010001101001111011010100101000000111010001101011100000110011110110001011011011110111101111110,SMEQSGAJJLOOFS-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(C)CCCOC2)Cl)C3CC3,7525E9DE974A2520_C5020FF9DED525CF_7022_UN,7.4372196,00000000000000000000001000000000000000000000000000000000010000100010000000000000001000110011000001101001000111001001101000000000110011110110000011010111010111101111110,BOTKIPAJBITOIU-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[S](CC2)(=O)=O)NCC3=C4C(=C(OC)C=C3)C=CS4,6DEF65F7B434A10F_4508EF296F8CC8A9_6041_UN,8.251178,00000000000000000000000000000000000010000000000000010001001111000001000001000000011100001001010010001110010000001100001010001111001011011110000111111001110111111111110,JWIPEMVVUJMJTR-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC3(CCOCC3)C=C,5C39AE5C4F64FAB1_4DB70B588BF04810_6041_UN,7.862892,00000000000000000000000000000000001000100010000000000000010000000110000000000100000000110010000001110100110101011000001011000100110011110110001011010111010011101111110,LLHKUOQYGSRASC-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC[C@@H]3CCCN(C)[C@H]3C4=CN=C[N]4C,7D8F98D9D33B94DF_9B8273BB4C49AA2A_6041_UN,7.9014683,00000000000000000000000000000000000000000010000000000000010000100100000010010101101101110011010010101000000111010001101011110100110011110110001011011111010111111111110,BOGGBJFVWUJNEU-HNAYVOBHSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3=C4C(=CC(=C3)F)COCO4)C5,C94EAB8EC030576E_D98641278005F5BD_6041_UN,7.277464,00000000000000000000000000001000000000000010000000000000010000000100000000010000101101110111010011101100110101010101101011110100110101110110001011011001110111111111110,MKLXEQADQXYMNY-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NC4CC(C3=CC=N[N]3C)OCC4,6416B524570F4A01_8C242D4F5B1483AD_6041_UN,8.127657,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010010011111100100110111010000001011101100110011110100001011011111110011101111110,HMOZBZSWNFEOCU-UHFFFAOYSA-N
CC2=C(C=C1N=C(C(=CC1=C2)C)NCC3CCCC(O3)C4CC4)C,131ABB4579682A17_C1EF6335AFA8EE84_6041_UN,8.009949,00000000000000000000001000000000000000100000000000000000010000100100000000000100001000000011000100101100010010000000001011000100110011010100011011010111110111101111110,NTFCOCTWYJMFHH-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CCCC2)C3=CC=CS3)F)CC4,BA2195875E558731_1ABA17625CA3B272_6041_UN,8.52436,00000000000000000001000000000000000010000010000000000000000000100010000000010001111101111011010010001000000110011001101011100100110001110110001010011011010110101111010,ZASDIEILTYWFPE-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C(CCC2)C3=CC=CC=C3)Cl)C4CC4,2926B01F44CA8D55_BF03322B8F1E190C_7022_UN,7.7653427,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010011000010001001000110000000001000000100110001110000000011010011010110101111010,UPJGZJQQCXLXCK-UHFFFAOYSA-N
N4CCC1=C(C=C(S1)NC2=CC(=C(C=C2)N3CCCCC3)F)C4,8F5F5ED74BA7B7E8_6E5C8893A1E222AC_6041_DP,7.6389804,00000000000000000000000000000000000010000010000100000000000000100000000000010000011101111001000010101100110100010000001011100100110101110110001011011011010010100111010,NZXRLSOUQZFUAK-UHFFFAOYSA-N
CCC(C#N)C1=CC(=CC=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,4FA07589E96ED11E_96D8B966A945BFF6_6041_DP,7.8323197,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010010001001000100110101110110001001010011010110101111010,KPQMXXXAWNIEGI-JEWJRUSMSA-N
C(CCOC1CCCCO1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,EF15A7BBEBC5AF0D_7C1EE4A7EF65083F_7019_UN,8.04768,00000000000000000000000000000000000000000010000000000000010000000000000000000000000001010000010010110000000111010000101000110011110011110110000111011010010111111111110,BJPHMOMIDRLQFA-UHFFFAOYSA-N
N1CCC4(CC1)CCC2=C(C=CC(=C2)NCC3=CC(=C(CN(C)C)C=C3)F)O4,F4EC8DABD6CB87E4_488E921011144E39_6041_DP,7.224073,00000000000000000000000000000000000000000010000000000000010000000010000000100000001001110001010001101100110100011101001011100100110111110110001011011111110111101111110,KLKPLMYWRITGPG-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCCC3CC(C)CC3,B904D2A4A19CE7EC_B7896BA076FC2D54_6041_UN,8.013855,00000000000000000000000000000000000000000010000000000000000000000100000000000001001000010001000010101100110110010001101001000100110001110100001011010111010110101111010,SRYWWZITDWJUDQ-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=CC(=CC=C2)C3=NN=C4CCCCC[N]34,33E2D3AA19D41CFC_FB5608D09F76CE39_6041_UN,8.078645,00000000000000000001100000000010000000100000000000001000000000100100000000100101100101100000011010101100010000011000001011101100110001010100011011011111010010101111010,SVBAUDFMOVTQHP-UHFFFAOYSA-N
CC4=CC1=C(C(=CC=C1)NCC2N(C)CC3(CC2)CC3)[NH]4,A5EC469330E3ED88_2FD995F870836842_6041_UN,7.962012,00000000000000000000001000000000000000000000000000000010000000000110000000010001001101100011010010101100010010011001101011100100110101010110001001011111010110101111010,WYSBRYHXMDCEJJ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2=CC(=C(C=C2)SC3CCCC3)F)Cl)C4CC4,99689AA428F7EFE9_02C596E5D580D44B_7022_UN,8.086228,00000000000000000000001000000000000000000010000000000000000100101000000000000000010000011000000010000001000110000000001000000100010001110000000011010011000010101111010,HRWLJJQZSPSBNZ-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2OCCNC2)F)CC3,AB4A73BBB453F45A_5DA1B729909F429F_6041_DP,7.318909,00000000000000000001000000000000000000000010000000000100010000000000000000010001101001110011010100101000100111010001101011100000110111110110001011011011110111101111110,VRABAIROSYOICP-UHFFFAOYSA-N
C[N]1C=C(Cl)C(=N1)C=CC2=CC(=CC=C2)C3CCCC3,385965C34DE4FC28_BDBBC0EE77B7AE34_7019_UN,8.614512,00000000000000000000000000000000000000000000000000001000000000100100000000010000100100010000011010010001000100000000001011101100010000100100001010011010000010101111010,FNOURWOMUUBEJH-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NC4CCOC(C3=CN=C[N]3C)C4,BA37EA3806FD7F42_C746D1BDBA061420_6041_UN,7.1500044,00000000000000000000000000000000000000000010000000000000010000100100000000010101000101010011010111100100110111010000001011100100110011110100001011011011110011101111110,IISPJPIPDCORND-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2C[C@H]3[C@@H](CNC3)C4=CC=C(C=C4)Cl)C5CCNCC5,2DA6ECF022595711_65ACB6BEC9513779_6034_UN,9.132333,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010101101110100010000001011100100110100100110001001011011010110100111010,CWCWTWPMDLATEO-AVRDEDQJSA-N
CC1=CC(=C(C=C1)OC2CCCC2)NCC3C(CCOC3)(F)F,8233C42FBE081031_19E0005652985519_7022_UN,7.953152,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110011000111101000000101001100001000000011110011110110000111010011110111111111110,WRAKDOAFMWECNH-UHFFFAOYSA-N
CC1=CC(=C(C#N)[N]1C)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,1EC45827AFD0CAA8_AD625461385E68E2_6041_DP,7.839902,00000000000000000000000000000000000000000110000000000100000000100100000000010001101101110011010010101000100100010000001011100100110101110110001011011111010110101111010,KQYHJLJIJBVBEM-DOTOQJQBSA-N
O=[N](=O)C1=C(N=C(C=C1)NC2=CC3=C(C=C2)CCOC3)C4=CC=C(C=C4)F,EE1BE312C5DE394A_7455041DCC604D65_6041_UN,8.001814,00000000000000000000000010000000000000100010000001000000110000110100001100000101000000110001001001100110010101000000001111101100111011110110001011111011010011110111110,WTSMTKOFSVOHKE-UHFFFAOYSA-N
NCCCC(OC1=CC2=C(C=C1)CNC2)C3=CC=C(C=C3)F,6039AC318FA46ED7_7FC57C5786076001_6035_UN,8.466368,00000000000000000000000000000000000000000010000000000000000000000000000000000000001110110011000010001100110100010100001001000111010110100110001111010001110101100111110,UDGHXPDEYZSOHO-UHFFFAOYSA-N
N1C4CCC1CC(C=CC2=C[N](C)N=C2C3=CC=C(C=C3)F)C4,7734AC6822685080_E2F0B74662416DCB_7019_DP,7.6455436,00000000000000000001000000000000000000000010000000001000000000100100000000010000100100010011011010110000110100010000001011101100110000100100001011011011000010101111010,NMBDRLSMGNVWRU-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCCC(CC)C2)F)CC3,8670268C1A9E4C28_BCF7CF01E8545544_6041_UN,7.824053,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010000001000000110010011101011100000110001110110001011011111010110101111010,OPWNFHCFURWVKI-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3CC34CCC(F)(F)CC4)Cl,58D5BF6BF81BE5DC_683E9F141BB30DF6_6034_UN,8.258926,00000000000000000000001000000000000010000010000100000000000000000110000000010110010101011011000010001001011110001000001111100100110001110100001011011011010110101111010,ATTPBWBNWPEZAQ-UHFFFAOYSA-N
C1(=C(C(=CC=C1Cl)Cl)Cl)NCC(OC)C2CCCOC2,504A909F5E76494F_F24ACF106BCD98ED_7022_UN,8.11445,00000000000000000000000000000000000000000000000000000000010000000000000000000000001000110101010100101001000111000000101000000010110011110110000011010011110111111111110,WHGQCOOBMIJQCM-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NCC3CCCCN(C)C3,E6FE3FE24A7C269C_62AE1577E7D484EA_6041_UN,8.187459,00000000000000000001000000000000000000000010000000000000000000000100000000010001101001110011010000101100010110010001101011100100110001110110001011011011010110101111010,BNMUGTGJXDGVEZ-UHFFFAOYSA-N
C1(=CC=C(C=C1)CCN2CCCCC2)NC3=C[N](C[Si](C)(C)C)N=C3,A5C08B225A7017B7_F433A7BFBBAFB1A5_7022_UN,7.504074,00000000000000000000100000001010000000000000000000001000000000000100000000110001100101100001011010101000000000011001001011101100110001010110011001011101010110101111010,CRGAKIMBLAJTNU-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2C[C@H]3[C@@H](CNC3)C4=CC(=CC=C4)F)C5CCNCC5,7A799EC637E79637_4C0D9B2B66E98030_6034_UN,9.11447,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010101100110100010000001011100100110100100110001001011011010110100111010,BDBXGYYLZKCMCB-AVRDEDQJSA-N
N(CC1C2CCC(C1)C2)C(C3=C(C)C4=C([NH]3)C=C(C=C4)F)=O,EDDBAA09696FEE6B_615D48310A24CBD1_6038_UN,8.065103,00000000000000000000000000000000000000000010000000000010000000000100000000000001001100010011100110001100010100100000011001000100110100100100001011010011011110101111110,KTOBJBCMLMCNGW-UHFFFAOYSA-N
CN(CC1CCNC1)C2=NC(=NC=C2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,64C65E5460D4553D_3EF6B11C7A83E054_6041_DP,8.082905,00000000000000000000001001000000000000100010000000000000000000100100000000000100101101110011010010101000101110010001001011100100110101110110001011011011010110101111010,HVMJUJLOWAFIGV-NOYMGPGASA-N
CC1=C(C=C(C(=C1)N[C@@]34[C@@H]2OC(C)(O[C@@H]2[C@@H](CC3)C4)C)F)[N]5C=CC=C5,EB7354BA6CB5ED89_5D646A4967452210_6041_UN,8.379342,00000000000000000000000000000000000000000010000000000000010000100110000010110000000101010011000111000100110100011000001011110100010001110100011011011111100011111111110,LJXKBOYFCFDUDN-HUMBJQDLSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NCC3C(CCCC3)F)C,8E083E920BAAA901_48E81052D685045F_6041_UN,8.671284,00000000000000000000000000000000000000000010000000000100000000000100000000000000101100010011000010001100010100000000001001000100110101110100001011010111010110101111010,ZLWMTPIQAYNSOV-UHFFFAOYSA-N
CC1=CC2=C(N=C1)N(C=C2)CC3CCCN3CC4CCCN4,025C731E46427667_D01CBC0D85B42D25_6034_UN,7.9277,00000000000000000000000000000000000000100000000000000000000000000100000000010101001101100011000010101100110000010000001011100100110000000110001000011011010110101111010,RGHHFTPMCCHTLG-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CCN(CC2CCCO2)CC3)F)CC4,E42882A73B73449B_771307C7A004F1DF_6041_UN,7.5673766,00000000000000000001000000000000000000000010000000000000010000000000000000010001100101110010010110101000100111010001101011100000110011110110001011011011110111101111110,BNYAYFKXRHTVDL-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC3C2(CNC2)SCC3)F,74D741BA986C15BB_1074F2FBD20F8FD6_7022_DP,7.545191,00000000100100000000000000000000000010000010000000000100000000000010000000100000111101111011010010001000110100011001001011100000110101110110001010011111010110101111010,AZUNRZKHKKEFEC-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC4(CC3=CC=C(C=C3)F)CC4)C5CCNCC5,CAD111CCAF99D959_0EF63E030BA2F733_6034_UN,8.413113,00000000000000000000001000000000000000000010000000000000000000100110000000010000001101110001000010101100110100011000001011100100110000100110001001011001010110101111010,BNLDXZUYOAEVPJ-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC4(CC3=CC=C(C=C3)Cl)CC4)C5CCNCC5,A4F59CD4CEDBCE8C_FD98E2627A3205B8_6034_UN,8.413104,00000000000000000000001000000000000000000000000000000000000000100110000000010000001101110001000010101101110100011000001011100100110000100110001001011001010110101111010,OJDIIMAZSGLCAD-UHFFFAOYSA-N
O(C3CCN(CC1=CC=CC=C1)C2(CC2)C3)C[C@@H]4CNCC(O4)(C)C,6ECFD7F57133763A_D88A9ECBCDEA222B_6039_DP,8.207336,00000000000000000000001000000000000000000000000000000000010000000010000010110000001001100010000101101000010011011001001011100011110010000110001101011101110111111111110,OSGPDQACMWITBS-GGYWPGCISA-N
FC1=C(C=CC(=C1)C2OCCO2)NC3C4CC3CN(C)C4,6560A3B51BD27874_AA19C2D3130E847E_6041_UN,7.222078,00000000000100000000000000000000000000000010000000000000010000100000000010010000100101110010010010101000010111000001001011110000100011110110001011011011010011111111110,YPSHAOICFNSSHQ-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC3CCOC2(CCCCC2)C3)F,F98CBDF66ADB1240_E38F15DA8AE92A1B_7022_UN,7.53732,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110011010001101000110101011001001000100000110011110110001011011111110111101111110,WXAFPMQDEDVDEF-UHFFFAOYSA-N
CCC2=C1N(C=C(C1=CC=C2)C3CCNCC3)C[C@H]4[C@@H](CCNC4)C5=CC=C(C=C5)F,59BF848355706568_F1726C0DA4B38F5F_6034_UN,8.506136,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010101100110100010010001011100100110100100110001001011011010110101111010,JTACTEOHPYHEGM-UPVQGACJSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2C[C@]3(C)C[C@H]3C4=CC=CC=C4)C5CCNCC5)F,D062BA13789AF604_781ACB6B39B06802_6034_UN,8.766706,00000000000000000000001000000000000000100010000000000000000000100110000000010101001101110001000010101000100100011001101011100100110000100110001011011011010110101111010,NMBFRJJSPWJDKL-CPJSRVTESA-N
C(C1CCCCC12CCC2)=CC3=CC(=C(C)C=C3F)F,3F333D72D06160B4_3CE4A0135D9E48A1_7019_UN,9.070499,00000000000100000000000000000000000000000010000000000000000000000010000000000000000000010000000000010000010100001000001000000000110000100000000011010010000000001011010,UWJMWTUJQAZUIO-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)NCCN(C)CC2COCCC2,979B33F03121D50B_2D62311725C47E24_6041_UN,7.061841,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001011011111010111101111110,WDKFXPIRTGSTDJ-UHFFFAOYSA-N
C(C1CC2CCC1C2)=CC3=C[N](C)N=C3C4=C(C=CC=C4)Cl,2D1A3F6D5B4A14F3_26C918F1B473BA7F_7019_UN,8.012959,00000000000000000000000000000000000000000000000000001000000000100100000000010000100100010000011010010001010100000000001011101100110000100100001011011010000010101111010,LOIOYIRGKCPVOR-UHFFFAOYSA-N
CC1=C(C=C(C=C1)Cl)NCCN(C)CC2COCCC2,07F9560B9C094AED_AF00F9B94823DE0A_7022_UN,7.0618224,00000000000000000000000000000000000000000000000000000000010000000000000000000001001001110001010001101001100111010001101000100000110011110110001011011111010111101111110,SRXRJWAUFIKIKG-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)C=C,DD55BE4318981E09_B79E8621ECA950A5_6041_DP,8.61956,00000000000000000000000000000000001000000010000000000100000000100100000000010101101101110011010010011000000110000000000011100100110101110110001010001011010110101111010,ADXHZBUICJUJBM-GXTWGEPZSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=C(N=CC=C2Cl)Br)C3,E8A66DBF6DDD7AA6_9F2ED7691283BD65_6035_UN,8.260302,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000010111101001010100000101001001100011110000100100001111011110110111101111110,RFLQZZHBUSFYAE-SRRSOLGSSA-N
CN(C)CC1=C(C=CC(=C1)NC3CCC2(CCCN2)C3)F,5B7A760F7BE17BCB_E92B6F52D77CE42D_7022_DP,7.5372634,00000000000000000000000000000000000000000010000000000100000000000010000000100000101101110011010010001000110100011001001001100000110101110110001010011111010110101111010,NCZUHKZWYMPVDQ-UHFFFAOYSA-N
N4CCC1=C(C=C(C(N1CC2CSCC(N2)C3=CC=CC=C3)=O)C#N)C4,81586809C37F51DA_F1C50E6379D3F1C9_6034_DP,8.148466,00000000000000000000000000000000000010000100000000000000000000100100000000010001101001101001100001101100110000110100011011100101110100000110001111011011011110100111110,RJSBQRIIXCFSRU-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC3C(CCCC3)C4CC4,2F3BC3E7364CA837_6A29A1B594F8EC24_6041_UN,8.013042,00000000000000000000001001000000000000000010000000000000000000100100000000010101001101010011010010001100011110000000001011100100110001110100001011011011010110101111010,ZORXPTYREAAGLJ-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CC3(C)CCCCN3CC4=CC=CC=C4)C5=CCNCC5)F,A7FD59D64D73DE74_A7266EA5B916B864_6034_UN,8.668167,00000000000000000000000000000000000000000010000000100000000000100110000000011001001101110001000010111100110110011001101011100100110000100110001011011011010110101111010,GNJREUNSHKYXFO-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)N[C@H]3[C@@H](CCCC3)OC4CCCC4,AF235951E897BA9E_84CDC67DF96D19CC_6041_UN,7.9403973,00000000000000000000000000000000000000100000000000000000000000000100000000000100000000000011000110100100110000010000001001000111110011010100011111010111100011101111110,OKHPQBYDXQGKRE-NHCUHLMSSA-N
FC2=C1C=CC=CC1=NC=C2NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,7EB9711A5A0141E4_C32F6BF47A24A4DD_6041_UN,8.299362,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,QZUOLOMSTRVEAR-QRQCRPRQSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)NC[C@@H]4CN(C)C[C@H]4C5=CC=CC=C5)F,2C9AC8CD41BE26B9_851C37434503288B_6041_UN,7.5312357,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101100010110010001001011100100110001110110001011011111010110101111010,LHSFPASYAUFPOZ-KNQAVFIVSA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=N3)CC(C)(N)C4=CC=C(C=C4)Br,064B2E96654CC2E6_7CE66A3FEF75BA33_6034_UN,8.262594,00000000000000000000000000000000000000100000001000000000000000100110000000010101001111110011000010101100110100011001001011100100110100100110001001011001010110101111010,FIGRYOKOYXPCMC-UHFFFAOYSA-N
CC3CCCC(CC=CC1=C[N](C)N=C1C2=C(C=CC(=C2)F)F)C3,8ED6E47870921E10_A601A2E7C15AD003_7019_UN,8.11816,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010000000110000001101011101100110000100100001011011110000110101111010,LHQWXVNQXVZYAP-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=NC=N2)NC3CCN(C)C34CCCNC4,EC07623C3345C4AF_3B9423CCAF9991F4_6041_DP,8.452702,00000000000000000000000000000000000000100010000000000100000000000110000000010101101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,OTYQCRBJTUCEQS-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC34CNC(C3)CO4,4A4AC40A255ED6B7_067B52FB263B86FD_6041_DP,8.25464,00000000000000000000000000000000000000000010000000001100010000000110000000010000101100010011011111101100110101011000000011101100110111110110001001001001110111101111110,UXWWEGTUKRCJDW-UHFFFAOYSA-N
ClC1=CC3=C(C=C1)C(=O)C2=C(CCCC2)N3C[C@H]5N[C@H]4CCCC[C@H]4C5,5B7BFB1A9850378D_CE16D5FD222CE51C_6034_UN,8.580687,00000000000000000000000000000000000000000000000000000000000000000100000000010001000101010011000011101101110100010100001011100101110000100100001111011001111110100111110,MIMUTLAWSOBEDI-QOKNQOGYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CNCC34CNC4)Cl,109BA48C4FE3774C_AAE2E3997DA2FC1A_6034_DP,7.6089907,00000000100100000000000000000000000010000000000100000100000000000110000000010110111101111011000010001001011100001000000111100100110101110110001010001011010110101111010,WKCRBNNODKVNCB-UHFFFAOYSA-N
BrC1=CC(=CN=C1)NCC2=NC=CN2CC3CNCCC34CCN(C)CC4,9908C42724E91E7B_E2CBA387D926CC94_6034_UN,8.071871,00000000000000000000000000000000000000100000001000000000000000000110000000010101101101110011010010101000110100011001101011100100110101110110001011011011010110101111010,DQVLPRJCFHRZCB-UHFFFAOYSA-N
FC2=C(C=C1NC(NC1=C2)=O)NC3=CC=C(C=C3)C46CC5CC(CC(C4)C5)C6,4C97700B810E7C0E_4A55DD1FCB350DAE_6041_UN,7.701277,00000000000000000000000000000000000001000011000000000110000000100110000000000101100100010000000010000100011100101100010011000101100101110100001111000011001010100111110,KEZXXYJEJIIAFW-UHFFFAOYSA-N
CC1=C(C(=CC=C1)F)NCC2(CCSC2)N3CCOCC3,8989E3F8757C1AB2_9F185B38DD2A9142_7022_UN,8.122647,00000000000000000000000000000000000010000010000000000000010000100010000000010001001101111011000110101000000111011000001011100000110011110110001011011011010111101111110,WCIBIYSKMVNZPG-UHFFFAOYSA-N
CC1=C(C(=CC=C1)Cl)NCC2(CCSC2)N3CCOCC3,DEB6A2EC0BFAB814_BBC40CACC107FCDE_7022_UN,8.122639,00000000000000000000000000000000000010000000000000000000010000100010000000010001001101111011000110101001000111011000001011100000110011110110001011011011010111101111110,HOTXRKLCHOXLNO-UHFFFAOYSA-N
C(C2C1CC3CC(C1)CC2C3)=CC4=C([N](N=C4C)C5=CC=C(C=C5)F)C,ED74C0D96EDC2FE0_6ABF9B922C587674_7019_UN,8.518973,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000001010010100010100000000000011101100100001110100001011001110000010101111010,XEDBUZSCNTWUCY-UHFFFAOYSA-N
C(C2C1CC3CC(C1)CC2C3)=CC4=C([N](N=C4C)C5=CC=C(C=C5)Cl)C,00E7D2E527E1FB9F_4265DCB62CB97FA4_7019_UN,8.518965,00000000000000000000000000000000000000000000000000001000000000100100000000010000100100010000001010010101010100000000000011101100100001110100001011001110000010101111010,QFXVARHGWWAASX-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC34CC(CC3)OC4,35B6FD603D4E23AF_D07738D1F2479022_6041_UN,8.014717,00000000000000000000000000000000000000100010000000001000010000100110000000010101100100010011011111100000110101011000001011101100110011110100001011011011110011101111110,MZFSMPPMUVCZFN-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C([N]1CCC(C)C2CCNCC2)C=CC(=C3)Cl)C4,C66B4D881A3560D9_8DEE3D48B1F90377_6034_DP,8.350335,00000000000000000000000000000000000000000000000000000000000000000100000000010000001101110011000010101101110110010011101011100100110101100110001011011101010110101111010,LLLMYFWCSOPZPL-UHFFFAOYSA-N
N(CCC1=CC2=C(C=C1)COC2)[S](C3=CC4=C(C=C3)[NH]C=C4)(=O)=O,4D678AC54EF48524_B7404E805CD9636B_6029_UN,8.991309,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100101000001010001110111001011000011011001100111100001110001011111001010111110111110,LVRRVSCJGSXYKW-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)C#N)NC(C2CNC2)C3=CC=C(C=C3)F)F,E6BC584927BA5C3C_1D9A5FCB3CA1074D_6041_DP,8.025512,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110010000000001000000100000000000001000100000101110110001011000011010010100111010,CJJPDGAJWYMRBM-UHFFFAOYSA-N
CC(C)[N]1C(=NC=C1NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C,F79BE45EC47FEF93_EC02432C3F98035B_6041_DP,7.905265,00000000000000000000000000000000000000100010000000000100000000100100000000110101101101110011000010101000100100010000001011100100110101110110011011011111010110101111010,VFBQKRLPQIIXCH-FUHWJXTLSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3CCC2(CCCOC2)O3)F)CC4,CC21AA1C430BB311_86D59781F6B6D921_6041_UN,6.838512,00000000000000000001000000000000000000000010000000000000010000000010000010010001101101110011010110101000010111011001101011100000110011110110001011011011110111111111110,CFNWZVYOJXXIJS-UHFFFAOYSA-N
N1C4CCC1CC(C=CC2=CC=CC3=C2[N](C)N=N3)C4,47F7DD41F3A87E32_2EEBCD7E57B3BB74_7019_DP,8.966787,00000000000000000001000000000000000000000000000000001000000000000100001000010101100100000011011010110100110000010000001011101100111000000100001001011001000010101111010,ODLVBUGKCGRCGO-UHFFFAOYSA-N
CC1=C(C=C(C=C1)N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)CC#N,1A5B6BF1CE777ED7_E1560C8108220213_6041_DP,7.759875,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000101001000100110101110110001011010011010110101111010,IBVIGLTXQPCBMO-WOJBJXKFSA-N
C2(=CC1=C(C=CC=C1F)S2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,4EB861C9251F4405_321CCE187D0D61BE_7022_UN,8.21995,00000000000000000000001000000000000010000010000100001000000000100100000000010001111101011011011010101100010100010000001011101100110001110110001011011011010110101111010,JLYBXNQVFHMIKI-SZNDQCEHSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC3CN(CC2=CC=CC=C2)C4(C3)CCOCC4,99205EEE0BBD8198_E3B92C5F4E4952DF_6041_UN,7.9272523,00000000000000000000100000000010000000000000000000000000010000000110000000110001100101100001010011101000110001011000001011100100110011010110011011011111010111101111110,SPPAOTQOFZLTQJ-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CCCCC3)C4=CC=C(C=C4)F,33F50663184B18D6_B0797A95543FEF3A_6041_UN,7.7372384,00000000000000000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001001011011010110101111010,UDDNAELSAMYXEU-NRFANRHFSA-N
CC1=C(C=C(C(=C1)NCC3O[C@@H]2CCCC[C@H]2C3)Cl)C4CC4,063CAA7C614731AA_AEB88195A71BEA0E_7022_UN,7.6672354,00000000000000000000001000000000000000000000000000000000010000100000000000000000001100010010000110001101010110000000001000000000110011110100000011010011110111101111110,OIHRJJKLWQKSBN-CTHAPGQVSA-N
CC1=C(C=C(C(=C1)NCCC2CCCC(C)C2)Cl)C3CC3,E62E9ABBAB1797D8_406BA5A6EAF96A4E_7022_UN,7.9008884,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010001000000001001100110010001101000000000110001110000000011010111010110101111010,FNIBQUJXNADMPN-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C(=O)OCC2)NC4=CC3=C([N](C)C=C3)C=C4,028CA706922A126A_60C6DBCA282C4E0F_6041_UN,8.898385,00000000000000000000000000000000000000000000000000000000010000000100000000010000000101000001010010100100010001000000001011110101000011010100001111011001011011111111110,CJHMNSIAIBOQRY-UHFFFAOYSA-N
CC1=C(C=C(C=C1)Cl)NCC(CN2CCCC2)C3CC3,D52B17E6349339DA_935A16B0FDA0C981_7022_UN,8.455111,00000000000000000000001000000000000000000000000000000000000000000000000000010000101101110011000010001001000110010000001001100000110001110110001010011011010110101111010,VIVXNONYNWLMIT-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)NCC(CN2CCCC2)C3CC3,FC57074D9935A73F_1138DE1E904769AF_6041_UN,8.45511,00000000000000000000001000000000000000000010000000000000000000000000000000010000101101110011000010001000000110010000001001100000110001110110001010011011010110101111010,DYEYYCCYIKEKFE-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC[C@@H]2CC[C@@H](O2)C3CC3)F)CC4,36C8C255E91456F3_A9356F75C8998443_6041_UN,7.3618674,00000000000000000001001000000000000000000010000000000000010000100000000000010001101101110011010110001000000110010001101011100000110011110110001010011011110111101111110,KVNACPMFGQFOED-PZJWPPBQSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CNCCC3(C)C)Cl,D5D0AFBDEB164419_66E583F032925643_6034_UN,8.463236,00000000000000000000000000000000000010000000000100000000000000000110000000110110111101111011000010101001101100011001101111100100110101110110011011011111010110101111010,NAQUSDVHDOTMIZ-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=CC3=C(C=C2)N=C(Cl)C=C3Cl)C4,3F79089F4B2AB7D1_454EA329F0204D6F_6035_UN,8.0913105,00000000000000000000000000000000000000000000000000000000000000000100000000100000000001110000010011101101010100000101001001100111110000100100001101011110110111101111110,OYHXOORATRKRSF-YBQLKJDGSA-N
C1CC(NC1)C2=NC(=CN2CC3CCCCN3C)C4=CC=CS4,D6A921F6965FEED2_49C39EF9FE9BD6EE_6034_UN,7.748403,00000000000000000000000000000000000010100000000000000000000000100100000000010101011101101011010010101000100010010001101011100100110000000110001010011011010110101111010,AGSYSMIZADYGLV-UHFFFAOYSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC2=C[N](C)N=C2C3=C(C=C(C=C3)F)F)C4,127402D67C8F124D_09D61C98B1635954_7019_DP,8.237635,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010010011010010000110100010000001011101100110000100100001011011011000010101111010,UAPCBUJWHJKVRM-ZLENFMNRSA-N
C1(=C(C=C(C(=C1)Cl)Cl)Cl)NCC(OC)C2CCCOC2,4949C2DF93928AE6_3812C5BF975FB847_7022_UN,8.2281275,00000000000000000000000000000000000000000000000000000000010000000000000000000000001000110101010100101001000111000000101000000010110011110110000011010011110111111111110,IUSOUQOZDSVXAM-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)F)F)NCC(OC)C2CCCOC2,24820C8B04576075_C325BFB0773E867B_7022_UN,8.228123,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110101010100101000000111000000101000000010110011110110000011010011110111111111110,YMVPSUULDAMCHR-UHFFFAOYSA-N
CN5CCCN(CC1=C(C=C(C=C1)N[C@@H]2C4=C(OC3(C2)CCC3)C=CC(=C4)F)F)CC5,53DA3A09666DC46B_6D7DC15E82962CB7_6041_UN,7.866867,00000000000100000001000000000000000000000010000000000000010000000010000000010001100001110001010001101100110110011101101011100100110011110110001011011011110111101111110,BMHULOJPNXOFQR-QHCPKHFHSA-N
C1(=C(C=C(C(=C1)F)F)Cl)NCC(OC)C2CCCOC2,8C820291D35564BC_A7950473C94DBF8B_7022_UN,8.228107,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110101010100101001000111000000101000000010110011110110000011010011110111111111110,XQQJNQGKWSULEU-UHFFFAOYSA-N
C[N]1C=CC2=C1N=CC(=C2)NCC(N3CCOCC3)C4=CC(=CC=C4)F,3C59A9897EC3B349_CA66DE594ABEDD54_6041_UN,7.4792986,00000000000000000000000000000000000000100010000000000000010000000100000000010101001101110001010110101100010101010000001011100100110011110110001001011001010111101111110,QEYLCVXOANRFEF-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC[C@H]2[C@@H](OCC2)C3=CC=C(C=C3)F)F)CC4,CDD82E4A57C72CBA_CB73B4393F2292F8_6041_UN,7.6662374,00000000000000000001000000000000000000000010000000000000010000100000000000010001101101110011010011001000000111010001101011100100110011110110001011011011110111101111110,PTXVJRRQLUFGDM-CYFREDJKSA-N
C(=CC1=CC(=CC(=C1)F)F)NCC2C(C)(CCCO2)C,831798A58C97B8A5_7606C4A777C317A2_7022_UN,8.358773,00000000000000000000000000000000000000000010010000000000010000000010000000100000001000010001000100111000000111001001101000000000110010100110000001010111110101101111110,GBXOGLGDNRVATF-UHFFFAOYSA-N
CC(OCCN1C(C)COCC1)CC2CCCCN2C,0BC60C9DAA232284_143B80BDBD086F55_6039_UN,8.037155,00000000000000000000000000000000000000000000000000000000010000000000000000010000000001100000010101101000000011010001101011100010110010000110011001011110110111111101110,HNKOAYYJWVDSDY-UHFFFAOYSA-N
CC(C)C2=C1N=C(C=C(C1=CC=C2)C)NCC3=C(C=CC(=C3)C4OCCO4)F,25F86395D2AFCEF6_60EA2ED45D94B411_6041_UN,8.093355,00000000000000000000000000000000000000100010000000000000010000100100000010100100001100010000000010101100010101000000001011010100000011110110011011010111010111111111110,KNKOMFMLACCDOL-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NCC4(N3CCN(C)CC3)CCCCCC4,84B6C37B6D7A25C2_3C46C7B78AE392FA_6041_UN,7.0786653,00000000000000000001000000000000000000000010000000000000010000100010000010010001001101110011010010101000000101011001101011110000110011110110001011011011010111111111110,YRQFPIGWYYAJSS-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4,40657046D41E635F_289CAC724FA35FE6_6041_UN,8.521637,00000000000000000000001000000000000000000010000000000000000000100000000000010000101001110011010000101000000110010001101001100100110001110110001011011011010110101111010,AIMKEHBBISFNJG-AVRDEDQJSA-N
C(C12CC(C1)OC2)=CC3=C[N](C)N=C3C4=C(C=CC=C4)Cl,89C2EA30C3A3B464_8A8BF11281616593_7019_UN,7.245945,00000000000100000000000000000000000000000000000000001000010000100110000000010000100100010000011010010001010101001000000011101100110010100100001010001010110011101111110,VCVNLEQTWMLNFM-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC3C(C3)C4CCCC4,FE221973416E3242_98FDA4D328CB9903_6041_UN,8.559578,00000000000000000000001000000000000000000010000000000000000000100100000000000000101000010011000010101100010100000000001001000100110001110100001011010011010110101111010,JDSDOAOVBWGQBX-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3(CCCN(C)C3)C)Cl,A7ADAA8E4EE7EC34_A8B0F36250BA64C4_6034_UN,8.070907,00000000000000000000000000000000000010000000000100000000000000000110000000010110110101111011010010101001001110011001101111100100110001110110011011011111010110101111010,IEGFRIMJXXSPBA-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2CC3=CCSC3(C)C)C4CCNCC4)F,A5858650BCA8FB66_6473C4B532121B41_6034_UN,8.753277,00000000000000000000000000000000000010100010000000100000000000100110000000111101011101111001000010111000100110011000101011100100110000100110001011011111010110101111010,VBKQFMBAHYEOLJ-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3NCCC3)C[C@H]4[C@@H](CNC4)C5=CC(=CC=C5)F,414655FEFFEF08DB_CEC4DA231E010835_6034_UN,8.061986,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010001100110100010000001011100100110100100110001011011011010110101111010,VPTVSAZPDCUSQO-CTCAENTCSA-N
FC2=C1CCCC1=CC(=C2)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,DB21E5BC3E691053_4BD8E0F8023A8A06_6041_UN,8.266897,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101100010110010001101011100100110001110110001011011011010110101111010,NPINGPFALPZNCS-JXFKEZNVSA-N
CC1=C(C=C(C(=C1)NCC3CCCN(CC2=CC=CC=C2)C3)Cl)C4CC4,87414B1233BEA2A9_FBB038BA600047B8_7022_UN,8.242827,00000000000000000000001000000000000000000000000000000000000000100000000000010000101001110011000000101001000110010000001001100100110001110110001011011011010110101111010,MVTBYLZJEWNLRK-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NC3(CC2=C(C=CC=C2)F)CCCCC3)F)C4,191D0AFBA50BF847_98B43FF0D1BED052_6041_UN,7.998497,00000000000000000000000000000000000000000010000000000000000000000010000000010000000001110011000000101100110110011010101001100100110001110110001011011011010110101111010,HALSGLMANSGGES-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2CCCC3CCCN23,98C3F4C4B2494F1C_B714EF23354FAF8F_6041_UN,7.9224725,00000000000000000100100000000010000000000000000000000000000000000100000000100001001101100011010010101100010000011000001011100000110001010110011011011111010110101111010,HKXARDZWAROPDY-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CC2(CN(C)C2)C)C=CC(=C3)Cl)C4,63EF6EA60276248C_81A8163E45C7A372_6034_UN,7.7906995,00000000100100000000000000000000000000000000000000000000000000000110000000010000101101110010010010001101110110011011001011100100110001100110011011011101010110101111010,FMWKTTPMMXQDIP-UHFFFAOYSA-N
C2(=C1OCCOC1=CC(=C2)C#N)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F,78AC6A605978D3F5_B26E492361B1A4F8_6041_DP,7.998726,00000000000000000000000000000000000000000110000000000010010000100000000010000001001000110011000101101100110101010100001011000100110111110110001011010011110011110111110,FHKIDCXNIXBTAG-RDTXWAMCSA-N
FC1=C(C2=C(C=C1)C=NC=C2)NCC3CCCN(C)C3C4=CC=CS4,F94F76BCAEBE66DF_E0438B874FB80FEB_6041_UN,8.681732,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,QUCMDGSRXFNUHC-UHFFFAOYSA-N
C1(=CC2=C(C=C1)SCCCC2)NC3=C[N](C[Si](C)(C)C)N=C3,B59712591CA19FA2_4143047D7016488A_6041_UN,7.4029307,00000000000000000001100000001010000010000000000000001000000100000100000000110001110100101001011010001100010000011001001011101100110001010110011010011101010110101111010,SQPXGYKANKPGGI-UHFFFAOYSA-N
ClC1=C(C=C(C=C1)CCCC=CCC2(CCNCC2)C#N)Cl,327E81EB44A5CAA4_EF7D30029FED3D0E_7019_DP,8.971547,00000000000000000000000000000000000000000100000000000000000000000010000000000000001000110001000000111001100100011000001001000000110000100110001011010011010100100111010,BGRPBMNVIYSKCZ-UHFFFAOYSA-N
CN5CCCN(CC1=C(C=C(C=C1)NC2=CC4=C(C=C2)OC3(CCCCC3)O4)F)CC5,AA9A772BEF18B66C_ED22B6A0974FBE5E_6041_UN,7.811353,00000000000000000001000000000000000000000010000000000000010000000000000010010001100101110000010011001100010110011101101011110100110011110110001011011011110111111111110,ORFXHDKAEFGBLB-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCC3=CC(=C(C=C3)Cl)Cl,C0DE4EC3906EB172_733AEABFB50DFFA8_6038_UN,7.8308253,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010011100000011001110100110000011000000000110010100000000011010011011110100111110,JUPNPNKPFODOIJ-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCC3=CC(=C(C=C3)Cl)F,3DFE2EF96D52E376_626751362067B4F3_6038_UN,7.830819,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011001110100110000011000000000110010100000000011010011011110100111110,AJMQFPQKXUVZFY-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCC3=CC(=C(C=C3)Br)Cl,18C256233C5BC8E7_096377AA76FEB6E0_6038_UN,7.830819,00000000000000000000000000000000000000000000001000000000000000000000000000000000001000010011100000011001110100110000011000000000110010100000000011010011011110100111110,HBYVVYHVNALFNM-UHFFFAOYSA-N
CCC4CCC1=C(C3=C([N]1CC2(CCNC2)C)C=CC(=C3)C)C4,61A5676A2FEA19D0_9E52E281C50706DE_6034_DP,8.34787,00000000000000000000000000000000000000000000000000000000000000000110000000010000101101100011000010001100110010011011101011100100110000000110011011011101010110101111010,LMCJOKMWXRULSJ-UHFFFAOYSA-N
C(C12CCC(CC1)CC2)=CC3=NC4=C([N]3C)C=CC(=C4)Cl,C2DA1056E651000E_E92FEA66E827DFB6_7019_UN,8.173298,00000000000000000000000000000000000000100000000000000000000000000110000000010101000101010000010010010101010100001000001011100100110000100100001011011010000010101111010,FIQKVZCODBMTRS-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NC2CCN(C)C23CCCNC3)OC=C4,7CB8D9C90E9EBEFC_99CEDE1065895799_6041_DP,8.367696,00000000000000000000000000000000000000000010000000000100010000000010000000010001101101110011010110101100110110011001101011100100110101110110001001011001110010101111110,PZEYBVBLCSDCID-UHFFFAOYSA-N
CCNCC1=CC2=C(C=C1)N(C=C2)CC(N3CCNCC3)C4=CC=C(C=C4)F,982E1B7E87FF0102_B5FC173E73DB2427_6034_UN,8.313069,00000000000000000000000000000000000000000010000000000000000000000100000000010001001101110001000010101100110100010010101011100100110100100110001001011001010110101111010,JYAJZMZNEVEVBY-UHFFFAOYSA-N
CCNCC1=CC2=C(C=C1)N(C=C2)CC(N3CCNCC3)C4=CC=C(C=C4)Cl,17B100994AF63221_C4602991C21D0415_6034_UN,8.313062,00000000000000000000000000000000000000000000000000000000000000000100000000010001001101110001000010101101110100010010101011100100110100100110001001011001010110101111010,DKBKITUZLRODBK-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC34CC(C3)CCO4,58E51C0911D6AE14_DD5D33E47962569B_6041_UN,7.792537,00000000000100000000000000000000000000100010000000001000010000100110000000010101101100010011011110101000010101001000001011101100110011110110001011011011110111101111110,VCSSXCDOBFVCDH-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3CCN(C(CC)C)C3,DECD5BA3D1B1DB27_78B3D6D386BE2B2A_6041_UN,8.2922325,00000000000000000000000000000000000000000010000000000000000000000100000000010001101101110011000010101100010110010011101011100100110001110110011011011111010110101111010,YUTJSXNXKFDELM-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC4=CC2=C(C3NC2CC3)C=C4)Cl)C5CC5,A431B3A02B3A7B29_7E0777D477838FE9_7022_DP,7.4624214,00000000000000000000001000000000000000000000000000000000000000100000000000000000000100010010000010000101110110010000001001000100000101110100001011010011000010101111010,KFNLLQGIUZCXCG-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C2CC2)N[C@H]4[C@H](C3=CC=N[N]3C)OCC4,BFF407E172C97D55_B64BB778A7143594_6041_UN,8.640578,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011011111000000100101010000001011101100000011110100001010011011110011101111110,FNFLTEWSPWKCIY-RHSMWYFYSA-N
C[N]1C=CN=C1C(NC(=O)CC2CC3CC2C4CC34)C5=CC=C(C=C5)F,C0763BA20F022FC9_35021F5D858C6DA7_6038_UN,8.3391905,00000000000000000001001000000000000000100010000000000000000000000100000000010101000101010001110010000000110100110000010011100100110010100100001011001011001110101111110,VDBLVMDRCRJENI-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC4(CC3=CC=C(C=C3)F)CCNC4)C5CCNCC5,BFCBBB2134889AB8_486363478A3C569F_6034_UN,8.52067,00000000000000000000000000000000000000000010000000000000000000100110000000010000101101110011000010101100110100011000001011100100110100100110001001011001010110101111010,SYTGBBFGWDEALQ-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC4CN(CC2=CC=CC=C2)C3(CCCC3)C4,DCBD1E33C1EBC19A_74BCA94A73F628B8_6041_UN,7.9431844,00000000000000000000100000000010000000000000000000000000000000000110000000110001100101100001010010101000110000011000001011100100110001010110011011011111010110101111010,KBCOHIIMTXRFTO-UHFFFAOYSA-N
CC1(C)[C@@H]4C[C@H]1C2(CC2)C5=NC3=C(C=C(C=C3)Cl)C(=C45)C6=CC=CC=C6,BBB778E80B44A2CD_73C7C3B58159EE33_2201_UN,7.570797,00000000000100000000001000000000000000000000000000000000000000100110000000100000000000010000000000100101010110001000100001000100110000100100000011010100000010001111010,FGUQQTWYOPFKOZ-IEBWSBKVSA-N
CC1(C)[C@@H]4C[C@H]1C2(CC2)C5=NC3=C(C=C(C=C3)F)C(=C45)C6=CC=CC=C6,57CE0F3DA62BBCC2_E9A35886A1CCB6E0_2201_UN,7.5707903,00000000000100000000001000000000000000000010000000000000000000100110000000100000000000010000000000100100010110001000100001000100110000100100000011010100000010001111010,BGPRYXSDHDAVJU-IEBWSBKVSA-N
FC1=CC2=C(C=C1)N(C=C2C3=CCNCC3)CC4(CC)CCCN4,019961DC994FCFF6_D6A033D6FB31E174_6034_UN,8.486782,00000000000000000000000000000000000000000010000000100000000000100110000000011001001101110011000010111100110110011010101011100100110100100110001001011001010110101111010,CTWCIMACYNJDRJ-UHFFFAOYSA-N
C[N]1C=C(C=N1)C(NC(=O)CC2CC3CCC2O3)C4=CC(=C(C=C4)F)Cl,16C5CE5F8DFF225D_AFA9299FBD6B80DA_6038_UN,7.881257,00000000000000000000000000000000000000000010000000001000010000000100000000010000100100010001111010000001110100110000011011101100110010100100001011011011101111111111110,VCEAIKCOBAQQPM-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)F)NCCN(C)CC2OCCC2)F,0CC1461F3D18CBB5_080EB8359723D788_7022_UN,7.4621325,00000000000000000000000000000000000000000010000000000000010000000000000000000001001101110001010110001000100111010001101000100000110011110110001010011111110111101111110,HRMXVOLUYZZKKP-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(C)CC=CCC3,DCB9CDFF5604E5C3_4BABE07370F3030B_6041_UN,7.987275,00000000000000000000000000000000000000100000000000000000000000100110000000010100101101100011010010111000000010011001101011100000110001010110001011011111010110101111010,ZQNPHDQBWOVVPA-ATNAJCNCSA-N
CC5(C)CCC1=C(C4=C([N]1C[C@@H]2CNC[C@H]2C3=CSC=C3)C(=CC(=C4)F)F)C5,7BECF099E0D6E9F2_B1612049FBD7D623_6034_DP,8.627551,00000000000000000000000000000000000010000010000000000000000000100110000000110000101101111011000010001100010100011001101011100100110000100110001011011111010110101111010,ORYJTMXFJCXIMA-KXBFYZLASA-N
FC2=C(C=C1OC=CC1=C2)NC3=CC=CC(=C3)CC4CCCN(C)C4,A3D1CE43C565E03D_6D86FD4E6F200E36_6041_UN,7.729562,00000000000000000000000000000000000000000010000000000000010000000000000000010000000101110001010011101100010110010001101011100100110001110110001011011011110110101111110,AWNQEUFMFKEOIM-UHFFFAOYSA-N
FC2=CC(=C1OCCC1=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,9787D130BCF0387A_8C61C063C9FA1FB0_6041_UN,8.014435,00000000000000000000000000000000000000000010000000000000010000000000000000000000100101110011010110001100010111010101101000100100110011110110001011011011110111101111110,LQERYFKWQWZGQS-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC3C4CCC(C3(C)C)C4)F,D0999C4DC08606CC_FD6C21B083877D68_6041_DP,7.039028,00000000000000000000000000000000000000000010000000000000000000000010000000100000001000010011000010101100110110011000101001000000110101110100001011010111010010101111010,DMIDKUUPEVMNPV-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)C[C@H]4N[C@H]3CCO[C@H]3C4)Cl,A5EA5B000881A134_5AD18BFE152B76E9_6034_UN,8.125544,00000000000000000000000000000000000010000000000100000000010000000100000000010111010101011011000111001101111111010000001111100100110111110110001010011011110111101111110,WYQQZJZBCIPQQW-BPUTZDHNSA-N
CC1=C(C=C(C(=C1)NC[CH]3C[C]2(C[C](C)(C2)C)C3)F)F,DA07A320D14957C7_AFA17189E13F284B_7022_UN,8.519784,00000000000100000000000000000000000000000010000000000000000000000010000000100000001000010010000000001000010110001001000000000000100001110000010010000111010110101111010,YQNDMMQDAGNLQG-UHFFFAOYSA-N
CN(C)CC1=C(C=CC=C1)NCC2(CCNCC2)C3=C(C=NC=C3)F,0598A2C26E4E6D68_519E190A4A0E7A63_6041_DP,7.9155483,00000000000000000000000000000000000000000010000000000000000000100110000000100000101001110011010000101000100100011001001011100100110101110110001011011111010110101111010,YWDPTDLZBDQMCZ-UHFFFAOYSA-N
CC1=CC(=CC(=C1)F)NC2CCN(C)C23CCCNC3,40C610AB71E99F6E_A8D4A63EF80156E6_6041_DP,7.999606,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101110011010010101000110110011001101011100000110101110110001001011101010010101111010,DUGOTRIYKMJGMF-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CC(=N2)NCC3CCCN(C)C3C4=CC=CS4,7C1BF26BDF7E15E2_DD2FCB1D64D4C997_6041_UN,8.488449,00000000000000000000000000000000000010100010000000000000000000100100000000010100111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,APYKAMBBQNPUET-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC(C3CCNCC3)C4=CC=CC=C4,2ECC41D862D59064_7DAEE5675BB52080_6041_DP,8.087953,00000000000000000000000000000000000000100010000000000000000000000100000000000100001000110001000000101100110110010000001011000100110101110110001011010111010110101111010,SCUOHNNUCZRABF-UHFFFAOYSA-N
C(C1=CSC2=NCCCN12)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,748D145532ADDD1C_23F7D19A0826B94F_7019_UN,8.320541,00000000000000000000000000000000000010000010010100000000000000000000000000001110110101011000010010111100011110010000101111100000110001110110001011011010010010101111010,FRRBSESNLMUIGP-UHFFFAOYSA-N
FC1(F)CC15CCC(C=CC2=C[N](N=C2C3=C(C=C(C)C=C3)C)C4=CC=CC=C4)CC5,D31C3C7BA53A6684_38EA5E062D5BFE94_7019_UN,8.2061,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011110000010101111010,LHKRVRNVOVLHFZ-UHFFFAOYSA-N
C2(=C1CCCCC1=NC=C2)NC3=CC=C(CC[Si](C)(C)C)C=C3,FD47887674B074DB_5079933FDFE91ADE_6041_UN,7.772446,00000000000000000000100000000010000000000000000000000000000000000100000000100000100000100011010000100100010000011001101001000100110001010100011011011101010110101111010,QBWWXRMQRYFDJL-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3(CCC)CCCN3)Cl,308CB6A7F22ECB25_05EB9595BBB9C5FE_6034_UN,8.26175,00000000000000000000000000000000000010000000000100000000000000000110000000010111011101011011000010001001101110011011001111100100110101110110001010011111010110101111010,SBMDPZBTFJZOQM-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(CC)CCC2)F)CC3,F9139726A4AA3B7C_C33C6BC72F06E7C1_6041_UN,8.018765,00000000000100000001000000000000000000000010000000000000000000000010000000010001101001110011010000001000000110011011101011100000110001110110001010011111010110101111010,FOYFBRJGOFAKBL-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC[N]3C=CC4=C3C=CC(=C4)Cl)C5CCNCC5,C3A09AF37B7EB652_2260A370B6A816B2_6034_UN,8.509505,00000000000000000000000000000000000000000000000000000000000000100100000000010001001101110001000010101101110100010000001011100100110000100110001001011001010110101111010,MZWGPHJBLAKJQL-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5)F,5AB5A8A6A6D6FB24_0957B6D6F54003B2_6041_DP,7.663981,00000000000000000000001000000000000000000010000000000000000000000010000000100000001000010011000000101100110100011001101001000100110101110110001011010111010110101111010,BPQJCOXHOLIHGI-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NCC3=C(C=N[N]3C)C4CCC4,759DEEC996760F4A_2B7CB25DE70955D5_6041_UN,7.7142925,00000000000100000000000000000000000000000010000000001000000000100100000000010001101100010011011010001100010100010000101011101100110001110100001010011011010110101111010,CLPOOXUUPIVGIY-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CCC2CC2)C=CC(=C3)Br)C4,186AE832F1BB3D20_B4F4CF9CF024B5A6_6034_UN,7.716288,00000000000000000000001000000000000000000000001000000000000000000110000000110000000101010000000010001100010100011001101001100100110000100100000011011100010110101111010,AHZWIILJXJXPTE-UHFFFAOYSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC4=C3N=CC=CC3=C(C)C=C4,AFBF79AECC87029E_BEF60ADDB40198D4_7019_UN,8.525663,00000000000000000000001000000000000000000000000000000000000000100100000000000000000000000000000000110100010000000000000001000100110000000100000001010010000110001111010,VRMYPTDMMXTDRW-AEFFLSMTSA-N
FC1=CC4=C(C(=C1)NCC2CCCN(C)C2C3=CC=CS3)C=CO4,A4535E7919E7E747_B05B5CDDD0E0EC6A_6041_UN,8.342998,00000000000000000000000000000000000010000010000000000000010000100000000000010000111101111011010011101100010110010001101011100100110001110110001001011011110110101111110,KKNOGIQFZPHUOX-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3CC4CCC(C3)O4,763B2018EF2D7380_AA58C68589D529E3_6041_UN,8.490652,00000000000000000001000000000000000000000010000000001000010000000100000000010000100100010001011011100100110100010000001011101100110011110100001001011001100011101111110,JGMAHODJJNYUJP-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CC2)C3=CCOCC3)F)CC4,EFB6865AB4474B3E_95963D328E21EF1A_6041_UN,8.15304,00000000000000000001001000000000000000000010000000100000010000100010000000011001101001110011010000111000000111011001101011100000110011110110001011011011010111101111110,WGTORBJFZKKLQF-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2(CCOCC2)C3CC3)F)CC4,28FD7751A71A0609_DEEA15E3B09DF0E4_6041_UN,7.8139534,00000000000000000001001000000000000000000010000000000000010000100010000000010001100001110011010001101000100111011001101011100000110011110110001011011011010111101111110,DARXTGCBYWEYOO-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C=C)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,72B1204B383686D9_3BA93EFD29D71189_6041_UN,8.442588,00000000000000000000001000000000001000000010000000000000000000100100000000010101101101010011010010111000000100010000001011100100110001110110001011011011010110101111010,OAXBLGOCGQACDX-IERDGZPVSA-N
FC1=CC=C(C=C1)CC2=NC(=CC=N2)NCC[C@@H]3CC[C@H]4C[C@@H]3C4(C)C,AFAC78E12C3A75B4_4F070F2B0A8F298F_6041_UN,8.374665,00000000000100000000000000000000000000100010000000000000000000000110000000100100101000010001000000101000110110011000101011000100110001110100001001010101010110101111010,SNJNEAIHAOFUCG-LNLFQRSKSA-N
FC1=CC=C(C=C1)C3=CC2=C(C=CC=C2)N3C[C@H]4[C@@H](CNC4)C5CCOCC5,70AB34E3AFB1CC0A_827FEE89CCFACA7F_6034_UN,8.82321,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011000010101100010101000000001011100100110010100110001011011011010111100111110,VJGPTDMYEOBCIZ-UNMCSNQZSA-N
CC1=C(C=C(C(=C1)N[C@H]3[C@H](C2=NC=C[N]2C)OCC3)Cl)C4CC4,0829628C4057918E_6CA15EDFCA142F87_7022_UN,8.80408,00000000000000000000001000000000000000100000000000000000010000100100000000010101100101010011010111000001100111010000001011100100000011110100001010011111110011101111110,PYQHDEKWZKOYSB-NVXWUHKLSA-N
FC1=C(C=CC(=C1)C2CC2)N[C@H]4[C@H](C3=CC=N[N]3C)C4,E19A2DAD2513113C_D96CA29F32A6B736_6041_UN,8.233337,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010010011010000000100110010000000011101100000001110100001010011011000010101111010,VXXJBNSXVJDNRI-IUODEOHRSA-N
FC1=CC4=C(C(=C1)C=C[C@@H]2CCO[C@H]2C3=CC=N[N]3C)OCOC4,F8E173EA19888323_DFCBC8C4B3CF2456_7019_UN,8.417676,00000000000000000000000000001000000000000010000000001000010000100100000000010000100100110100011111110100010101000100001011111100100010100110001011111010110011111111110,GSILBWITYLCORX-KZULUSFZSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC(CC)C2CCCO2)F)CC3,25B71DA386842E4C_834453AD43D61ECA_6041_UN,7.6975594,00000000000000000001000000000000000000000010000000000000010000000000000000010001100101110011010110001000100111010011101011100000110011110110001010011111110111101111110,HBJTZDGQKVELNJ-UHFFFAOYSA-N
FC2=C1C=NC=CC1=C(C=C2)NCC3CCCN(C)C3C4=CC=CS4,A4B74E537CAB141F_9DCE5C12B9222C68_6041_UN,8.629408,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,JFQJHIYSGQFOJI-UHFFFAOYSA-N
C2(=C1OC=CC1=CC=C2F)NCC3CCNC(C3)(C)C,06324F97E4CB4220_A858787C1E01EDFE_7022_DP,7.85082,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010011000110101100110110011001101011000100110101110110001011010111110110101111110,YNJYYAYFLGPCMR-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCOCC23CCCC3)F)CC4,78ABDDCB516FFCBD_4E21E828AE6FF130_6041_UN,7.0002537,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110011010011101000110111011001101011100000110011110110001011011011010111101111110,MENWBJTVZYSRFU-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CCCCC3)C4=CC(=CC=C4)F,A971F09FCE0770B4_5264378DB2202082_6041_UN,7.718951,00000000000000000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001001011011010110101111010,PYWGQMPMINIWCX-NRFANRHFSA-N
N(C1C2CCC(CC1)C2)C(=O)CC3=C[NH]C4=C3C=CC(=C4)F,B16EAC03854F2573_2831051B4315B4BA_6038_UN,7.814801,00000000000000000001000000000000000000000010000000000000000000000100000000000000000100010011100010000100110100110000011001000100110111100100001001010001001110100111110,IKEYFGVMSAWRJO-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3C5=C(C4CCC3C4)C=CC=C5,AB8D4BA360351691_696873BDC5860EDD_6041_UN,8.619051,00000000000000000001000001000000000000000010000000000000000000000100000000010101000101010011010010000100011100000000001011100100010001110100001011011011000010101111010,ISZNQHCLNZTJDZ-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CCCCC3(C2)OCCO3)F,C9DD7C4E5C54DC98_E905E81972F9C704_7022_UN,7.4760094,00000000000000000001000000000000000000000010000000000000010000000000000010100000001101110011010010001000010101001001001010110000110011110110001010011111110111111111110,YCWNTBFBZLDJAT-UHFFFAOYSA-N
N4C[C@@H]1COC[C@]1(C=CC2=C[N](N=C2C)C3=CC(=CC=C3)F)C4,4BE6E9DA7DF8A5A1_6E27639DAB22FAB5_7019_DP,8.566925,00000000000000000000000000000000000000000010000000001000010000100110000000010000101100110011001011011100010101001000000011101100110001110110001010001011010011101111110,DMZFPOBUQQQZJD-QAPCUYQASA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC4CN(CC3=CC=CC=C3)CC45CCOCC5,8AFF1E70F5502D1A_EA56965E65AE2A84_6041_UN,7.9728727,00000000000000000000000000000000000000100010000000000000010000000110000000010100101101110011000010101100010111001000001011100100110011110110001011011111010111101111110,AVVYVWCAJIXBGB-UHFFFAOYSA-N
C2(=C1CCCC1=NC=C2)NC3=CC=C(CO[Si](C)(C)C)C=C3,132F9F39CB99CC76_4DD10261A924D7B1_6041_UN,7.8772717,00000000000000000000100000000010000000000000000000000000000000000100000000100000100000100011010010100110010001011000101001001110010001010100011011011101010111101111110,UMQREGSAUANSMF-UHFFFAOYSA-N
N(CC12CC(C1)C2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)F,3A5F490C8C2ED539_3BE694CC06B43AF8_6038_UN,7.386333,00000000000100000000000000000000000000000010000000000000000000100010000000000000001000010011100000001001010100101000011000000000100000100000000010010011011110100111110,LCLLVLDDQFHEIN-UHFFFAOYSA-N
N(CC12CC(C1)C2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)Cl,0DABDD0AC691FC5D_F403CEC4DD8243DE_6038_UN,7.3863254,00000000000100000000000000000000000000000000000000000000000000100010000000000000001000010011100000001001010100101000011000000000100000100000000010010011011110100111110,FGAQRXWHWZJWJX-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@@H]2COC[C@H]2N3CCCC3)F)CC4,35FE6E8EBEF4D357_C7AEDA2E64EF8114_6041_UN,7.4186945,00000000000000000001000000000000000000000010000000000000010000100000000000010001100101110011010111001000100111010001101011100000110001110110001010011011010111101111110,BHNBKISZPNONSM-NHCUHLMSSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC2=C([N](N=C2C)CC3=C(C=CC=C3Cl)Cl)C)C4,437687B4F2A9879F_B1EC95FE1DF4A4A7_7019_DP,8.480611,00000000000000000000000000000000000000000000000000001000000000000100000000010000100100010010001010011001110110010000101011101100110000100100001011011111010110101111010,LFSVFXRYIMMRES-SXGZJXTBSA-N
C[N]1N=C(N=C1N[C@@H]3C2=CC=CC(=C2CC3)F)C4CCOCC4,065D935D42340207_E1D836F6B5F4F0FE_6041_UN,8.079468,00000000000000000000000001000000000000100010000000001000010000100100000000010101100100110011011010100100111101010000001011101100110011110110001011011011010011101111110,LNWNDGGUHHUDCN-HNNXBMFYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC5=C4OCCCC4=CC(=C5)F,8EF515495411768F_0DED5F3826230C47_6041_DP,8.152427,00000000000000000001000000000000000000100010000000000000010000000100000000000101100101010011010110100100110101010100101011100100110111110100001011011001110011101111110,OPJKKOSVGWZDIO-BJWYYQGGSA-N
CN5CCCN(CC1=C(C=C(C=C1)NC23CC(C)(C2)OC34CCC4)F)CC5,4A4C0193B050B74F_0057347BBF21F95A_6041_UN,6.991653,00000000000100000001000000000000000000000010000000000000010000000010000000010001100101110011010111001000110110011001101011100000110011110110001010011111110111101111110,MBKNXOKGJVBUCQ-UHFFFAOYSA-N
C2(=C1OCCCC(C1=CC=C2)=O)NC4=CC3=C([N](C)C=C3)C=C4,99E37CD615D1D1A7_0736187F3B6F3EE2_6041_UN,9.423535,00000000000000000001000000000000000000000000000000000000010000000100000000010000000101000101010110000100010001000100001011100101000011010100001111011001111011111111110,IJMVFGHBUOASSP-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C(CC)C3=CC=C(C=C3)F)=O,61865170425FE724_559FB97901AE2138_6038_UN,8.146493,00000000000000000000000000000000000000000010000000000000010000000000000000000000001100010011100010001000110100110010011000000000110010100100000001010001111111111111110,OLOKDJDSJWITHA-UHFFFAOYSA-N
N5CC1=C(C=C(C=C1)NC3=C(C=C(CN2CCN(C)CC2)C=C3)F)C4(CC4)C5,ED8CE7E291EFC922_E1BA6352508A24D5_6041_DP,7.2060623,00000000000000000000001000000000000000000010000000000000000000000010000000010001001001110011010000101100010100011001101011100100110101110110001011011011010110101111010,LQKMMLBBNKPPDB-UHFFFAOYSA-N
FC2=C(C=C1C=CC=NC1=C2)NCC3N(C)CC4(CC3)CCC4,212F3935B5906A7E_FA30C5556319004B_6041_UN,7.9541235,00000000000100000000000000000000000000000010000000000000000000000110000000010001001001110011010000101100010110011001101011100100110001110110001011011011010110101111010,RVVPBRUBMMKDGC-UHFFFAOYSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)C[C@H]3NC[C@H](C)CC3,52AC124CD51AE567_A32594237BF84279_6034_UN,8.820765,00000000000000000000000000000000000010000000000100000000000000100100000000010111011101011011000010101001101100010011101111100100110001110110011011011111010110101111010,QMMZLKRSFAAUMZ-STGLDUPZSA-N
CN(CC1CCNCC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=C(C(=CC=C4)F)F,85165A297EA200A2_877F4E554026A94E_6041_DP,8.355206,00000000000000000000001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010001001011100100110101110110001011011011010110101111010,QMTDSYACDPEUFN-DOTOQJQBSA-N
CCC1=C(C(=CC=C1)F)NC2CC3CC2C4CCCC34,E56A43DF3E5EB3F7_4CFB65DAC7895A05_6041_UN,8.417671,00000000000000000000000000000000000000000010000000000000000000000000000000000000000000010011000010000100110100010010001000000000110001110000000011010011000110101111010,FZBLUWWKQXQOLH-UHFFFAOYSA-N
CC1=C(C=C(S1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)Br,D52A769A4B4A456A_0091374328D60B36_7022_UN,8.042717,00000000000000000000001000000000000010000000001100001000000000100100000000010001111101011011011010101000000100010000001011101100110001110110001010011111010110101111010,GNQXQOBKRYLJIB-ACJLOTCBSA-N
C(C1CC2CCC1O2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,010D3027704A443A_7EE68BB8034BE349_7019_UN,7.7526636,00000000000000000000000000000000000000000010000000000000010000000000000000000000000101010000010010010000010110010000101000100000110011110100000011011010100011101111110,RDDUIIZVPHOOIZ-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC3C4CCC(CC3)CO4,BD875ED6B95608AE_FD709BF75F580681_6041_UN,7.672858,00000000000000000001000000000000000000100010000000001000010000100100000000010101100100010011011110100000110101010000001011101100110011110100001011011011110011101111110,QJFHQTJFVYGQJY-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CCC2CSC2)C=CC(=C3)Br)C4,C372E9AD1D1A8F6A_5E1A93380A1E63A9_6034_UN,8.136298,00000000100100000000000000000000000010000000001000000000000000000110000000110000000101111000000010001100010100011001101011100100110000100110000011011100010110101111010,VZPTVYYPZQMQLT-UHFFFAOYSA-N
CCC1=CN(C2=C1C=C(C=N2)Br)CC4(CC3=CC=C(C=C3)F)CCNC4,021A92C9B4215926_53CDD71DE50A869D_6034_UN,8.669644,00000000000000000000000000000000000000100010001000000000000000000110000000010100101101110011000010101100110100011010001011100100110000100110001001011001010110101111010,NCAHIQCMDVYVSV-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC3=CC2=C(CCNC2)C=C3,A5A0C22F65A49CB8_98B540FB17690849_6041_DP,7.7109528,00000000000000000000100000000010000000000000000000000000000000000000000000100000001000100001010000101100110000011000001001000100110101010110011011011101010010101111010,NSWLHXIJBBHFTA-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C=N[N]2C3CCCCO3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,A83F3FC028CB7D26_AB6E276261FB8C8E_6041_UN,8.610803,00000000000000000000000000000000000000000010000000001000010000100100000000010001100101110011111110101100110111110001111011101100110011110110001011011011010011101111110,NOSMFZYCSJCHNE-FQXDTITESA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CNCC4(O3)CCC4,9B5F362CCD870D45_26EF89B24D405AD1_6041_DP,7.4885197,00000000000100000000000000000000000000100010000000000100010000000110000000000100101000110011000100101100010110001000001011000100110111110110001011010111110111101111110,LYTZXRDOYMGIRP-UHFFFAOYSA-N
CC1=CC=C(C=C1)C2=CN(C(=N2)C3NCCCC3)C[C@H]4[C@@H](CCNC4)C5=CC=C(C=C5)F,F9F33C41EDD749B1_D13A5B6ACCDB9BBF_6034_UN,7.962639,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101000100100010000001011100100110100100110001011011011010110101111010,NOKOFPDDRKVKCA-VZXIVJASSA-N
FC1=CC(=C(C=C1)NCC2(C)C(OCC2)C3CC3)C=C,46A86FCAD6996876_0231F99333258BBC_6041_UN,8.19813,00000000000000000000001000000000001000000010000000000000010000100010000000000000001100010011000011011000000111001001101000000000110011110110000010010011110111101111110,FWSGHOPMZCHYIT-UHFFFAOYSA-N
FC2=C(C=C1C=CN=CC1=C2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4,5B735C2C1D4FE1FA_B42E4F2F413E3BA2_6041_UN,8.786781,00000000000000000000000000000000000000000010000000000000000000100100000000010000101001110011010000101100010110010001101011100100110001110110001011011011010110101111010,IHVHOXJBEVFLJC-AVRDEDQJSA-N
FC1=C(C=CC(=C1)C#C)NC2CN(C)C3(C2)CCOCC3,E7D5530848773218_88E3FE155855977B_6041_UN,7.159415,00000000000000000100000000000000000000000010000000000000010000000010000000010001100101110001010011101000110111011001101011100000110011110110001011011011010011101111110,HUHLKJPEMXDEAM-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2C3(CCCC2)CCC3,CCFDFD0EA62CE976_82AA1F3701BA7DAC_6041_UN,7.4660716,00000000000100000000100000000010000000000000000000000000000000000110000000100001001000100011010000101000010000001000001001000000110001010100011011011111010110101111010,RWMYKBYGDODZKZ-UHFFFAOYSA-N
O[C@H](CF)C1=CC(=CC=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,99520360448EB0F4_9C28320C158EC969_6041_UN,8.58916,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101000011010010101000100000010000001011100100110111110111001011011011110111101111110,NMIDJXYVVWIYEG-HBGVWJBISA-N
O[C@H](CCl)C1=CC(=CC=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,C4EA87160E65FE53_38F566FAFC0256FE_6041_UN,8.5891485,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101000011010010101001100000010000001011100100110111110111001011011011110111101111110,XIKVSBKFAGAQBK-HBGVWJBISA-N
C1(=C(C=CC(=C1)C(F)F)Cl)N[C@H]3[C@H](C2=C[N](N=C2C)C)OCC3,886CBA37D4D3431C_EE81F8C98D747CEF_7022_UN,9.223926,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111000001100101010000001011101100000011110100001010011111110011101111110,VJCDVNYJNYWRLZ-HIFRSBDPSA-N
CC1=C(C(=CC(=C1)F)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F)C#N,AA13801C30B0E507_A1ED2F72CC78C711_6041_DP,7.66627,00000000000000000000000000000000000000000110000000000010000000100000000000000001101000110011000000101000100100010000001001000100110101110110001011010011010010101111010,KRYHEYVYLMLFIP-VQIMIIECSA-N
NCC4(OC1=C(C=C2C(=C1)CNCC2)F)CCC3=C(C=CC=C3)C4,33F33B8D31D537F1_55AC13DEC07B0066_6035_UN,8.186699,00000000000000000000000000000000000000000010000000000000000000000010000000000000001010110011000100101100110100011100001001000111110110100110001111010011110101100111110,FFNBOKLIPLWUTO-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(CCNC2)C3CC3)Cl)C4CC4,955A0743E99689EA_897502A972FEFECC_7022_DP,8.416274,00000000000000000000001000000000000000000000000000000100000000100010000000000000101100110011000010001001100110011000001001000000110101110110001010010011010110101111010,JKOQSWFQHVHOAT-UHFFFAOYSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(=O)CC(C4CC4)C5=CC(=C(C=C5)F)F,49226877224D905C_636721895CE33126_6038_UN,7.4935865,00000000000000000000001000000000000000000010000000000000010000000000000000000000000100010001100011000100110100110000011000000100110011110100000011010011101111110111110,YEYHUNWMFAYWFU-UHFFFAOYSA-N
CC1(C)O[C@@H]2CC[C@H]1C[C@H]2OC4=C3C=CC(=C(C3=NC=C4)F)F,F935FB5D988EF318_7D7DBDE7585C31C1_6035_UN,8.136965,00000000000000000000000000000000000000000010000000000000010000000110000010100000000000010000000001100100010110001100101011000111110010100100000111010110100011011111110,BZWLKOIIMHXEDL-COLVAYQJSA-N
CC1(C)O[C@@H]2CC[C@H]1C[C@H]2OC4=C3C=CC(=C(C3=NC=C4)F)Cl,DA11CEF26415C24D_6766CEB61F83A0E9_6035_UN,8.136949,00000000000000000000000000000000000000000010000000000000010000000110000010100000000000010000000001100101010110001100101011000111110010100100000111010110100011011111110,INTZCRZPVVRAKK-COLVAYQJSA-N
FC1=CC=C(C=C1)C2=CSC(=N2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,EE9A78BA1AC531D0_F1DB8DFD6B405AB1_6041_UN,8.587538,00000000000000000000001000000000000010000010000100000000000000100100000000010101111101011011010010101000001100010000001011100100110001110110001011011011010110101111010,NXZJBUVGFHCDIG-IERDGZPVSA-N
FC2=C1C=C[NH]C1=CC=C2NC3CCN(C)C4CCCC34,19D48154ABF79B88_C801498DF4075344_6041_UN,8.44711,00000000000000000000000000000000000000000010000000000000000000000100000000010000100101110011010010101100110110010001101011100100110101110100001011011011010010101111010,RPMSXRDOBZYKCL-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CO2)NCC4CC3(CCN3C)C4,3C5A803A782274F7_BEF33CAD8C1FC5D4_6041_UN,8.194206,00000000100100000000000000000000000000000010000000000000010000000010000000010000001101110010010110001100010100011001101011100100110001110110001010011011110110101111110,OWWPAHDUYVHWBO-UHFFFAOYSA-N
O([C@@H]([C@H]1NCCC1)C2=CC=CC=C2)C3=NC=C(C(=C3C#N)C)I,335B53D983189585_AB082EE303757628_6035_UN,7.708277,00000000000000000000000000010000000000000100000000000000000000000100000000000000101100010011100111101000100100110100011011000111010000100100001111010011110011101111110,BLUDHHIZGCPBDX-DLBZAZTESA-N
N(CCC12CC(C1)CO2)C(=O)C3(CCC3)C4=C(C(=CC=C4)Cl)F,B3B88D787F5606B8_2EBEA47E6E4CBA2D_6038_UN,7.87654,00000000000100000000000000000000000000000010000000000000010000100010000000000000001100010011100011001001110101111000011000000000110010100110000010010011111111110111110,IEUHFGBKPUCWBN-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C([N]1CCC2CCNC2)C=CC(=C3)Br)C4,8CAE38F83066ADEC_31ED24A3F2A2DE5B_6034_DP,8.109934,00000000000000000000000000000000000000000000001000000000000000000110000000110000001101110011000010001100110100011001101011100100110000100110001011011101010110101111010,VNCJFZSCGZWORO-UHFFFAOYSA-N
CN(C1CCCNCC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=CC(=C(C=C4)F)F,CC25862277745006_08D107057EF466DC_6041_DP,8.540193,00000000000000000001001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010000101011100100110101110110001011011011010010101111010,LPAJZSWSQDOHPW-JGNLYWJMSA-N
CN5CCCN(CC1=C(C=C(C=C1)NCC2C4(C23CC3)CC4)F)CC5,729AFA849E3A505B_F02BE261B774FB7E_6041_UN,7.625299,00000000000000000001001000000000000000000010000000000000000000000010000000010001101001110001010000001000010110011001101011100000110001110110001010011011010110101111010,GSTDJNAVULYWMY-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2CCCC(C2)C3=CC=CC=C3,46C86A27C264AEC7_F48974639E547C8B_6041_UN,7.866152,00000000000000000000100000000010000000000000000000000000000000100100000000100001000000100011010000100000100000011000001001000100110001010100011011011111000010101111010,JPWICCQCNAQHNM-UHFFFAOYSA-N
N(CC1C2CCC(C1)CC2)C(=O)CC3=C(C(=CC=C3)Br)F,7565AE1083FAA8CE_B80C13138997476C_6038_UN,7.306918,00000000000000000000000000000000000000000010001000000000000000000000000000000000001000010011100000001000110100110000011000000000110010100000000011010011011110100111110,RVHYDVQEJPNTBS-UHFFFAOYSA-N
N(CC1C2CCC(C1)CC2)C(=O)CC3=C(C(=CC=C3)Cl)Cl,C372E071DE2254FB_447EEE69BB1DA560_6038_UN,7.306916,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010011100000001001110100110000011000000000110010100000000011010011011110100111110,AATFTKBGGWJXDJ-UHFFFAOYSA-N
N(CC1C2CCC(C1)CC2)C(=O)CC3=C(C(=CC=C3)F)F,ED2E54831968C75F_53CF86AF8BB9089C_6038_UN,7.3069105,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000001000110100110000011000000000110010100000000011010011011110100111110,PDJLWKAGLJXCLW-UHFFFAOYSA-N
CN(C)CC1=CN(C2=C1C=CC(=C2)F)CC3C4(CCNC3)CCC4,D70A7E02C5202DA2_5EDB3F4F65C2945D_6034_UN,7.421601,00000000000100000000000000000000000000000010000000000000000000000110000000110000101101110011010010101100110100011001001011100100110000100110001001011101010110101111010,HISAUQCEQIFSQA-UHFFFAOYSA-N
CN(C)CC1=C[N](C2=C1C=CC(=C2)F)CC3C4(CCNC3)CCC4,D70A7E02C5202DA2_FAF961374DF631A5_6034_DP,7.4215784,00000000000100000000000000000000000000000010000000000000000000000110000000110000101101110011010010101100110100011001001011100100110000100110001001011101010110101111010,HISAUQCEQIFSQA-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@@]34CCN(C)C[C@H]3CNC4)Cl,ED97872F192AEFF1_683A17AAD2DDF569_6034_DP,8.006111,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101111011010010101101011110011001101111100100110101110110001011011111010110101111010,DNDSLHQQRGQBNG-UZLBHIALSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCCC3=C(C=CC(=C3)F)F,F5DB77328437CC22_DDEEB1EE40320956_6038_UN,7.92854,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,BQYMKGUJQGXZTN-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCCC23OCCO3)F)CC4,0DEBD538BA23054E_26349932D1E9D06D_6041_UN,7.027565,00000000000000000001000000000000000000000010000000000000010000000000000010010001100101110011010110001000110111011001101011110000110011110110001010011011110111111111110,FURLJZMFXLTIBL-UHFFFAOYSA-N
C2(=C1CCCC1=NC=C2)NC3=CC=C(CC[Si](C)(C)C)C=C3,39CE01C5322091A6_DFA8B6965D9D370F_6041_UN,7.888488,00000000000000000000100000000010000000000000000000000000000000000100000000100000100000100011010010100100010000011001101001000100010001010100011011011101010110101111010,AIBWGNSYYDBZHX-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=CC=C(C=C2)C4=C[N]3CCCCC3=N4,8D5FBED5251BCE22_434718048C2BBD86_6041_UN,8.062842,00000000000000000000100000000010000000100000000000000000000000100100000000100101000101100000010010101100010000011000001011100100110001010100011011011111010010101111010,XFYCDBCNYJLSNH-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCC3(CC2)CCOCC3)F)CC4,8959FBFD42E00E01_D9C81AAEB5A65CFC_6041_UN,7.0782394,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110010010000101000110111011001101011100000110011110110001011011011010111101111110,TXWLQXOLDBOBAX-UHFFFAOYSA-N
CCNCC1=CC2=C(C=C1)N(C=C2)CC3(CCNC3)C4=CC(=CC=C4)F,1E2FA51ADFCABB5A_9F1505016340E6D7_6034_UN,8.169214,00000000000000000000000000000000000000000010000000000000000000100110000000010000101101110011000010001100110100011010101011100100110100100110001001011001010110101111010,SYMXDYYOOOTXEU-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CC3(CC2)CCCCC3)Cl)C4CC4,F3AC960529B22D19_0ED1147BE8C44F36_7022_UN,7.4987392,00000000000000000000001000000000000000000000000000000000000000100010000000000000000000010011000010000001110110011000001000000000110001110000000011010011000010101111010,KLHSZRZNLYWUGY-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)C2OCCO2)C)NC(C3=NC=C[N]3C)CC4=CC=C(C=C4)F,255F2EE141259207_8E2DC8ABD3C49B4A_6041_UN,8.012389,00000000000000000000000000000000000000100010000000000000010000100100000010010101000101010000010010000000100111010000001011110100000011110110011011011111010111111111110,UFEOFTXIONMSMC-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CCOC2(CCCC2)C3)F)CC4,45D49B4363F6D04A_C4650900942F818D_6041_UN,7.0479965,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110011010011101000110111011001101011100000110011110110001011011011110111101111110,SBKREZISMAOUFH-UHFFFAOYSA-N
C1(=CC2=C(C=C1)CCOC2)NC3=C[N](C[Si](C)(C)C)N=C3,2C12240BC5C956F8_3FC09E78641C1060_6041_UN,7.102659,00000000000000000000100000001010000000000000000000001000010000000100000000110001100100100001011010101100010001011001001011101100110011010110011011011101010111101111110,KWCVFLQLRBBKEQ-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)N[C@H]4[C@H](CC4)C5=C(C=C(C=C5)F)F,D96387AECCEFC48A_9988A0D8D50CBB64_6041_DP,8.244157,00000000000100000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000110110010000001011100100110101110110001011011011010010101111010,XXABYPTUASNJCK-YGFMJBJJSA-N
FC1=C(C=CC(=C1)CC#N)N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,B78C5EDAB61913B4_440D029FE81F6A2D_6041_DP,7.309916,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,SGMKJOHUBCHKLA-VQIMIIECSA-N
CC1=C(C=C(C(=C1)N[C@H]2[C@@H](C2)C3=CC4=C(C=C3)OCCO4)Cl)C5CC5,E13958F8B8B1C3E0_B8F3851225EE2CC2_7022_UN,8.768478,00000000000000000000001000000000000000000000000000000000010000100000000010000000000000010010000000100101110111010100001010000100000011110110000011010011110011111111110,ABNXANBWDNDDOY-FUHWJXTLSA-N
FC1=CC(=CN=C1)C2=C5C(=CC(=C2)C=CC4=C3COCCC3=N[N]4C)OCO5,26D0F50339B65B9F_13C225F7006F6167_7019_UN,7.841848,00000000000000000000000000001000000000000010000000001000010000100100000010010000100100110000011011110100010111010100001011111100110010100110001011111010110011111111110,XHXJGLFNENPYSR-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[C@@H]3CNC[C@H]3C4=CN=C[N]4C,C09011B778E6D52B_E353E6B660281607_6041_DP,8.314911,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101110011010010101100010110000000000011100100110101110110001011001111010110101111010,QXHTYCMNKRKBKR-LSDHHAIUSA-N
O=[N](=O)C1=CC2=C(C=C1)C(=NC=C2)NC4=C3OCCCC3=CC(=C4)F,90628F61B0078429_D9E183FB6EA361F1_6041_UN,8.198655,00000000000000000000000010000000000000100010000001000000110000010100001100000100000000010001001100100110010101000100001111101100101011110100001011111001110011110111110,MSAMSTXGRZGCIM-UHFFFAOYSA-N
CC1=NOC2=C1C(=CC(=N2)C)NCC3CCCN(C)C3C4=CC=CS4,7D36FB58A3A26B79_ABDD53603BC3B8BF_6041_UN,8.49831,00000000000000000000000000000000000010000000000000000000010000100100000100010001111101101011111011101110010010110001111011101100110001010110011001011111010110101111110,RPUMHYQKFABRFL-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CC(CC)OCC2)Cl)C3CC3,32B1143DB53B716D_CE44EA0C94856694_7022_UN,7.8470073,00000000000000000000001000000000000000000000000000000000010000100000000000000000000000010011000001100001100111010010101000000000110011110100000011010111110111101111110,JAJBWGWBQAJSRQ-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NCC[C@@H]2CC[C@H]3C[C@@H]2C3(C)C)[NH]N=C4,CB7A9145451DB51F_0757ECFE00D70B39_6041_UN,8.545679,00000000000100000000000000000000000000000010000000001010000000000110010000100001101100010001001010001100110110011000101011001100110101110100001001010101010110101111010,BQYOEJHPZOPABN-WHOFXGATSA-N
CC1=CC=C(C=C1)C2=NC(=C(Cl)[N]2CC3C(CCN3)C4CC4)C#N,9F18F518CEFC4F7D_82F97CD26819C278_6034_DP,8.175916,00000000000000000000001000000000000000100100000000000000000000100100000000010101101101010011000010001001100100010000001011100100110000100110001010011011010110101111010,KGTHPMYMSBEAFS-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(C4=C(C=C(CC)C=C4)F)=O,243A3C6F7F562FAC_C1ACB7E87B5FB95A_6038_UN,8.713363,00000000000000000001001000000000000000000010000000000000000000000000000000000000001000010011100010001000010100100010010000000000110000100000000011000011011110101111110,OLLDNUQWHWEEHM-UHFFFAOYSA-N
N(C1C2CCC(C1)C2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,2111D4EF6817F0D9_1BEC279A20A8B5DE_6038_UN,8.348772,00000000000000000000000000000000000000000010000000000000000000000100000000000000100000010011100011100100110100110010011001000100110001100100001011010011001110101111110,DBMJZAPGVAALPS-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4CC(OCC4)C5=CC=C(C=C5)F,E080DC2C4C796133_AEAA6A5118B25A2E_6041_DP,8.346577,00000000000000000000001000000000000000100010000000000000010000100100000000000101101101110011010011101000110111010000001011100100110111110110001001011001110011101111110,KDYCQTQTZSLMBL-WHWMZARZSA-N
C[N]1N=CC(=C1)C4=NC2=C(C3=C(S2)CCCC3)C(=C4N5CCNCC5)C6=CC=C(C=C6)Br,1D02EE92267DE092_A1F04A2E8FC6ADC2_2201_UN,7.581268,00000000000000000000000000000000000010000000001100001000000000100100000000010001111101111001011010101100110100010000001011101100110001110110001011011011010010101111010,ORNWYMXHQHXMMX-UHFFFAOYSA-N
C[N]1N=CC(=C1)C4=NC2=C(C3=C(S2)CCCC3)C(=C4N5CCNCC5)C6=CC=C(C=C6)Cl,DDB740614F59F2DC_5C34161B900CB88B_2201_UN,7.581269,00000000000000000000000000000000000010000000000100001000000000100100000000010001111101111001011010101101110100010000001011101100110001110110001011011011010010101111010,SVTOOTFNGPINPX-UHFFFAOYSA-N
FC2=C(C=C1C=CN=CC1=C2)NCC3CCCCN(C)C3,D0F16107906B8103_854845197BCD2D73_6041_UN,8.48358,00000000000000000001000000000000000000000010000000000000000000000100000000010000101001110011010000101100010110010001101011100100110001110110001011011011010110101111010,GBDKCGLGTAFENM-UHFFFAOYSA-N
CC1=CC(=CC(=C1)F)NCC(CN2CCCC2)C3CC3,4FA4B84CD0D28D1B_0C8B88F4F15C218F_6041_UN,8.479476,00000000000000000000001000000000000000000010000000000000000000000000000000010000101101110011000010001000000100010000001001100000110001110110001000011001010110101111010,KJNZBHGLARMNJL-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3=C(C=CC(=C3)C4OCCO4)F,7F93E09EA3A64FD3_009ECE504164F0EF_6041_UN,7.4392095,00000000000000000000000000000000000000100010000000000000010000100100000010010100101101110000010010101000000111010001101011110100010011110110001011011011010111111111110,YMVKTLPAGHEBLS-SFHVURJKSA-N
C[C@@H](OCC3CCC1(CCC2(CC1)OCCO2)O3)C4=C(C=CC(=C4)F)C,AB43524AC6BF8446_28A0159E9D4B6CDD_6039_UN,7.5046206,00000000000000000000000000000000000000000010000000000000010000000010000010000000000100010000000010000000010101001000101010010010110010100110100011110110110101011011110,RZCBNYUULZBJCS-PYUWXLGESA-N
N(CC1C2CCC(C1)CC2)C(=O)CC3=C(C=CC=C3F)F,9FB68B4BF320D989_38E63FF41B373F8D_6038_UN,7.288743,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000001000110100110000011000000000110010100000000011010011011110100111110,GNZIPZILDZGISD-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3CN2CCCC2CO3)F)CC4,22024F364C2A7496_C48D029E2BD3AAFC_6041_UN,7.5917506,00000000000000000001000000000000000000000010000000000000010000000000000000010001101101110011010110101100010111010001101011100000110011110110001011011011110111101111110,DONJHQXATURLEO-UHFFFAOYSA-N
N(CC23CC(CC1=CC=CC=C1)(C2)CO3)[S](C5=CC4=C(N=C(Cl)C=C4)C(=C5)Cl)(=O)=O,D515ABEC92B5474B_A3530185ED9F2A73_6029_UN,7.73008,00000000000100000000000000000000110000000000000000010001011111001111010001000000011100011011001110101111011101001000010011001100111010101110001001101001110111110111110,FOSCSNYNOMWKPU-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@H]3[C@@H](CNC3)C4CCOCC4)Cl,A78437200F97C223_1EBF2D6034EEE536_6034_UN,7.5917983,00000000000000000000000000000000000010000000000100000000010000100100000000010110111101111011000010101001001101000000001111100100110111110110001011011011010111101111110,HAWTUDXLRVPYCD-HKUYNNGSSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CC(C3)C4CC4,7F350C5D1FE8A7BD_70FDD58A5197F30D_6041_UN,8.288617,00000000000100000000001000000000000000100010000000000000000000100100000000000100001000010010000000101100010110000000000001000100110001110100001011010111010110101111010,LOYGSDHMCYWODY-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CC2CCCCN2CC)C=CC(=C3)C)C4,20E57C87300BDEE9_2556DB00A57F59A2_6034_UN,8.0156555,00000000000000000000000000000000000000000000000000000000000000000100000000010001000101100000000010101100010010010010101011100100110000000110011011011110010110101111010,ATQXLSFRSMDHGD-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C3CCC2O3)NC4=C(ON=C4C)C=CC5=CC=C(C=C5)F,1D24F20B1685807E_32735ABF423FCCAA_6041_UN,8.272282,00000000000000000000000000000000000000000010000000000000010000000100000100000001100100010000001111010110010100000000001011001100000011110100001011010011100011111111110,REVNUTNWAHNNSV-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)OC(C2=CC=N[N]2C)C45CC3CC(CC(C3)C4)C5,C2323C5C203A5494_B3C6C635DED834A1_7022_UN,8.264924,00000000000000000000000000000000000000000010000000001000000000000110000000010000100100010000011111010100010100001000000011101110100000100100001011001010100011101111110,MXHIKDRNHIOWQN-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[NH]C3=C2CSCC3)NC4=CN=C([Si](C)(C)C)C=C4,942C636EDE6D5069_C173FACB34274991_6041_UN,7.607966,00000000000000000000100000000010000010000000000000000000000000000100000000100001000100101011010010100100110000011000001011000100110101010110011011011101010010101111010,WCFXZOLAANWVQO-UHFFFAOYSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NCC34COC(C)(CC3)C4,8FDA17A961D13C74_72D048D06B5A118F_6041_UN,7.2227674,00000000000000000000000001000000000000000010000000000000010000000110000000010101001101010011010011101100011111001001101011100100110011110110001011011111110111101111110,PTAMAPDXAHJOEY-UHFFFAOYSA-N
N4CCC1=C(C=C(C(N1C[C@H]2[C@@H](CNC2)C3=CC=C(C=C3)Cl)=O)C#N)C4,1F8BCD84A6539A0E_46483DCFCA88C564_6034_DP,8.252824,00000000000000000000000000000000000000000100000000000000000000100100000000010000101101110011100011101101110100110100011011100101110100100110001111011011011110100111110,RVHKBEFXMUCIKI-WMZOPIPTSA-N
CC5=NC1=C(C=C(C=C1F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)S5,CF433012E2E9AADC_608D0CB9E4F38738_6041_UN,8.243656,00000000000000000000001000000000000010000010000100001000000000100100000000010001111101011011011010101100010100010000001011101100110001110110001011011111010110101111010,FDWLDJKHHNMJSC-SZNDQCEHSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC3CC4CCCC(C3)C4,FF8AA2B8689A5249_1CE3607FC41CBE90_6041_UN,8.157542,00000000000000000000000001000000000000000010000000000000000000000100000000010101001101010010010010001100011110000000001011100100110001110100001011011011010110101111010,MVPUEBPCRPIVMG-UHFFFAOYSA-N
O([C@H]1C[C@H](NCC1)C2=CC=CC=C2)C3=C(C)C=C(C=C3C#N)Cl,D94BAEC2E73DBC68_B3BB2142E040E762_6035_UN,7.829246,00000000000000000000000000000000000000000100000000000000000000100000000000000000001000010001000001101001100100010100001001000111110010100100001111010011110011101111110,XDPTVCQYNOMIMK-MSOLQXFVSA-N
CC1=CC(=C(C(=C1)F)N[C@H]3[C@H](C2=C([N](N=C2C)C)C)OCC3)F,A19F0085ABBEA477_FC7D7EE21F6EF047_7022_UN,8.781367,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111000000100101010000001011101100000011110100011010011111110011101111110,QGMRZUIATRXTTK-RHSMWYFYSA-N
FC2=C1CCCC1=CC(=C2)N[C@H]4[C@H](C3=C(C)[N](N=C3)C)OCC4,650238E694594373_A1D7067F0531F186_6041_UN,7.8829484,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111000100110101010000001011101100010011110100001010011111110011101111110,AVZSOFRVPWIDMN-MSOLQXFVSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NCC4C(N(C)CC4)C5=CC=CC=C5,150CF43217A236E6_E6C3303A1D7C51A0_6041_UN,7.7413807,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101110011010010101100010111010001101011100100110011110110001001011011010111101111110,JRUDXFGYRPVJNZ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CCC2(CCNCC2)C3)F)CC4,BF4E75A423FEA6C3_83E4C8609519A312_6041_DP,7.6085806,00000000000000000001000000000000000000000010000000000000000000000010000000010001101001110011010010101000110110011001101011100000110101110110001011011011010110101111010,JMEBOBDXWDFJSY-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC[C@H]2COCCO2)F)CC3,EA5E173B9350BC05_C8E111AFC8F49446_6041_UN,6.9463153,00000000000000000001000000000000000000000010000000000000010000000000000010010001101001110011010101101000000111010001101011100000110011110110001011011011110111111111110,BLGOVONOPBREGI-KRWDZBQOSA-N
C1(=NC=C[N]1C2CCCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,148D97259E91F405_B2F0CAD933F3955A_6041_UN,8.441628,00000000000000000000000001000000000000000010000000000000010000100100000000010101100101110011110011101000101111110001111011100100110011110110001011011011010011101111110,UQROVNQKLIDQRD-BLAYRMRBSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3CCC2(CC2)C3)F)CC4,A473D2ACD6A83D1C_50A78038F009493F_6041_UN,7.5365925,00000000000000000001001000000000000000000010000000000000000000000010000000010001101001110011010010001000010110011001101011100000110001110110001010011011010110101111010,YTPHZRKZMDAQKM-UHFFFAOYSA-N
CN1CCCC1CCOCCC3COC2(CCCC2)O3,B33002DB04246E7B_9FAFEB2E3F3489D0_6039_UN,7.25776,00000000000000000000000000000000000000000000000000000000010000000000000010010000000101100100010011001000010011011001101011110010110010000110000000111010110111111100110,HIVGKAPBKZYNFZ-UHFFFAOYSA-N
FC2=C1C=CC=CC1=CC=C2NCC3CCCN(C)C3C4=CC=CS4,7A86247B16770F00_A8558C48C019D6EB_6041_UN,8.523186,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,ILTRJQWNIPDLQB-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NC(CCC)C3=C(C=C(C=C3)F)F,51C631319A764C42_24A1A9B92BA42366_6041_UN,8.175023,00000000000000000000000000000000000000100010000000000000000000100100000000010100100101110011010010101000100110010011101011100100010001110100001011011111010110101111010,WMCWNXZIISJTOW-GGYWPGCISA-N
FC1=CC2=C(C=C1)C(=NC=C2)NCC3N(C)CC4(CC3)CC4,9B0DB3A6AA86CF4E_5F64B97DB20B0A4E_6041_UN,8.17249,00000000000000000000001000000000000000100010000000000000000000000110000000010101001001110011010000101100010110011001101011100100110001110110001001011011010110101111010,GNPDDTZPICYJNK-UHFFFAOYSA-N
NCCCC(OC1=CC2=C(C=C1)CCCNC2)C3=CC=C(C=C3)F,FFEDE3C48D2DCBB8_A656E6CC4E4905C9_6035_UN,8.380417,00000000000000000001000000000000000000000010000000000000000000000000000000000000001010110011000000001100110100010100001001000111110110100110001111010001110101100111110,ODJIXTBKPIJQJB-UHFFFAOYSA-N
IC1=NC2=C(C=C1)C=CN2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,6926A784F14CC6DF_CF6B3A98A29715C7_6034_UN,8.41123,00000000000000000000001000010000000000100000000000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,XXEHXWQWLJAHQP-BEFAXECRSA-N
ClC1=NC2=C(C=C1)C=CN2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,B0217516E5C8D732_F9795225C244BFA9_6034_UN,8.411211,00000000000000000000001000000000000000100000000000000000000000100100000000010101100101010000010010101101010100010000001011100100110001100110001011011010010110101111010,CAKBSNVIIDXNQY-BEFAXECRSA-N
FC1=CC2=C(C=C1)C(=CN2CC3[C@@H]([C@H]3C)C)C4=CCNCC4,D2FFCB96E9F5A85D_BD0750F0253C0FE4_6034_UN,9.193071,00000000000000000000001000000000000000000010000000100000000000100100000000011000001101110001000010111100110110010000101011100100110000100110001001011111010110101111010,XDZUAHOTBWINGM-CHWSQXEVSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2OCC(C)(CC2)C)F)CC3,BEFD53A70B7FC949_F4E07C1FFC3569D5_6041_UN,7.72208,00000000000000000001000000000000000000000010000000000000010000000010000000110001101001110011010100101000000111011001101011100000110011110110011011011111110111101111110,PCSPWYJJIJYRGQ-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCCCC3)C4=CC=C(C=C4)F,C00D5C3E29F463F6_4588544423463AC4_6041_UN,7.3822637,00000000000000000000000000000000000000000010000000001000000000100110000000010000101100010011011010001100010100001000001011101100110001110100001001011001010110101111010,ZCPZJRKWUMHAJT-UHFFFAOYSA-N
BrC2=NC=C1N(C=CC1=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,36C0278EED68CCCD_79DF5600A7E29D0C_6034_UN,8.541725,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,SMLDUKZHJAYVHU-QRWLVFNGSA-N
CC1=C(C2=C(C=C1)C=C[NH]2)NC4CC(C3=CC=N[N]3C)OCC4,013F3C7C872C5400_462B1756107B9F6E_6041_UN,8.23316,00000000000000000000000000000000000000000000000000001010010000100100000000010001100100000010011111100100110011010000001011101100110111010100001011011111110011101111110,WQVYGANHTNUTHA-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCNCC23CCC3)F)CC4,39F3860DBF55786C_5D1F699ABE193C10_6041_DP,7.465248,00000000000100000001000000000000000000000010000000000100000000000010000000010001101001110011010000101000110110011001101011100000110101110110001011011011010110101111010,IJJOJASJMJIJFV-UHFFFAOYSA-N
N(CC1CN2CCC1CC2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)F,4193B7B9890AE2FE_0954EAD9B85F01A9_6038_UN,7.278807,00000000000100000000000000000000000000000010000000000000000000100010000000000000101001110011100000101001010100111000011001100000110000100110001011011011011110100111110,AFUZHJXCIYHILJ-UHFFFAOYSA-N
N(CC1CN2CCC1CC2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)Cl,031C18DA8E70F68E_C6B1B0D16369788F_6038_UN,7.2787995,00000000000100000000000000000000000000000000000000000000000000100010000000000000101001110011100000101001010100111000011001100000110000100110001011011011011110100111110,PEWWUMCOUOKLNF-UHFFFAOYSA-N
ClC2=NC=C1N(C=CC1=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,A5EBCE36AA959678_ED6E1BE56F25E2C6_6034_UN,8.541679,00000000000000000000001000000000000000000000000000000000000000100100000000010101100101010000010010101101010100010000001011100100110001100110001011011010010110101111010,OQUMVYNGKZWGAS-QRWLVFNGSA-N
N(C1=CC=C(C=C1)N2CC3CCC2C3)C(=O)[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)Cl)F,AEE0D8A2663DAC24_9B0FC87B04B3CC12_6038_UN,7.587534,00000000000000000000000000000000000000000010000000000000010000100000000000010000000101010111100011101001010101110000011011100100110011110110001011011011111011110111110,LJLXXUOIHIZNBY-RQGVKANISA-N
N(C1=CC=C(C=C1)N2CC3CCC2C3)C(=O)[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)F)F,2428E2E5AC4494B9_F89A295901563597_6038_UN,7.5875225,00000000000000000000000000000000000000000010000000000000010000100000000000010000000101010111100011101000010101110000011011100100110011110110001011011011111011110111110,IJZRRVKTGVWWKC-RQGVKANISA-N
CN(C)CC1=C[N](C2=C1C=CC(=C2)F)CC3CNCC34CNC4,F153FA76836D0D5B_5CBD91B2661772EE_6034_DP,7.5717154,00000000100100000000000000000000000000000010000000000100000000000110000000110000101101110011010010001100010100001001000011100100110100100110001000001101010110101111010,HYHDLAKZSYHOGS-UHFFFAOYSA-N
C2(=C1C=CC=CC1=CC=C2Cl)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,A4385D4700F73F05_84BE3904F5984938_7022_UN,8.15448,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101101010100010000001011101100110001110110001011011011010110101111010,UFBGXDQRVRQBRM-HXOBKFHXSA-N
C[N]1N=C(C=C1NCC2(CCOCC2)C3=CC(=CC=C3)F)C4CCCC4,6A753EE6C3D5865B_A65FCCE7BCEBEF32_6041_UN,7.970558,00000000000000000000000000000000000000100010000000001000010000100110000000010101101100110011011010101000000111001000001011101100110011110110001011011011010111101111110,NLYWPKFZURRSMP-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2=CC4=C(C=C2)OC3(CCCCC3)O4)F,207FDF69773808A7_010547B236AC6C73_7022_UN,7.7796307,00000000000000000000000000000000000000000010000000000000010000000000000010100000000101110000010011001100010100001101001010110100110011110100001011011111110111111111110,XUWDICVEPOXMLE-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NC3CC(C2=CC=N[N]2C)OCC3,CCB61461124A97E9_B4666CD1B14615AC_7022_UN,8.292808,00000000000000000000000000000000000000000010010000001000010000100100000000010000100100010010011111110000100111010000001011101100110011100100001011011011110011101111110,HGIHQQYJZIWONL-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC3C5CCC(C3C4=CC=CC=C4)C5,B0D371B13EE5AFE5_A8809A9259EDEE7D_6041_UN,7.9256773,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011011010100000010100000000001011101100010001110100001011011011000010101111010,QLVNPYMAVBFSGM-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC3CN(CC2=CC=CC=C2)C4(C3)CCCCC4,4529C240C1386186_7937269321C95EEC_6041_UN,7.8725834,00000000000000000000100000000010000000000000000000000000000000000110000000110001100101100001010010101000110000011000001011100100110001010110011011011111010110101111010,NBJGTUZDYWBGCA-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C2CC2)NC4CCOC(C3=CN=C[N]3C)C4,DFEFD9E6E42F43AB_08973DEE09D99399_6041_UN,7.63029,00000000000000000000001000000000000000000010000000000000010000100100000000010101000101010011010111100000100111010000001011100100110011110100001011011011110011101111110,QBCIXMRMPPNEMY-UHFFFAOYSA-N
N1CCCCC1C2=NC(=C[NH]2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,A7AEAC669A7AC9F3_442ED553251776CA_6041_DP,8.166931,00000000000000000000000000000000000000100010000000000110000000100100000000010101101101110011010010101000100110010001101011100100110101110110001001011011010010101111010,GCTFRKJVTCGTAJ-AGPBCMBSSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC3CN(CC2=CC=CC=C2)CC34CCOCC4,538ABDFEBA864979_59C30C743FC7647F_6041_UN,7.861043,00000000000000000000100000000010000000000000000000000000010000000110000000110001101101100011010010101000010001001000001011100100110011010110011011011111010111101111110,WACUKWDGWLETBI-UHFFFAOYSA-N
FC1=CC(=C(C=C1)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,EB3082B06080A0A2_B54EFC2122AED1CA_6041_UN,8.370401,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,AAOASUIWXAQYAX-YJYMSZOUSA-N
COC1=C(C=CC(=C1)C)NC24CC3CC(C2)CC(C3(F)F)C4,28B2F176C866075F_106F188A39CEE607_7022_UN,7.921724,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010001010100000100110100011100000000000011100001110000000111000111100011101111110,KXFXZPIHRQOJAR-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)C3=NC2=C(C=CC=C2)N3CC4CC5(CN4)CCCCC5,D95753421AE136F8_F3865BB07E901A88_6034_UN,8.010295,00000000000000000000000000000000000000100010000000000000000000100110000000010101001101010011000010001100110100011000001011100100110000100110001011011011010110101111010,RYYMSFHJBPPFFT-UHFFFAOYSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NC3CC4(C3)C5CCC(C4)C5,AD53D1B1982B9C67_970FC50C9880262C_6041_UN,7.780287,00000000000100000000000001000000000000000010000000000000000000000110000000010101000101010001010010000100111100011000001011100100110001110100001011011011000010101111010,QGMHHIHBFWNFCO-UHFFFAOYSA-N
FC1=CC2=C(C=C1)[NH]C(=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,3288F923E467A9DB_A18E1C28255229C2_6041_UN,8.580872,00000000000000000000001000000000000000100011000000000000000000100100000000010101101101010011010010101100010100010000001011100100110101110110001011011011010110101111010,PEDBNEBSXKCUCI-SZNDQCEHSA-N
CN(CC1CCNCC1)C2=NC(=CN=C2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,8C9CF35494DDB91E_C41DA5B320CA84EA_6041_DP,8.2173,00000000000000000000001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010001001011100100110101110110001011011011010110101111010,VEMYUAVIGWEMHT-JKSUJKDBSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@@H]2CCO[C@H]2C3CCNCC3)F)CC4,940CE0F6891AA92E_0EECC2124CD1CD43_6041_DP,7.790657,00000000000000000001000000000000000000000010000000000000010000100000000000010001101101110011010111101000100111010001101011100000110111110110001011011011110111101111110,WGHWUAGVQPDBJU-YADHBBJMSA-N
IC2=CC1=C(C=CC=C1)[N]2CC45OC3(CCNCC3)C(C4)(N)C5,011E3CD0E9DFAF00_C86348B3B90F9266_6034_DP,8.692301,00000000000100000000000000010000000000000000000000000000010000000110000000010000001111110011000111101100110100011000001011100100110111100110001011011011110111100111110,OSJIOTGATFTMJF-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NC[C@@H]2CNCC(O2)(C)C,858BC4F22A0D3197_699105F007006302_6041_DP,7.554368,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110011011000111110111101111110,FNVFPDXSQFENPC-LBPRGKRZSA-N
O[C@H](CCl)C1=CC=C(C=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,606D870EAD912A3C_8031A5C7429C6DED_6041_UN,8.569147,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101000011011010101001100000010000001011101100110111110111001011011011110111101111110,UVTCTLIYDMDPPR-HBGVWJBISA-N
C(C1CC(C1)C2CCC2)=CC5=CC3=C([N](N=C3C)C4=CC=CC=C4)N=C5Cl,69EE31A6788145D4_1D699CCBB56D0A90_7019_UN,8.216434,00000000000100000000000000000000000000100000000000001000000000100100000000010101100100010000001010110101010100000000001011101100110001110100001011011010000010101111010,YELSDTFDCXLYRN-UHFFFAOYSA-N
CC1=CC(=C(C=C1)F)NCC2(CCSC2)N3CCOCC3,B41660732CF3122A_18FBE0B5FBAE1CF0_7022_UN,8.124595,00000000000000000000000000000000000010000010000000000000010000100010000000010001001101111011000110101000000101011000001011100000110011110110001011011011010111101111110,WJWFZIUKSUXLNS-UHFFFAOYSA-N
FC2=C1C=C[NH]C1=CC=C2NCC4CC3(CCN3C)C4,93E54E011888DCEB_5008422D363FF2D6_6041_UN,7.7465115,00000000100100000000000000000000000000000010000000000000000000000110000000010000001101110010010010001100010100011001101011100100110101110110001010011011010110101111010,YVOMDWWHZXYJSS-UHFFFAOYSA-N
FC1=CC=C(C=C1)CC2=NN=C([NH]2)NC4C[C@H]3CCC[C@H](N3C)C4,FC4320611028D4BE_A5696D1D72E28956_6041_UN,7.956966,00000000000000000000000001000000000000100011000000001000000000000100000000010101100101010001011010100100111110010000101011101100110101110100001001011001000110101111010,JMOPAFKSQOCNNM-MQVJKMGUSA-N
N2C6CNC1=C(C(=CC=C1)C24C3=C(C=C(Br)C=C3)N(C4=O)CC5=CC=CC=C5)C6,8B9EF68E5AC19614_E668F7A31429F0BA_2238_DP,8.18611,00000000000000000000000000000000000000000000001000000010000000000010000000010001101101010011100110101100110100111000010011100101100100110110001111001011011110100111110,PAHWRLUPHYSCPO-UHFFFAOYSA-N
CC4=CC1=C(C=C(C=C1C)NCC2CCCC(O2)C3CC3)[NH]4,832CDB949B77D0B8_6E8994E9E9A741C1_6041_UN,7.627804,00000000000000000000001000000000000000000000000000000100010000100100000000000000101100000011000110101100010000000000001011000100110111010100001001010101110111101111110,UEYKCOAFYCOQGC-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC3CCN(C)C34CCCNC4,9A7B7B8CD34D9683_612C4388E9D05545_6041_DP,8.101854,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001011011111010010101111010,BXWQEONZTJNPGP-UHFFFAOYSA-N
CC1=C(C=C(C=C1)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)CC#N,135C3CA6B3F8E596_F52308C9B5EE975A_6041_DP,8.121377,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000101001000100110101110110001011010011010110101111010,WIZTWOGVJOIYQP-YLJYHZDGSA-N
CC1=C(C=CC(=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)F,22DD0C43A0A4A8B7_47017F56B244F145_6041_UN,7.76073,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011111010110101111010,JITSNWAMVKLZTH-QRWLVFNGSA-N
CC1=C(C=CC(=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)Cl,8B24312D168A03BD_DE0F604728B460F0_7022_UN,7.760729,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101001000100010000001011101100110001110110001011011111010110101111010,VKWOSLUSUBLNRT-QRWLVFNGSA-N
FC1=CC5=C(C(=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)N=CC=C5,C13A8FD75FF10737_460E669EE95C9392_6041_UN,8.437228,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,CAMWLBKPYNEOAR-ZHRRBRCNSA-N
FC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCCC3)C[C@H]5[C@H]4CNC[C@H]4C5,F6680388AED3088D_FB7E0BDB26E4A6D1_6034_UN,8.769287,00000000000100000001000000000000000000100010000000000000000000100100000000010101001101110011000010101000110100010000001011100100110100100110001011011011010110100111010,SWZXIWASBCIYNN-NJFSIMARSA-N
FC1=C(C=C(C(=C1)NCC2C(CCNC2)(C)C)C#N)F,DD91DA7E738F72CF_6CC5BC9026E19425_6041_DP,8.488294,00000000000000000000000000000000000000000110000000000100000000000010000000100000101000110011000000101000100100011001101001000000110101110110001011010111010110101111010,LPHOUPQWSBLNPF-UHFFFAOYSA-N
C[N]1N=CC(=C1)C2=CC(=CC=C2)NC34CCC(CC3)(F)CC4,A30C93C2021572A0_991A1D557656AD55_6041_UN,7.8412266,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010010011010000000110100011000001011101100110001110100001001011001000010101111010,JWIJKHAQQKQKES-UHFFFAOYSA-N
N1CC2CCC1CN2C3=CC=C(C=C3)N[C@H]4C5=C(OC(C)(C4)C)C=CC(=C5)F,0EE410C402DE1446_E3672679EEE4A7BB_6041_DP,7.8816996,00000000000000000000000000000000000000000010000000000000010000100010000000110001001001010011000001101100110100011101001011100100110111110110001011011101110011101111110,SYYUJDAIEDNENO-CNBHCMJISA-N
FC1=CC2=C(C=C1)C=NC(=C2)NC3CCN(C)C34CCCNC4,0B4B5974A59A8DA6_2DD7C53D0387B3BC_6041_DP,8.432851,00000000000000000000000000000000000000100010000000000100000000000110000000010101101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,ILNMXPSTSLBEET-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NC3CN(CC2=CC=CC=C2)C4(C3)CCOCC4,87CC413542547EC4_5A6F8A8988C1B40B_6041_UN,7.862651,00000000000000000000100000000010000010000000000000000000010000000010000000110001110101101001010011101000110001011000001011100100110011010110011011011111010111101111110,WUXJWXANIHPDRT-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C(=O)CC2)NC3=CC=C(CSC)C=C3,00035BE2987326C2_16A5A9FD5419D31D_6041_UN,8.899897,00000000000000000000000000000000000000000000000000000000000000000000000000000000000000101001010010000100010000000001001000000101000011010000000111010001111110101111110,UBVYDOAKNLKZGC-UHFFFAOYSA-N
CN(CC1CCNC1)CC2=NC=C(N=C2)NC3CC(OCC3)C4=CC=C(C=C4)F,B27F48CC064EBA3E_A0D81C6D3E8A4FD4_6041_DP,8.034723,00000000000000000000000000000000000000100010000000000000010000100100000000000101101101110011010011101000100111010001001011100100110111110110001001011001110111101111110,QHBSWURAMLKKLM-UHFFFAOYSA-N
N1CC2CCC1CN2C3=CC=C(C=C3)NC5=CC(=C(C4=CC=N[N]4C)C=C5)F,2B02E7B02E667F1A_66977B773F13E50F_6041_DP,7.940118,00000000000000000000000000000000000000000010000000001000000000100100000000010001101101010011011010101000110100010000001011101100110101110110001011011011010010101111010,ZPETUICKSLXSSB-UHFFFAOYSA-N
N1CC2CCC1CN2C3=NC(=CN=C3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,F63C1E1E6140EA5D_879B97C732824D41_6041_DP,8.336711,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000110110010001101011100100110101110110001011011011010010101111010,NYUDFUOZUZLJLR-AOTIDICTSA-N
FC1=C(C=CC(=C1)CC#N)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F,1890C4640D40729A_BDBC5682DD20E5EF_6041_DP,7.293033,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,AOLGANAOQRCHSG-VQIMIIECSA-N
N(C2=C1OCCC(C1=CC=C2)=O)[S](C4=CC(=C3[NH]C=CC3=C4)CC)(=O)=O,47A93D1C14E0235F_2676998BD98C97C0_6029_UN,8.273835,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100001111001110100110011001001110011011001101001111011100101111111001111111111111110,BALXBDWRJIRDTL-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4(CCCC4)C5=C(C(=CC=C5)F)F,BF9409D6F01FE6D5_32B9E2EF2B674E81_6041_DP,8.232195,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010010101111010,VGXFLXNKIRQNQS-RAKKMVLPSA-N
CC1=C(C=C(C(=C1)C2OCCO2)C)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,FB0186740EE9F7F0_3EB364C6A9A953D2_6041_UN,7.637404,00000000000000000000000000000000000000000010000000000000010000100000000010000000001100010011000011001000000111000000001010010100110011110110000011110111110111111111110,BWYOKFMCIZVIMU-UWJYYQICSA-N
NCC3(COC1=CC(=C(C)C=C1C2CNCC2)Cl)CC=CC3,9C35037687F66FF8_3F88DBDF1CE5D6AF_6035_UN,8.570895,00000000000000000000000000000000000000000000000000000000000000100010000000000000001110110011000011011001100101011100001001000011010100100110001110010011110101101111110,ICCFFHRRRFGYKO-UHFFFAOYSA-N
C[N]1N=C(C=C1F)NC(CCC2=CC=CC=C2)C35CC4CC(CC(C3)C4)C5,64A58A9751910A1B_D3972CEBE7F4224C_6041_UN,7.800006,00000000000000000000000000000000000000100010000000001000000000000110000000010101100100010010011010000100110100011000001011101100110001110100001011011011000110101111010,MHLAFUZEJNLJCT-UHFFFAOYSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(=O)CC4=C(C=NC=C4)F,D8613686577606D1_02A59F0D78F15339_6038_UN,7.926657,00000000000000000000000000000000000000000010000000000000010000000100000000000000000100010001100011100100110100110000011011000100000011110100001011010011101111110111110,FOEGAOKIMNRASR-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CC3)C4=C(C=CC=N4)F,2E67C24EEB3E6C76_2BE897E980C8A2E1_6041_UN,8.100259,00000000000000000000001000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100010001110110001011011011010110101111010,AWAMJTWTNVAYLE-INIZCTEOSA-N
N3CCCCC(C=CC2=CC1=CC=CC(=C1O2)CC)C3,480BD8844AEF7395_EDC378ED39BE0F0A_7019_DP,8.36637,00000000000000000001000000000000000000000000000000000000010000000000000000000000001100100011000010011100110000010010001011000100110000000110000000010001110100101111110,GLEUACJULRSQAJ-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NCC23CC(C)(CC2)CO3)C4CC4,4F92035660B98306_B2D8D36BBAC41BFB_6041_UN,7.137872,00000000000000000000001000000000000000000010000000000000010000100010000000000000001100010011000110101000010111001001101000000000110011110110000011010011110111101111110,DLFHEXCLMXDIIP-UHFFFAOYSA-N
C1(=CC2=C(N=C1)CCC2)NC3=CC=C(CO[Si](C)(C)C)C=C3,5D968FD61A7BE4B4_AB2D6BEC47EC721E_6041_UN,8.075241,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100001010010100110010001011000101001001110010001010100011011011101010111101111110,CAOZNXVESAUIPG-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC2=NC=CN2C[C@]34CNC[C@H]3CN(C)CC4,5C1A3BBC630C5902_8451568CA91E8E20_6034_UN,8.05397,00000000000000000000000000000000000000100000000000000000000000000110000000010101101101110011010010101101010110011001101011100100110101110110001011011111010110101111010,BTTPLDZQEGWNNP-JXFKEZNVSA-N
O[C@H](CBr)C1=C(C=CC=C1)NCCC3CCN(C2CCN(C)CC2)CC3,0C0F3E719650FB56_80454659F699A1FF_6041_UN,8.137001,00000000000000000000000000000000000000000000001000000100000000100000000000010000101001100001010001101000100000010001101011100000110111110111001011011011110111101111110,REHWSMYELIYSJP-OAQYLSRUSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2(CCNC2)CC=C)F)CC3,84AB228899B687E5_4474B843347A8DF2_6041_DP,8.49833,00000000000000000001000000000000001000000010000000000110000000000010000000010001101101110011010010011000100110011001101011100000110101110110001010011011010110101111010,AQQXGORTRRVOMP-UHFFFAOYSA-N
N(CC1C3CC2CC(CC1C2)C3)[S](C5=CC=C4[NH]C=CC4=C5F)(=O)=O,8CE2F9AF3BCAF230_0664220E18E8DE42_6029_UN,7.7777033,00000000000000000000000000000000110000000010000000010001001111001101010001000000011100011001001010001110011100001000010001001100111100101100001011001011010110110111110,MVAKBPFHBQPATN-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC34CC(C3)OC4,6A2F297271097C05_5E79D085CC7FBAB4_6041_UN,7.711096,00000000000100000000000000000000000000100010000000001000010000100110000000010101101100010010011011101000010101001000000011101100110011110110001010001011110111101111110,LXSIPMJNRGNVJN-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CC3CCC2N(C)C3)Cl)C4CC4,CFA0C4EE23222AF3_2397B050CE6E427D_7022_UN,7.7861586,00000000000000000000001000000000000000000000000000000000000000100000000000010001000001110011010000101001110110010001101001100000110001110100001011011111010010101111010,XBXQUAIQIUJEDB-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC34CCC(CC3)O4,41A4CD7F1C7F8555_9B77585DA22C1D9A_6041_UN,8.005357,00000000000000000000000000000000000000000010000000001000010000000110000000010000101100010011011110001100010100001000001011101100110011110100001001011001110111101111110,KXZZKYKAQBTHNE-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)SC=C2)NC3=CC=CC(=C3)CC4CCCN(C)C4,9893E71DCC083BF1_5A81685893061562_6041_UN,7.8075304,00000000000000000000000000000000000010000010000000000000000000000000000000010000010101111001010010101100010110010001101011100100110001110110001011011011010110101111010,BIVJOYAUWNOINQ-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NCC2N(C)CC3(CC2)CCC3)C=CO4,81417408595ED8E6_2F0AF4A3CE43BE31_6041_UN,7.5612764,00000000000100000000000000000000000000000010000000000000010000000010000000010001001101110011010011101100010110011001101011100100110001110110001001011011110110101111110,MSLDPFMYWSVRLK-UHFFFAOYSA-N
CC1=C(C3=C(N1CC(CC)NCC2=C(C=C(C=C2)Cl)Cl)C=CC=C3)C4=CCNCC4,5F377D147AC2E926_C730913AEFDB32E1_6034_UN,8.456014,00000000000000000000000000000000000000000000000000100000000000100100000000011001001101110001000010111101110110010010101011100100110100100110001011011111010110101111010,DMLRQKCTJILCAN-UHFFFAOYSA-N
CC1=CC(=C(C=C1)NCCC3CCN(C2CCN(C)CC2)CC3)C,49CF1E72F38346C0_35F00DB2043BB5F1_6041_UN,7.7912836,00000000000000000000000000000000000000000000000000000000000000100000000000010000101001100001010000101000100010010001101011100000110001010110011011011111010110101111010,WLLVEVZWVYRAGE-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N=CC(=N2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,4230282D7632E78F_2A6B25242221EF8A_6041_UN,8.336225,00000000000000000000001000000000000000100010000000001000000000100100000000010101101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,QQBGMYTXRFVKNW-SZNDQCEHSA-N
FC1=C(C=CC(=C1)C2OCCO2)NCC5=CC3=C([N](C)C(=N3)C4CC4)C=C5,7B37BEEA75829C04_BA96F46BA69EEBC4_6041_UN,7.7518473,00000000000000000000001000000000000000100010000000000000010000100100000010010101001101010000010010001100010111000000001011110100000011110110001011011011010111111111110,ORWPJCKWSYLTNS-UHFFFAOYSA-N
CC1=C(C(C4=C(N1CC2(CNCCC2)C3=CC=CC=C3)C(=CC=C4F)F)=O)C,F10EA7A006F68720_F2F9F91378BF5E54_6034_UN,8.78689,00000000000000000000000000000000000000000010000000000000000000100110000000010000101001110011000001101100110110011100101011100101110000100110001111011111111110101111110,GPHGDXZGSRHGCK-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NCC34CCC(C)(CC3)CO4,E431F6C946957098_7469DE118137A705_7022_UN,7.2249265,00000000000000000000001000000000000000000000000000000000010000100010000000000000001000010011000100101001010101001001101000000000110011110110000011010011110111101111110,AVNVOVMYMMWYHT-UHFFFAOYSA-N
CC1=C(N=C(N1CC2NCCC3=C2C=C(C=C3)Br)C4CCCN4)C5=CC=CC=C5,9EF72B3ABB9E858D_2D47606505C426D7_6034_UN,8.510857,00000000000000000000000000000000000000100000001000000000000000100100000000010101001101010011000010101100110100010000101011100100110100100110001011011011010110101111010,JYGKKONQLBPTMF-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NCC34CCC(C)(CC3)CO4,C50BDCD70BB5AE76_80A92C1CC97406BA_7022_UN,7.2249255,00000000000000000000001000000000000000000010000000000000010000100010000000000000001000010011000100101000010101001001101000000000110011110110000011010011110111101111110,PRFLZEKFWNDJDO-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCC2(CCC2)C3=C(C=NC=C3)F,2A91759BBD848AE5_9BF0D661EF1AC825_6041_UN,8.076812,00000000000100000000100000000010000010000010000000000000000000100110000000100000011100111011010010101000000100001000001011000100110001110100011010011111010110101111010,PNZHVIKARODWQB-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)NCC2(COCCNC2)F)C#N,B4CC9AE6D42F3829_A7E1E80742E4CFF3_6041_DP,8.334084,00000000000000000001000000000000000000000110000000000100010000000010000000000000101000110011000101001000100101011000001011000000110111110110001010010011010111101111110,LHAKANJKTTYODM-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCCC34CCNCC4,6C8E8334A0C076BE_60D57AA4DFA8E5CE_6041_DP,7.6848545,00000000000000000000000000000000000000100010000000000000000000000110000000000100001000110011000010101100110110011000001011000100110101110110001011010111010110101111010,ZJMCVHHEWFNBDL-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5)C6CCNCC6,A45A7BA8F221F6F2_4640D06F529F005F_6034_UN,8.823962,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101110001010010101100110100010000001011100100110001100110001011011011010110101111010,DOWMEVIXEJEOIW-BCHFMIIMSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC4(C3CCNCC3)CCOCC4,0454D93C2F641721_AE63AF625FFF0D2D_6041_DP,8.365412,00000000000000000000000001000000000000000010000000000000010000100110000000010101001101110011010010101100111111011000001011100100110111110110001011011011010111101111110,GXJQTPDZIHAZIH-UHFFFAOYSA-N
C[Si](C)(C)C1=NC(=CS1)NCC3CN(CC2=CC=CC=C2)CC34CCC4,CC301B06538A771E_B8D386BBC44A142B_6041_UN,8.124801,00000000000100000000100000000010000010100000000100000000000000000110000000110100111101101011010010001000011000001000001011100100110001010110011000011101010110101111010,OUTDAJHPQXKPJV-UHFFFAOYSA-N
O=[N](=O)C2=C1C=C(N=CC1=CC=C2)NC4=C3OCCCC3=CC(=C4)F,787D2DC000D02B03_8B3008F2A4D0EC3B_6041_UN,8.142017,00000000000000000000000010000000000000100010000001000000110000010100001100000100000000010001001100100110010101000100001111101100101011110100001011111001110011110111110,YKGGVIDXRQGYID-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C(CCCC2)N3CCCC3)F)[N]4C=CC=C4,BE59702025FD2A4A_F38E7B726B1ADC60_6041_UN,7.9286647,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010001000000100010000001011100100110001110110001011011011010110101111010,MFWIQVOXEAAXEI-UHFFFAOYSA-N
FC2=C1C=CC=CC1=CC(=N2)NCC3CCCN(C)C3C4=CC=CS4,030FD4635ACA425F_3B049B42E6E8F439_6041_UN,8.428468,00000000000000000000000000000000000010100010000000000000000000100100000000010100111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,BELUQOITEGFUFU-UHFFFAOYSA-N
FC2=C1C=CC=C(C1=CC=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,E10AAFEF16F5E9A5_E7E97E2ED3CA7B38_6041_UN,8.4696865,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,UBCKVBRMXXMVTC-MWTRTKDXSA-N
O(C3CCN(CC1=CC=CC=C1)C2(CCC2)C3)CCC4COC(C)(C)O4,A824C085CBF782D9_06611859C020ECCE_6039_UN,7.9974585,00000000000100000000000000000000000000000000000000000000010000000010000010110000000101100100000011101000010011011000101011110011110010000110000101111100110111111111110,VYTFXYBCHZVAIW-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2CCCC2)NC3=C[N](C[Si](C)(C)C)N=C3,7A23DFD53AA80065_E270717142E46220_6041_UN,7.558003,00000000000000000000100000001010000000000000000000001000000000100100000000110001100100100001011010001000000000011001001011101100010001010100011000011101010110101111010,DVKHCHRYIHPFQA-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCC3)C4CC4,CBFF36A340D97045_905BDEBE407C9AE7_6041_UN,8.270577,00000000000100000000001000000000000000000010000000001000000000100110000000010000101100010011011010001100010100001000001011101100110001110100001000011001010110101111010,VWQOCCADOAMFIG-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)N[CH]2CC[C]3(CC2)C[CH2]C3)F,BFBC238FB6292FEF_81C1D676527429D1_6041_UN,7.6688194,00000000000100000000000000000000000000000010000000000000000000000010000000100000000001110011010000001000110100011001001000100000110001110000001011011111010110101111010,MREXYAAVWDANMC-UHFFFAOYSA-N
N(C1=CC=C(C=C1)N2CC3CCC(C2)O3)C(C4C5=C(CCN4)C(=C(C=C5)F)F)=O,CBF882552BB1EB30_394EA9CFE1A8DB6B_6038_DP,7.7660747,00000000000000000001000000000000000000000010000000000010010000100000000000010001001101110001100110101100110100110000011011100100110111110110001011011011111011110111110,OBTBJXKSITWSQE-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC4OC3CCCC3C4,BED9A0A040FA8623_7B124845677A1CD8_6041_UN,7.985235,00000000000000000000000000000000000000100000000000000000010000000100000000000100001100000010000110101100010010000000001011000100110011010100011011010111110111101111110,JOHSZCPVYQUVRR-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C(F)F)Cl)NC[C@H]3[C@H](C2=NC=C[N]2C)OCC3,B6CD8309151CDA5B_04D9557DA87ED6FB_7022_UN,8.407297,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101010011010111001001000101000000001011100100110011110110001010011011110111101111110,XOKJTAUNOCQNRN-SMDDNHRTSA-N
NCCC1=CN(C2=C1C(=CC(=C2)F)F)CC3(CCNCC3)NCC4CC4,66FBCDAF6FD0A787_8DB5B8A0FD089556_6034_UN,7.911336,00000000000000000000001000000000000000000010000000000100000000000110000000010001101111110011000010101100110100011000001011100100110101100110001001011001010110100111010,GHQYTCZUIDEDLM-UHFFFAOYSA-N
NCCC1=C[N](C2=C1C(=CC(=C2)F)F)CC3(CCNCC3)NCC4CC4,66FBCDAF6FD0A787_7B8A95FB2285228D_6034_DP,7.911331,00000000000000000000001000000000000000000010000000000100000000000110000000010001101111110011000010101100110100011000001011100100110101100110001001011001010110100111010,GHQYTCZUIDEDLM-UHFFFAOYSA-N
NCCC1=CN(C2=C1C(=CC(=C2)Cl)Cl)CC3(CCNCC3)NCC4CC4,CADF515DB8D257A2_8871A346A43F4BF2_6034_UN,7.911327,00000000000000000000001000000000000000000000000000000100000000000110000000010001101111110011000010101101110100011000001011100100110101100110001001011001010110100111010,HHOYIWNHZSWFLY-UHFFFAOYSA-N
NCCC1=C[N](C2=C1C(=CC(=C2)Cl)Cl)CC3(CCNCC3)NCC4CC4,CADF515DB8D257A2_7E4E8E1D7BB2FC29_6034_DP,7.9113216,00000000000000000000001000000000000000000000000000000100000000000110000000010001101111110011000010101101110100011000001011100100110101100110001001011001010110100111010,HHOYIWNHZSWFLY-UHFFFAOYSA-N
C1CC(CCN1)C2=CN(C3=C2C=CC=N3)CCC4CCN(C)C4,942AE5410ECA9C6A_862973601A61BCB5_6034_UN,8.043913,00000000000000000000000000000000000000100000000000000000000000100100000000010100001101100001010010101100110010010001101011100100110000000110001001011001010110101111010,IHEFQZRDNFSMSD-UHFFFAOYSA-N
NCCC(OC1=C2C(=CC=C1)CNCC2)C3=CC=C(C=C3)Br,D0A6EC2EDA3012A2_279146898CD149A9_6035_UN,8.116473,00000000000000000000000000000000000000000000001000000000000000000000000000000000001010110001000001101100110100010100001001000111110110100110001111010001110101100111110,MEGVVWIFMDFRII-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CC[C@]23C[C@H]2CCC3)C=CC(=C4)Br)C5,732A222921C1030F_F33EE01AD4552915_6034_UN,7.582439,00000000000000000000001000000000000000000000001000000000000000000110000000110000000101010000000010001100010100011001101001100100110000100100000011011100010110101111010,IVFGNSSMYLYLHR-IVZQSRNASA-N
C[Si](C)(C)C1=CC=C(C=C1)NC2=CC=NC(=N2)C3CCCN3,CC67081FA922E203_6233109B3D6E19AD_7022_DP,8.554802,00000000000000000000100000000010000000100000000000000000000000100100000000100101101100100011010010101000100000011000001011000100010101010100011001011101010010101111010,NOSZBUKJEAIHDL-UHFFFAOYSA-N
CC3=C2N=C1CCCCC1=C(C2=CC=C3)NC4=CN=C([Si](C)(C)C)C=C4,ED3661409FD66B06_31995DD26737AF0F_6041_UN,7.71972,00000000000000000000100000000010000000000000000000000000000000000100000000100001100000100011010000100100010000011000001011000100110001010100011011011101000010101111010,QPUGUFTZLYLYNJ-UHFFFAOYSA-N
C2(=C1OC=CC1=CC=C2F)NCC3CNCC(C3)(C)C,D6C10549C6DA3CDD_A176946999EDF974_7022_DP,7.761648,00000000000000000000000000000000000000000010000000000100010000000010000000100000101100110010000110101100010110001001000011000100100101110110001011000111110110101111110,SGMUFENZEYULPY-UHFFFAOYSA-N
CC1=C[N](N=C1)CC2=C(C=C(C=C2)NCC3CNCC(O3)(C)C)F,DCBA93C728C83BF1_9F709E2768181E7E_6041_DP,8.357335,00000000000000000000000000000000000000000010000000001100010000000110000000110000101100110010001110101000000110011001000011101100100111110110011011001111110111101111110,FVFWWOJKSYYDFD-UHFFFAOYSA-N
C[N]1C=NC(=C1)C2=CC=C(C=C2)NC34CCC(CC3)(F)CC4,804B5D08A913E962_E0FAED1699E5B837_6041_UN,7.9201818,00000000000000000000000000000000000000000010000000000000000000100110000000010101000101010010010010000000110100011000001011100100110001110100001001011001000010101111010,BKLPDQIKCPAXAM-UHFFFAOYSA-N
COC1=C(C=C(C=C1)C2=CC=NC=C2)N[C@H]3[C@H]4CC[C@@H]([C@@H]3C(F)(F)F)O4,2F09FAE6A9CF5474_330D213FDBB83B06_7022_UN,8.768215,00000000000000000000000000000000000000000010000000000000010000100100000000000000000100000011010111100000011100001100001011000111000011110100001111010011100011111111110,DKHCKZCQHSKKSC-MHORFTMASA-N
FC1=C(C2=C(C=C1)CCC2)NC[C@H]4[C@H](C3=NC=C[N]3C)OCCC4,199A58CEF79C8072_0DBD09BD8424CC24_6041_UN,7.3950977,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101010011010111101100010101000000001011100100110011110110001011011011110111101111110,ZCMYRYPTZYUCNO-KBXCAEBGSA-N
FC2=C1C=NC=CC1=CC(=C2)NCC3CCCCN(C)C3,FE868DB5235233EB_1F6B0095011F3D96_6041_UN,8.383497,00000000000000000001000000000000000000000010000000000000000000000100000000010000101001110011010000101100010110010001101011100100110001110110001001011001010110101111010,RCKYIEOBWMPPIT-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)NCC2CNCC(O2)(C)C)C#N,7DB1F9CB99CED63D_A9D1F2E87653532B_6041_DP,7.9566107,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110011011000111110111101111110,LSNMGDTYTNYRMS-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2COCCN2)F)CC3,62A0550BE9206110_0D261FC99EDE809B_6041_DP,7.2493396,00000000000000000001000000000000000000000010000000000010010000000000000000010001101001110011010101101000100111010001101011100000110111110110001011011011010111101111110,BLKWIFZHUGUOTP-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCCC3CCCC(C)C3,2739C7B186C17313_7BA39B1C07FD4673_6041_UN,8.0604925,00000000000000000000000000000000000000100000000000000000000000000100000000000100001000000001000000101100110010010001101001000100110001010100011011010111010110101111010,DRXJXOUHERCFNR-UHFFFAOYSA-N
FC2=C(C=C1OC=CC1=C2)NCCC4CCN(C3CCN(C)CC3)CC4,7980665F51338EA8_3531B601C50B9B45_6041_UN,7.605805,00000000000000000000000000000000000000000010000000000000010000100000000000010000101101110001010011101100110100010001101011100100110001110110001011011011110110101111110,SXXJZGZFGLUBBI-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)C=CC3=C2CCCCC2=CC=N3,6BEE7BD313B358AD_DF9C90510008B290_7019_UN,8.122901,00000000000000000000100000000010000000000000000000000000000000000100000000100000000000100000010000110100010000001000001001000100110000000100010011011100000010001111010,IJGFUZZVZWJKKS-UHFFFAOYSA-N
CC2=CC1=C(C(=CC(=C1)Cl)Cl)N2CC(CCC)N3CCNCC3,3E3C5DD9B6F0FA5E_C7CB57B77FC3F807_6034_UN,8.499401,00000000000000000000000000000000000000000000000000000000000000000100000000010001001101110001000010101101110110010011101011100100110000100110001011011111010110101111010,PZGZRRDYYGNZKM-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3C2CCC(N2)C3)F)CC4,8C6A8F89CA5D897B_7E24D326F638A0F3_6041_DP,7.6431212,00000000000000000001000000000000000000000010000000000100000000000000000000010001101101110011010010001000110110010001101011100000110101110110001011011011010110101111010,YXCJUFWNTLZMRQ-UHFFFAOYSA-N
CC(C)C1=CC2=C(C=C1)N(C(=C2)C)C[C@H]3[C@@H](CNC3)C4=CC=C(C=C4)Cl,50F8E45F69B64992_E13FE8AE73837988_6034_UN,8.5316105,00000000000000000000000000000000000000000000000000000000000000100100000000110000101101110011000010001101010100000000100011100100110000100110011011001111010110101111010,SGWCUHMJYICEHQ-UNMCSNQZSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CC(CCC2)F)F,62EC92421D6873EB_4DC8E4242337DE0B_7022_UN,7.7705774,00000000000000000000000000000000000000000010000000000000000000000000000000100000001001110011010000001000000100000001001000100000110001110010001011011111010110101111010,HSMQNLBLZBCDBB-UHFFFAOYSA-N
CC(NC(=O)CCC1CC2CCC1C2)CC3=C[NH]C4=C3C=C(C(=C4)F)F,F15C8583CCFA5B15_51545BAB1679C586_6038_UN,8.265933,00000000000000000000000000000000000000000010000000000000000000000100000000000000000100010011100010000100110110110001011001000100110110100100001011010011001110101111110,YPGKNDHUWFVUNA-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C(C)(C)C3=CC(=CC=C3)F)=O,5D4F6483F158BDC4_5EFD53592BE02BAD_6038_UN,8.27964,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010001100010001000110110111000011000000000110010100100000001010101111111111111110,HHEOHTSVWAQLJS-UHFFFAOYSA-N
CC2=NC1=C(C=CC=C1F)N2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,F2FAE490625DCA20_1050E59D88FA4138_6034_UN,7.593722,00000000000100000000000000000000000000100010000000000000000000000110000000110101000101010000000010001100010110011000101011100100110000100100011011011110010110101111010,LAGLAESCADZTCN-RRFJBIMHSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NCC3CCCC(CC)CC3,574E7E042BCD2E9A_4A3DC8ACB2861065_6041_UN,7.959978,00000000000000000001000000000000000000000010000000000000000000000100000000000000101000010011000000101100010110000010101001000100110001110100001011010111010110101111010,DVVRCUVXOVSRAY-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2CCCC23CNC3)F,9F36E3BCDED8FA95_5FDA4868C2E0E40B_7022_DP,7.7009625,00000000100100000000000000000000000000000010000000000100000000000010000000100000101001110011010010001000110100011001001001100000110101110110001010011111010110101111010,NAJZBZADJTVVSU-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)CCOC2)[S](C4=C3[NH]C=CC3=CC=C4)(=O)=O,9A6C715EEF34AF54_BF918A106169D095_6029_UN,8.910803,00000000000000000000000000000000110000000000000000010101011111001101010001000000110100101001001011100110011001001000011011001100111111011110001011111001010011110111110,OFPUFGHPJNDTCR-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=C[NH]2)NCC(C)(C)C3CCCCC3,C2FE8E35CDC7C9FC_549C618526B26773_6041_UN,7.641631,00000000000000000000000000000000000000000000000000000010000000000110000000100001001100000001000010001100010010001001101001000100110101010100011011010111010110101111010,BRBIODIVXAOOGF-UHFFFAOYSA-N
CC[C@@H](OC1=C(C=C(C=C1)CN2CCNCC2)Cl)C3CCOC3,20805814FF8B001E_3268F183B1918A9C_6035_UN,8.484373,00000000000000000000000000000000000000000000000000000000010000000000000000010001001101110101000010101001100111010110001011100011110010100110001111011011110101111111110,HDULJYWSOXPBDH-OMOCHNIRSA-N
CC1=C(C=C(C(=C1)C2OCCO2)C)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,779AF37A4F11955B_FB32EDCAE686CD7F_6041_UN,7.9507422,00000000000000000000001000000000000000000010000000000000010000100000000010000000001100010011000010001000000111000000001010010100010011110110000011010111010111111111110,BOKWWPGFTCTOLX-GOEBONIOSA-N
CN(C)CC1=C(C=C(C=C1)NCC3CCN(CCN2CCOCC2)C3)F,CCDE4EA8CF440C6F_06AD526CD4C1182A_7022_UN,7.955848,00000000000000000000000000000000000000000010000000000000010000000000000000110001101101110011010110101000000101010001001011100000110011110110001011011111010111101111110,IJPOKYCWKUYQCF-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC3CCOC2(CCCC2)C3)F,8ED5F796B4C000E5_2842F81235CC53A0_7022_UN,7.5221014,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110011010011101000110101011001001000100000110011110110001011011111110111101111110,FVHXWNFGEYPNLZ-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)N[C@H]2C4=C(OC3(C2)CCC3)C=CC(=C4)F,A4AF1A820979C673_77FD7E7C1AA15794_6041_UN,7.4541264,00000000000100000000100000000010000010000010000000000000010000000010000000100000010100111001010011100100110100011100001010000100110011110100010011011111100011101111110,BPMRXHUSBYMIKP-QGZVFWFLSA-N
CC1=C(C=C(C(=C1)NCC3(CC2CC2)CCCC3)Cl)C4CC4,0F259DE8EBE6977D_1EB05B5B2B9F5C17_7022_UN,7.6791754,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010011000010001001000110001000001000000000110001110000000010010011010110101111010,JDSWFQWFPIBWBI-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CC(=N2)NC(CC)C3CCCC3,C9EC07D471CA8591_CDF51199EE8EAE39_6041_UN,8.157731,00000000000000000000000000000000000000100010000000000000000000000100000000000100000000010011000010100100110110010010001001000100110001110100001001010001000110101111010,CPZSVLUMSYSOCZ-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3CCCC(C)C3,8BC8C1E06C1B331E_647CC58FE6F5983A_6041_UN,8.303554,00000000000000000000000000000000000000000010000000000000000000000100000000000001001000010011000000101100010110000001101001000100110001110100001011010111010110101111010,UKDNVODMNISGMG-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)N[C@H]4[C@@H](C4)C5=CC(=C(C=C5)F)F,AECA360C1B122FBB_7ED1FCEB56C4719D_6041_DP,8.5270195,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000110110010000000011100100110101110110001011001011010010101111010,HOSGTMNIKMUJDL-SHEPXDLSSA-N
CC1=C(C=C(C(=C1)NCC23CCC2CCN3)Cl)C4CC4,D9583D23425AABA6_2FD089ACE6DB8E78_7022_DP,8.19787,00000000000100000001001000000000000000000000000000000010000000100010000000000001001100010011000010001001110110011000001001000000110101110110001010010011010110101111010,DOEJURDWJUWSQP-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2CNCC23CCOCC3)F,B734C650FCB169AD_CEF5BA80494E39E3_6041_DP,7.3033133,00000000000000000000000000000000000000000010000000000110010000000010000000100001101101110011010010101000110101011001001011100000110111110110001011011111010111101111110,NUFWDUXXAMDBJW-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)C[C@@H]3CNCC(O3)(C)C)Cl,A67A3D52DDA9D3A4_68F14A89548CBA9D_6034_DP,8.709723,00000000000000000000000000000000000010000000000100000000010000000110000000110110111101111011000110101001001110001001000111100100100111110110011011001111110111101111110,IZAGHJKZTWYBNN-AWEZNQCLSA-N
CC1=C(C=C(C(=C1)N[C@H]2[C@@]3(CCC2)OCCC3)Cl)C4CC4,9A0EEBC73CDEC24B_5B6744E392B08CCB_7022_UN,8.067423,00000000000000000000001000000000000000000000000000000000010000100010000000000000000100010011000110000001110111011000001000000000110011110100000010010011110011101111110,UQYIWNVSANDHAX-MSOLQXFVSA-N
FC1=CC4=C(C(=C1)C=C[C@@H]2CCCO[C@H]2C3=NC=C[N]3C)OC(OC4)C5=CC=CC=C5,202BE781A84DE703_1ABEB66B020879E2_7019_UN,8.19246,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010100010110110100010101000100001011110100100010100110001011111010110011111111110,QNRHFYXDZSWNOI-ACYOWCCNSA-N
CC1(C)COC2=C1C=C(C=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,643C29058F82D737_8DD1D9AC3CB27B79_6041_DP,7.4879746,00000000000000000000000000000000000000000010000000000100010000100010000000100000101100110011000010101100110101011101001011000100110101110110001011010111110111101111110,FSFCWVDMSJKOCD-QFBILLFUSA-N
N2C[C@H]1CN(C[C@H]1C2)C3=NC(=NC=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,F8D9F50F0D42787B_3BB7276F19060270_6041_DP,8.590748,00000000000000000000000001000000000000100010000000000000000000100100000000010101101101110011010010101100111110010001101011100100110101110110001001011011010010101111010,SCWQFYVSTKJMHI-HNAWSFBYSA-N
CN1CCN(CCC1)C2=NC=C(C=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,3DCBBCECBD65074A_1736DC745442E427_6041_DP,7.5041537,00000000000000000001000000000000000000100010000000000100000000100100000000010101101001110011010000101000100110010001101011100100110101110110001001011011010110101111010,XRCAHLRUTPLWRC-SIKLNZKXSA-N
FC1=CC2=C(C=C1)N=CC(=N2)NC4C[C@H]3CCC[C@H](N3C)C4,73DCD4AB6D222BEB_18AD0F5E72820A21_6041_UN,8.563808,00000000000000000000000000000000000000100010000000000000000000000100000000010101100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,AVCQMCLUIJHNGH-AGUYFDCRSA-N
O(C2CCOC1(CCOCC1)C2)CCN3CCN(C)CC3,E4EFDE2B47CAC9AA_12798CCE1EF73898_6039_UN,7.3873057,00000000000000000000000000000000000000000000000000000000010000000010000000010001000001100100010100101000010001011001101011100011110010000110001101111000110101111101110,RGVFBYIBCGLNEN-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCC3=CC(=CN=C3)F,38E2C031A06267D8_E330590C3EC779C9_6038_UN,8.169679,00000000000000000000000000000000000000000010000000000000000000000100000000000000001000010011100000111000110100110000011001000000110010100100001001010001011110100111110,KHPNYKKYUFEPKE-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@@H]3C[C@H]2CC[C@H](N2)C3)Cl)C4CC4,963447979F2DDB61_D621D568008F80BC_7022_DP,7.3034506,00000000000000000001001000000000000000000000000000000100000000100000000000000000100100010011000010100001110110010000001001000000110101110100001011010011000010101111010,PMJWWDCKHQNAAX-BTTYYORXSA-N
FC1=CC=C(C=C1)C2=NN=C(C=C2)NCC[C@@H]3CC[C@H]4C[C@@H]3C4(C)C,FD3FE5E51632F12D_04CFD71BB80982FD_6041_UN,8.249455,00000000000100000000000000000000000000100010000000001000000000100110000000100101001000010001001000101000110110011000101011001100110001110100001001010101010110101111010,SZJDDBXXSIAYAB-ZVZYQTTQSA-N
N3CC[C@@H]([C@H](CNC(=O)C12CCC(F)(CC1)CC2)C3)C4=CC=C(C=C4)F,F123B51BF55FB3A5_F0F88D9CC98DCDA7_6038_DP,7.608267,00000000000000000000000000000000000000000010000000000100000000100010000000000000101000110011100000101000110100111000011001000000110100100110001001010011011110100111110,XDOTZIXCHKFJOE-QVKFIVLNSA-N
CC1=C(C=C(C(=C1)NCC3C2CCC2CN3)Cl)C4CC4,21E9E0A3F43972B0_4FB9E35AC425A908_7022_DP,8.561091,00000000000100000001001000000000000000000000000000000010000000100000000000000001001100010011000010001001110110010000001001000000110101110110001010010011010110101111010,YUPSYJNMKBZWSF-UHFFFAOYSA-N
CC1(C)COC2=C1C=CC(=C2)CC3=C(C4=C(N=C3)C=C(C=C4)Cl)C5COCC5,57FD6E6F40AF8C74_83BE9D286F001046_2201_UN,8.26646,00000000000000000000000000000000000000000000000000000000010000100110000000100000000100110000000010100101010101001101001011000100110010100110000011010110110111011111110,ANASYPZVBRFIPA-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CC=CCC(C)C)C3=CCNCC3)F,F9B89ADF2A3199B1_4B5F9738F032D568_6034_UN,9.2261,00000000000000000000000000000000000000000010000000100000000000100100000000111000001101110001000010111100110100010001001011100100110000100110001011011111010110101111010,PFGJIELQTJBGSK-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2CCCC23CNC3)F,236820B4310D2C20_479429135B82779D_7022_DP,7.481647,00000000100100000000000000000000000000000010000000000100000000000010000000100000101001110011010010001000110100011001001001100000110101110110001010011111010110101111010,FUIUYUOKTDKIKJ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCCCC2C)Cl)C3CC3,87ED71ED709458BE_CA41F9612528BCC2_7022_UN,7.9240437,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010011000000001001000110000001101000000000110001110000000011010111010110101111010,URPHIDHKNXAGBN-UHFFFAOYSA-N
C[N]1N=C(C=C1NCC2=C(C=C(C=C2)C3CC3)F)C4CCCC4,F810C94E036AE8F5_76EDA12A60551B1A_6041_UN,7.9910717,00000000000000000000001000000000000000100010000000001000000000100100000000010101101100010000011010001000000110000000001011101100010001110100001010011011010110101111010,ZFUYSONAYCTRLF-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCCC3CC(C)OCC3,A9AA9407C2FF6BC1_8DFDDC7D730D4E30_6041_UN,7.761896,00000000000000000000000000000000000000100010000000000000010000000100000000000100001000010001000000101100110111010001101011000100110011110110011011010111110111101111110,AKSGMVXERVYFEK-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)N[C@H]2COCC2)F)CC3,7588739341BCF488_63798D8DDD03E13E_6041_UN,7.2766814,00000000000000000001000000000000000000000010000000000000010000000000000000010001100101110011010111001000100111010001101011100000110011110110001010011011010111101111110,DFSSSSMVJQAOCW-MRXNPFEDSA-N
FC1=CC2=C(C=C1)N=CC(=N2)NC3CCN(C)C34CCCNC4,B547BA8A1C2220DD_2317E44CD4923398_6041_DP,8.578693,00000000000000000000000000000000000000100010000000000100000000000110000000010101101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,SEGMWMVXUZSDES-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NC2CCN(C)C23CCCNC3,1E41408810695C49_62561A38225FF426_7022_DP,8.426615,00000000000000000000000000000000000000000010010000000100000000000010000000010001101101110011010010111000110110011001101011100000110101100110001001011001010010101111010,ILVWGRFEBPGAEC-UHFFFAOYSA-N
FC1=CC3=C(C(=C1)NCCC2CCCN(C)C2)OC=C3,0C64C80164C7E2ED_9CD97BF839EFA745_6041_UN,8.021231,00000000000000000000000000000000000000000010000000000000010000000000000000010000001101110001010110101100110110010001101011100100110001110110001001011001110110101111110,PCHGXMWNJAHRJF-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3(CC)CNC3)Cl,CB8FB707C1B1F399_2E16C3B5D2BA54B4_6034_UN,8.221762,00000000100100000000000000000000000010000000000100000000000000000110000000010110111101111011000010001001001100001010100111100100100101110110001010001111010110101111010,SMDCZLXJOQYSCD-UHFFFAOYSA-N
FC1=C(C=CC=C1NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)CC#N,3BDD440E2B4E896A_E9EA6D2B52C91DE6_6041_DP,7.751168,00000000000000000000000000000000000000000110000000000100000000100100000000010101101101110011010010001000000110010000000011100100110101110110001010001011010110101111010,SVWVENFPKFXIER-UONOGXRCSA-N
CC(C)C1=CC(=C(C=C1)NCC2C(CCN2)C3CC3)F,F34BB22C5C9B1D63_90A40EBC9D1FA249_7022_DP,8.4938755,00000000000000000000001000000000000000000010000000000010000000100000000000100001001100010011000010001000100100010000001001000000110101110110001010010111010110101111010,NLWBISBKRBVKGO-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)F)NCC[C@H](C)OC2CCCCO2,E38E20DC480580E3_B6B6718234355C06_6041_UN,7.8921523,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000010000000001101000100111010001101000010011110011110110000111010111110111111111110,NZKGFDZKVLEWTO-SFVWDYPZSA-N
C[N]1C(=CN=C1C2CCCCN2)N[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,9827215AC073E426_8EE8720693EBE62F_6041_DP,7.912112,00000000000000000000000000000000000000100010000000000010000000100100000000010101101101110011010010101000100110010000001011100100110101110110001011011011010010101111010,HNSLACSXENBAME-GVYDCBATSA-N
C1(=CC2=C(C=C1)CC3CCC(C2)C3=O)NCC5=NC4=C(C=CC=C4F)O5,97B4BAA4AD67E163_84F099D7916A84A1_6041_UN,8.395683,00000000000000000001000000000000000000000010000000000000010000000100000000000001001100010001100110001100010100110000011011000101110011110100001111010001111110110111110,QWUWHRPSLOIYLG-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NCC(C3CCNCC3)F)C,A76D897AD9C18122_9AAF985465A51EA2_6041_DP,8.848051,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000110001000000101100110110010000001011000100110101110110001011010111010110101111010,AVXKHEVZKQVRTE-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(CC)CCNCC3)C4=CCNCC4,4FB7D6C3F07A0CE9_33253A38CC81E477_6034_UN,8.628292,00000000000000000000000000000000000000000010000000100000000000100110000000011000001101110001000010111100110110011010101011100100110100100110001001011001010110101111010,MIXYUOIDDCDWPO-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC=C2NCC3CCCCN(C)C3,6F0C214DAF6137B5_983DB986194899E8_6041_UN,8.213679,00000000000000000001000000000000000000000010000000000100000000000100000000010000101101110011010010001100010110010001101011100100110101110110001010011011010110101111010,ZAIHEEQBEJQNSA-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3C4(C3)CCOCC4,9BDBA17A71C3C04E_3FBB0C7C064C1A97_6041_UN,7.1652465,00000000000000000000001000000000000000100000000000000000010000000110000000000100001000100011000000101100010011001000001011000100110011010110011011010111010111101111110,XUTHMPDITQEZEN-UHFFFAOYSA-N
CC5(C)CN(CCC1CCC2=C(C3=C(N=C12)C=CC=C3)C4=CC=C(C=C4)F)CCS5,42E9959BE771BC98_A0AA411DF3FFFBBB_2201_UN,8.261933,00000000000000000000000000000000000010000010000000000000000000100110000000110000010001111000000010101100010110011001101011100100110000100110001011011100010110101111010,HMWHLSZKKIZEBG-UHFFFAOYSA-N
FC1=CSC(=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,A00F7E4E9B461EE3_95989D8710937E98_6041_UN,8.078591,00000000000000000000001000000000000010000010000100001000000000100100000000010001111101011011011010101000000100010000001011101100110001110110001010011011010110101111010,NXWBVRPWHZCZRW-PXAZEXFGSA-N
C[N]1C=C(C=N1)C4=NCC(C=CC2=CC=CC(=C2F)C3CC3)O4,2537CA51EA83626A_56F95C23F831201B_7019_UN,8.68273,00000000000000000000001000000000000000000010000000001000010000100100000000010010100100010000111111011000000100100000010111101100000010100100001010011010110011101111110,CNTQCFMGMQMXNP-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CSCC3=CC=C(C=C3)F,F93195E4BE2A7D95_22365D27291C559E_6038_UN,8.100432,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000111011100010001000110100110000011000000000110010100010000001010001011110100111110,LRCQWMRHANTJIZ-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(C3=C(C)C4=C([NH]3)C=C(C=C4)F)=O,CB9AE9BC6881E2E8_65D3BAAF580CA2FE_6038_UN,8.027107,00000000000000000001000000000000000000000010000000000010010000000100000000000001001100010011100110101100010100100000011011000100110110100100001011010011111111111111110,JNSRIGVQWHDJOM-UHFFFAOYSA-N
N3CCC1=C(C=CC(=C1)NC2=C(C=CC(=C2)CN(C)C)C)C3,4C9033A2CBEE3800_A4D1D4CC0EA53C05_6041_DP,7.23479,00000000000000000000000000000000000000000000000000000000000000000000000000100000001001100001010000101100110000010001001001100100110101010110011011011111010110101111010,VIUGIQFTHPNJGG-UHFFFAOYSA-N
C(CC1NCCCC1)=CC2=C(Cl)[N](C(=N2)N(C)C)C3=CC=C(C=C3)F,6631D8933709D900_613DD472B94FA903_7019_UN,7.30569,00000000000000000000000001000000000000000010000000000000000000100100000000110101001101110011010010111001101100010000001011100100110001110100001011011111010110101111010,RLLZQURJZRNVOE-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1C)Br)[N]2CC3(CC34CCNCC4)C#N,FA0EBA13C769D93F_8CCC71372B8B68F5_6034_DP,8.18996,00000000000000000000001000000000000000000100001000000000000000000110000000010000101101110001000010101100110100011000101011100100110000100110001011011111010110101111010,ABHCOWHVRICOGU-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)NC2C(C)(C2)C3=C(C=C(C=C3)F)F)C4[C@@H]5CNC[C@H]45,E7E89D6CDF83557A_3E7BEAFB4A146C54_6041_DP,8.345764,00000000000000000000001000000000000000100010000000001000000000100110000000000101101101110011011010101000110110011001100011101100110101110110001011001111010110101111010,XFOKPZVRXPBOSC-QYCBYKEFSA-N
FC1=C(C(=CC=C1)C[N]2C=C(C=N2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5)F,34237CAB861F1A3C_70D04A213B0DAFC3_6041_UN,8.096209,00000000000000000000001000000000000000000010000000001000000000000110000000110001101100010011001010001100010100011001101011101100110001110110001011011111010110101111010,JXPMGUXXXMMMIP-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,B71E328F06833F9B_380F0F38B194BB2A_6041_UN,8.1184845,00000000000000000000000000000000000000000010000000000000010000100000000010000000100101110010010010001000000111010001101010110100110011110110001011011011010111111111110,KTAXIUCCDNCUEW-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(COC3)C4=CC=C(C=C4)F,E5B62DA0A684741E_25483915F157B843_6041_UN,7.936183,00000000100100000000001000000000000000000010000000001000010000100110000000010001100100110001011110000000100101011000000011101100000001110110001010011011010011101111110,YKJVUMNCYAIFON-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3=C[N](N=C3[C@H]4CC[C@@H](C)O4)C)C5=CCNCC5,744A1C8AEAB1C4A1_9D82937A3B4E7201_6034_UN,8.642437,00000000000000000000000000000000000000000010000000101000010000100100000000011000101101110001011111111100110110010001101011101100110010100110001011011111110111101111110,GQDLKSRVARUJOC-IVZQSRNASA-N
C(C1CCCC12CCOCC2)=CC4=CC(=C(N3CCN(C)CC3)C=C4)F,0392B33C2F861E93_5762A07C25B04E49_7019_UN,7.007398,00000000000000000000000000000000000000000010000000000000010000100010000000010001000001110000010010111000010101011001101011100000110011110110001011011010010011101111110,LVYCFSBBYJJMPQ-UHFFFAOYSA-N
N1CC4(C1)OC5(COC2=C(C=CC=C2)CNC3=CC(=C(C=C3)F)Cl)CC4(N)C5,E53DADBA5481583A_3ADCF201BC8CD0A7_6035_DP,8.130293,00000000100100000000000000000000000000000010000000000100010000000010000010000000101110110011000111001001110101011100000011000111110111110110001111000011110111110111110,SUQITFSIUWHMIR-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NCCC2CCCN(C)C2)C3CC3,2B42A51AF8DD113E_41654D6645246267_6041_UN,7.8161955,00000000000000000000001000000000000000000010000000000000000000100000000000010000001001110001010000101000100110010001101001100000110001110110001011011011010110101111010,VGMDZAMKDGURAP-UHFFFAOYSA-N
CC1=C(C(=CC=C1)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,949E023B600487DD_C22F415438293A68_7022_UN,8.303107,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110011011011111110111101111110,XSBIZYHYEGMOJW-RDJZCZTQSA-N
N1CCC5(CC1)CCC2=C(C=CC(=C2)NC3=CC(=C(C=C3)N4CCCCCCC4)F)O5,D09F53E608D0152E_77D345919BF009C4_6041_DP,8.217035,00000000000000000000000000000000000000000010000000000000010000100010000000010000001001110001000001101100110100011100001011100100110111110110001011011011110011100111110,ASTSLSPCOJLMDP-UHFFFAOYSA-N
CC1=C(C(=CC=C1)Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,CA6CE2E8184F6F67_E6F316C0240457F4_7022_UN,8.303083,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110011011011111110111101111110,BDTUJTTZMKTVSK-RDJZCZTQSA-N
C(C2CCCC1(CC1)C2)=CC3=C([N](C)C4=C3C=CC=C4)Cl,1B4E04C722818517_F72B387246C2B784_7019_UN,8.377159,00000000000000000000001000000000000000000000000000000000000000000110000000010000000101010000010010010101010100001000001001100100110000100100000011011010000010101111010,LQGMSIKQDUOLCF-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)C[C@H]3OC(C)(CNC3)C)CC#N)F,47E111CA67DBD3AB_583655A9CEFFB5D8_6034_UN,8.303884,00000000000000000000000000000000000000000110000000000000010000000110000000110000101101110010000110101100010110011001000011100100100010100110001011001111110111101111110,ZXQBYECMNKDGTL-LBPRGKRZSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4=CC(=C(C(=C4)F)N5CCCCC5)F,F08C90993ABB72B1_F7111ECD58924DE8_6041_DP,7.945918,00000000000000000001000000000000000000100010000000000000000000100100000000010101100101110011010010101000110100010000101011100100110101110110001011011011010010101111010,XYXXYSKOXNERCR-ALXJQNPVSA-N
O(CC2CCOC1(CCOCC1)C2)CCC3CCN(C)CC3,82870F9A62098ABD_C1F02BDD7BEF4D46_6039_UN,7.3500905,00000000000000000000000000000000000000000000000000000000010000000010000000010000000001100100010000101000010001011001101011100010110010000110000001111000110101111101110,KAHPKSSGHAQRPS-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC4CCN(CC3CCCO3)CC4,78B62178F9BBE00D_BD5684E91FB04175_6041_UN,7.7286496,00000000000000000000000000000000000000100010000000000000010000000100000000010100100101110010000110101100110101010000001011100100110011110110001011011111110111101111110,RPZVBCXMYLGCGP-UHFFFAOYSA-N
FC1=CC(=C(C=C1)N[C@H]3[C@H](C2=NC=C[N]2C)OCCC3)C4CC4,4FEEB41CCF620383_E20E86F39D38AD25_6041_UN,8.52754,00000000000000000000001000000000000000100010000000000000010000100100000000010101100101010011010110100000100101010000001011100100100011110100001011011011110011101111110,CVOQPPFKRTZZSJ-IAGOWNOFSA-N
FC2=C1CCCC1=C(C=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,7847BCA0A7082F8B_D0F641F02EED5818_6041_UN,7.870739,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,CWPZFQPQKMQCRM-QRQCRPRQSA-N
FC1=CC5=C(C(=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)C=CO5,A7F8D2DCFC665968_7D6A86FAB4B957D1_6041_UN,8.364044,00000000000000000000001000000000000000000010000000001000010000100100000000010001101101010011011011101100010100010000001011101100110001110110001011011011110110101111110,BOKIUTXZCOHQKZ-SZNDQCEHSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@@]34CCCN[C@H]3CCCC4,D5B09018E45D710F_3C6F01C0D742EAAF_6041_DP,7.583185,00000000000000000000000000000000000000100010000000000100000000000110000000000100101000010011000000101100110110011000001011000100110101110110001011010111010110101111010,HZYVWORZZZBTAX-GHTZIAJQSA-N
CN(CC1CCNC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,A21D4D39C3638077_AAD788FF89C6EE72_6041_DP,8.408734,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000100110010001001011100100110101110110001011011011010110101111010,QCGKUXWJEDNJAF-LLQOJDTPSA-N
O(C3CCN(CC1CCCC2=C1C=CC=C2)CC3)CC4=CC=C([Si](C)(C)C)C=C4,B7C4A9815CA50065_8A5358DD56E89284_6039_UN,7.7198973,00000000000000000000100000000010000000000000000000000000000000000000000000110000000001100000010001101100010001011000001001100111110010000110010111011100110101101111110,OGLKYEWXVYFPPQ-UHFFFAOYSA-N
O(C3CCC4C1CC(C2OC12)C34)CC5=C[N](C(C)(C)C)N=C5,FA5D03D8EB8B5432_63CA3B338EDDBF8A_6039_UN,8.660677,00000000000000001001001000000000000000000000000000001000010000000110000000110000100100000000001011100100010001001000001011101011110010000100011101011100110111111111110,GSHANJAEUANQQI-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC4CC(C3=NC=C[N]3C)OCC4,0E63A9CF9801A15D_7479755A7034C8C0_6041_UN,8.128862,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010010010111100100110111010000001011100100110011110100011011011111110011101111110,PSZYIUCDYQLBST-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC2=CC=CC(=C2)CCN3CCN(C)CC3)C4OCCO4,14C3E5CBEBEA24A4_02507F2F4957D150_6041_UN,7.4411144,00000000000000000000000000000000000000000010000000000000010000100000000010010001000101110001010010101000000101010001101011110100110011110110001011011011010111111111110,FSPZONREHXRLIM-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CCC3CCCN(C)C3)C4CCNCC4,3DDE9C385A80ADC5_73936C34D5CCFDCC_6034_UN,7.9748106,00000000000000000000000000000000000000000000000000000000000000100100000000010000001101100001010010101100110010010001101011100100110000000110001001011101010110101111010,YRSWMQVFQJMUCP-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)SC=C2)NCC4(N3CCN(C)CC3)CCCCCC4,EE0E35DDFB524372_56670DA78EDB5BDC_6041_UN,7.5793185,00000000000000000001000000000000000010000010000000000000000000100010000000010001011101111011010010101100010100011001101011100100110001110110001011011011010110101111010,LKVHQFCUOMJHIE-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)CCC2)NCC3CCCN(C)C3C4=CC=CS4,999549614E53AE5E_E09D349EBC089847_6041_UN,8.0910425,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,VBIGIRHZJGFTTI-UHFFFAOYSA-N
N(CC3CN1CC2CC1(C2)CO3)C(=O)C4=C[NH]C5=C4C=C(C=C5)F,950FE183EF4E0186_FD3D807BFBAB8939_6038_UN,8.056015,00000000000100000000000000000000000000000010000000000100010000000110000000000000101101110011100111101100010101111000010011100100110110100110001001001001111111110111110,PZHYQBKIFSDCFX-UHFFFAOYSA-N
FC1=C(C(=CN=C1)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,18BD416555E77B06_84F745B8970A3D1B_6041_UN,8.684268,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,DCCJGCDCFARQPG-XIKOKIGWSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2(CC2)C3CCOCC3)F)CC4,D866F76883E77B05_B0468EA4522BE79A_6041_UN,7.531978,00000000000000000001001000000000000000000010000000000000010000100010000000010001100001110011010000101000100111011001101011100000110011110110001011011011010111101111110,YFEUVOQHCMQZLN-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2CC2)NCC3N(C)CC4(CC3)CCC4,77E21E8F852E1955_15F81D240457E6F8_6041_UN,7.525711,00000000000100000000001000000000000000000010000000000000000000100010000000010001001001110011010000101000010110011001101001100000110001110110001011011011010110101111010,JPFAFPIGDPULHF-UHFFFAOYSA-N
C1(=CC(=CC(=C1)F)COC2CCCCC2)NCC3(CN(C)C)CCOCC3,32F56DB9712ADF20_D2B6E59722C2E2FE_7022_UN,7.613325,00000000000000000000000000000000000000000010000000000000010000000010000000100000101001110011010000101000000111001001001000100011110011110110001101011101110111111111110,WUAONOQWKCZDJT-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC3CCC34CNC4,7A3895B1043A2ACF_CD7DB552560BA37A_6041_DP,7.7216687,00000000100100000000000000000000000000100000000000001000000000100110000000010101101100100011011010001000010010001000001011101100110101010110001010011111010110101111010,LQHKLKSZKNPKIY-UHFFFAOYSA-N
N(C2C1C3CC4C1CC5C2C3C45)C(C6=C(OCC)OC(=N6)C7=CC=C(C=C7)F)=O,854CF487E6792AC3_859BC04F85C6D9ED_6038_UN,8.659454,00000000000100000001000000000000000000000010000000000000010000100100000000000001000100010101100111000100010101100110010011010111110001100100001111100011011111111111110,HHSWABDSLFSIDF-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC4=CC3=C(C=C(C)C=C3)N=C4Cl,4FDB5BF93F8B1E3D_3F9E2ED8E810267F_7019_UN,8.646996,00000000000100000000000000000000000000000000000000000000000000000110000000000000000000010000000000110101010100001000001001000100110000100100000011010010000010001111010,NZBLVSZAPIOGQB-UHFFFAOYSA-N
CC1=CN(C2=C1N=CC=C2)CC3CCCN3CC4CCCN4,A63960F44D959760_833E7612C8C9A507_6034_UN,8.26194,00000000000000000000000000000000000000000000000000000000000000000100000000010001101101100011000010101100110010010000001011100100110000000110001000011011010110101111010,QJILVROKKODWIU-UHFFFAOYSA-N
BrC2=C1C=CN(C(C1=CC=C2)=O)CC45OC3(CCNCC3)C(C4)(N)C5,DDF85120B684FA71_6460CA40B35FC1C0_6034_DP,8.3661585,00000000000100000000000000000000000000000000001000000000010000000110000000010000001111110011100111101100110100111100011011100101110111100110001111011011111111110111110,INEINKPUFYWXTA-UHFFFAOYSA-N
FC2=C1C=CN(C(C1=CC=C2)=O)CC45OC3(CCNCC3)C(C4)(N)C5,D60B299F1931F20D_7DE74C5397542D4C_6034_DP,8.366133,00000000000100000000000000000000000000000010000000000000010000000110000000010000001111110011100111101100110100111100011011100101110111100110001111011011111111110111110,PTASYAMUGQVFPB-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4C(C)(C4)C5=C(C=C(C=C5)F)F,86E66C44A9A5C4A2_1C41FFAF786CE81D_6041_DP,8.387411,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011001100011100100110101110110001011001111010010101111010,MWUMWDKPHZYAGC-PXIGHNNKSA-N
BrC1=CC2=C(C=C1)N(C=CC2=O)C[C@]34CCCC[C@@H]3NCCC4,F037809B3767B591_896BF1DDAB397376_6034_UN,8.625282,00000000000000000000000000000000000000000000001000000000000000000110000000010000101001010011000001101100110100011100001011100101110000100110001101011001111110100111110,OFBSIGZHEYBAHN-RBUKOAKNSA-N
CC1=C(C(=CC=C1)F)NCC3OC2(CCC(C)(CC2)C)CC3,FA3C2C400360F3F8_FEC1972A7F82EA84_6041_UN,7.8239536,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010011000110001000010110001001101000000000110011110100010011010111110111101111110,CYKWINVOEKLBBE-UHFFFAOYSA-N
CC1=C(C(=CC=C1)Cl)NCC3OC2(CCC(C)(CC2)C)CC3,617B4FD9962EE852_9F62E733B7B8CC12_7022_UN,7.82395,00000000000000000000000000000000000000000000000000000000010000000010000000100000001100010011000110001001010110001001101000000000110011110100010011010111110111101111110,SXBYOVNDCYCCFZ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CC4(NC3)CCC4,CF16E045E509D826_4BC87A755747A8AA_6041_DP,7.4858723,00000000000100000000000000000000000000100000000000000100000000000110000000000100101100000011000010101100110010011000001011000100110101010110011011010111010110101111010,FDNJWTXASDTASS-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)NCC(C2CCNCC2)F)F)C#N,8E8160A1D963C892_062F4C369850B0FC_6041_DP,8.723818,00000000000000000000000000000000000000000110000000000000000000000000000000000000001000110001000000101000100100010000001001000000110101110110001011010011010110101111010,LZQZNFWUMJPQTL-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CO2)NCC3(CCN(C)CC3)N4CCCCC4,19C0D11560480F55_89C860DF1638B2BC_6041_UN,7.863509,00000000000000000000000000000000000000000010000000000000010000100010000000010001101101110011010110101100010100011001101011100100110001110110001011011011110110101111110,ZULZZIUBGBQKNH-UHFFFAOYSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3(C)CCC4(CC3)OCCO4)C5,295DF75BED471EF6_C43E40F38E7AF46C_6041_UN,7.2001147,00000000000000000000000000000000000000000000000000000000010000000110000010010000101101100011010010101100110001011001101011110100110111010110001011011101110111111111110,RFYWTBOUZJTJQK-UHFFFAOYSA-N
N1CCC2(C1)CCN(CC2)C3=NC(=NC=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,300F47832AB52617_5CE08A58A9A44AF6_6041_DP,8.456701,00000000000000000000000001000000000000100010000000000000000000100110000000010101101101110011010010101000111110011001101011100100110101110110001001011011010010101111010,IKMLFGMCQAYGID-CTNGQTDRSA-N
CC1=C(C=C(C(=C1)N[C@H]2[C@H]3CC[C@@H](C2)C3)F)[N]4C=CC=C4,CE8563A783A28A5E_41AEE08EABE4FDBF_6041_UN,8.4338875,00000000000000000000000000000000000000000010000000000000000000100100000000010000000101010011000010000000110100010000001001100100110001110100001011011011000010101111010,YLCUZAFBHLZURE-IJEWVQPXSA-N
O(CC2CCOC1(CCOCC1)C2)CCC3CN(C)C3,E78A6956C2ECC82E_FF1C7F428D36042D_6039_UN,7.3577085,00000000100100000000000000000000000000000000000000000000010000000010000000010000000001100100010000101000010011001001001011100010110010000110000001111000110101111101110,DZZDACSYSFUXKL-UHFFFAOYSA-N
N(CC12CC(C1)C2)C(=O)C3(CCCC3)C4=CC(=CC(=C4)F)F,3AB25BD48907611D_E678A8AC914E126F_6038_UN,7.396648,00000000000100000000000000000000000000000010000000000000000000100010000000000000001000010011100010001000010100101000011000000000110000100000000000010001011110100111110,UXRXSSNUOJUIHF-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C3CCC2O3)NC5=CC(=C(N(C)C4CCCCC4)C=C5)F,16AA3FA3A387729F_1CE27A7285508364_6041_UN,8.032489,00000000000000000000000000000000000000000010000000000000010000000000000000000000000101010000010010000100010110010000101000100100110011110100001011011011100011101111110,VNEQDGLKXJZNSD-UHFFFAOYSA-N
N(CCN1CC2C(C1)C3CCC2C=C3)C(=O)C4COC5=C4C=C(C=C5)F,8D8057CD7A6DBAAB_D9BED8069B8A4B36_6038_UN,8.151047,00000000000000000000000000000000000000000010000000000000010000000000000000010001001101110111100011011100110101110100011011100000110000100110001011011001111111110111110,FIJJIDOHGDBBRF-UHFFFAOYSA-N
CC[N+](C)(C)CC1=C(C=CC=C1)NCC2(CCNCC2)C3=C(C=NC=C3)F,F11ED07C5D4DC75E_169C3048E1C3E3B9_6041_DP,7.8989515,00000000000000000000000000000010000000000010000001000000000000100110000000100000101001110011010000101000100100011011101011100100110101110110011011011111010110101111010,YVWDFEKLQPHODH-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC5CCCN(CC4=C(C=CC=C4F)F)C5,60B38C788B7E03C5_B764649F1025E6F1_6041_DP,8.36063,00000000000000000000001000000000000000100010000000000000000000000100000000010101101101110011010010101000110110010000001011100100110101110110001011011011010110101111010,AKEMHCBTNYMADL-GERGAVKQSA-N
N(CC1C3CC2CC(CC1C2)C3)C(C5=C(CC)N=C4C=C(C=CC4=C5)F)=O,26E7B69FED2ED487_7B5E0EFDB491A058_6038_UN,7.90204,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010001100001101100010100110010010001000100110000100100001011000011011110101111110,HTUGTBKHWUWDLF-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)F)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)F,7CA69BD1D76EF2F5_BF3B64947FA2320F_7022_DP,8.818061,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001111010110101111010,WXBKZPUIKWOEBH-NWDGAFQWSA-N
CC2=C1N(C(C=CC1=C(C=C2)Cl)=O)CC3(NCCCC3)CC=C,11475A25906BDA85_09485BEFE2E026DE_6034_UN,8.516152,00000000000000000000000000000000001000000000000000000000000000000110000000010001001001010011100000111101110110111100011011100101110000100110001111011011011110101111110,LYHFPCFOYADVDC-UHFFFAOYSA-N
N1CC2(C1)CCN(CC2)C3=NC=C(N=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,DB8CDC4A3ED4DAF1_7046DD5D1BB1D1BD_6041_DP,8.443926,00000000100100000000000000000000000000100010000000000000000000100110000000010101101101110011010010101000110110011001101011100100110101110110001001011011010010101111010,GVCYWXKTDNMIHJ-NQIIRXRSSA-N
N(CC1CC2CCC(C1)O2)C(=O)C[N]3C=CC4=C3C=CC(=C4)F,CFE0B8EAA56555FE_837EDC89C22AAC4D_6038_UN,7.795248,00000000000000000001000000000000000000000010000000000000010000000100000000010001001101010010100110101100110100110000011011100100110010100110001001011001111111110111110,MMYCLBJHPXNCCI-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[N](N=C2)C3CCCCO3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,0D30190679634D54_ADF891A9E16EF384_6041_UN,8.037219,00000000000000000000000000000000000000000010000000001000010000100100000000010001100101110011111110101100110111110001111011101100110011110110001001011011010011101111110,GROCTVPABXQGEK-FQXDTITESA-N
FC1=NC=CC(=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,64DB7FD2D887B18C_B8299F28BAF1C6E4_6041_UN,8.391684,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,CVENPMGPHGLPDX-ACJLOTCBSA-N
FC1=CC2=C(C=C1)C=CC(=N2)NC3CCN(C)C34CCCNC4,46700A21D7E04556_1962D052F63EAE3E_6041_DP,8.52989,00000000000000000000000000000000000000100010000000000100000000000110000000010101101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,YDOQLZILTHELEM-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3(CC3)C4CCOCC4,92C50D5718A01CEE_4607EEF9DBCC0FCF_6041_UN,7.675983,00000000000000000000001000000000000000100010000000000000010000100110000000000100001000110011000000101100010111001000001011000100110011110110001011010111010111101111110,KRLFDAAUFMCSOD-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)F)NCC2CC3CCC2N(C)C3)F,524E39CBC0135AB5_F2FC1A29734FC184_7022_UN,8.327529,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001110011010000101000010110010001101001100000110001110110001011011111010110101111010,MPSNNQSFQFQDHZ-UHFFFAOYSA-N
N4CCC1=C(C=CC=C1NC2=CC(=C(C=C2)N3CCCCCCC3)F)C4,8C550EF7666900AB_B56C2F48BDD56993_6041_DP,7.7431316,00000000000000000000000000000000000000000010000000000000000000100000000000010000001001110011000000101100110100010000001011100100110101110110001011011011010010100111010,RFJYOKGAEQCDGA-UHFFFAOYSA-N
FC2=C(C=C1C=NC=CC1=C2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4,C0DC523E92EE8E85_5F23C73112CD5D87_6041_UN,8.772545,00000000000000000000000000000000000000000010000000000000000000100100000000010000101001110011010000101100010110010001101011100100110001110110001011011011010110101111010,GLJDYNMBOGNGCG-AVRDEDQJSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3C(CCC)CCC3,760259AF36C69DEA_8C016E59312617EE_6041_UN,7.954471,00000000000000000000000000000000000000000010000000000000000000000100000000000001001000010011000010101100010110000011001001000100110001110100001011010111010110101111010,PFWGDRHRCUZEDY-UHFFFAOYSA-N
FC2=C1OC=CC1=C(C=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,3AB15EA9E9BB295A_AF29B5DC8A1CBCC8_6041_UN,8.598881,00000000000000000000001000000000000000000010000000001000010000100100000000010001101101010011011011101100010100010000001011101100110001110110001011011011110110101111110,DOHVMOOSPPWXCE-VLIAUNLRSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC[C@@H]2OCCN(C)[C@H]2C3=CC=CC=C3)F)CC4,5D9C8F7618F55118_BA500993AEE35B79_6041_UN,7.9183574,00000000000000000001000000000000000000000010000000000000010000100000000000010001101001110001010100101000000111010001101011100100110011110110001011011111110111101111110,HYVYSWZMBPDLEC-DQEYMECFSA-N
C[N]1N=C(C=C1)C(NC(=O)CC2CC3CCC2O3)CC4=C(C=C(C=C4)F)F,718573A22C86FAA9_3E9757467163C139_6038_UN,7.9336433,00000000000000000000000000000000000000000010000000001000010000000100000000010001100100010001111010000000110100110000011011101100110010100100001011011011101111111111110,PDVYVTCLCMTALW-UHFFFAOYSA-N
O(C2C1CC(C1)C3=C2C=CC=C3)CC4CCC(F)(F)C(N4)=O,4F842805FEAFB34E_0BE003F5ADB17376_6039_UN,7.90082,00000000000100000000000000000000000000000010000000000000000000000000000000000000000000010011100100100100110101111000011001000011110000100100000111010011111111110111110,MVSYZKMFSHPZMD-UHFFFAOYSA-N
CC4(C)COC3(C[C@@H]2CC(OCC1=C(F)C=CN=C1)C[C@@H]2C3)OC4,03679C0239AA456A_1988939DE3A2AACF_6039_UN,8.55361,00000000000000000000000000000000000000000010000000000000010000000110000000100000000000010100000011100100010101001001000011010011110010100110000111100110110101011111110,BJKVWRXVIWHUFV-MZBDJJRSSA-N
FC1=CC2=C(C=C1)C(=NC=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,82D867505713E952_9D60C4F57A0B6A3A_6041_UN,8.549322,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,GBZYSRWMJOQPQC-IERDGZPVSA-N
CCC5CCC1=C(C4=C(N1CC2(CC2)C3=C(C=CC=C3)Br)C=CC(=C4)C)C5,1F4FD6C0696EFF97_31B02135EF8D6358_6034_UN,8.155062,00000000000000000000001000000000000000000000001000000000000000100110000000010000000101010000000010001100010110011010101001100100110000100100000011011110010110101111010,IIXOEJAONIOLSW-UHFFFAOYSA-N
C2(=CC1=C(C=C(C=C1)F)O2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,7BDE9141C2C72FB7_DEF7E971692872F8_7022_UN,8.481735,00000000000000000000001000000000000000000010000000001000010000100100000000010001101101010011111010101100010100110000011011101100110001110110001011011011110110101111110,KIKGOUMJHRDFDH-VFNWGFHPSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC23N(C)CC(C2)C3)F)CC4,EE3EE00E29D75DFC_0F4E9ECEA28B4474_6041_UN,7.5181503,00000000000100000001000000000000000000000010000000000000000000000010000000010001101101110011010010001000010110011001101011100000110001110110001010011111010110101111010,VCZGJDZNZWVSEL-UHFFFAOYSA-N
C2(=CC1=C(C=C(C=C1)Cl)O2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,DDC378AA312DC19B_CD5B98B3DB5E0C99_7022_UN,8.481745,00000000000000000000001000000000000000000000000000001000010000100100000000010001101101010011111010101101010100110000011011101100110001110110001011011011110110101111110,SWRRRFIVWRDSBX-VFNWGFHPSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2C3(CCNC2)CCC3,BE3C611C8204F7D7_FF2BC249E9CA164C_6041_DP,7.545113,00000000000100000000100000000010000000000000000000000100000000000110000000100001101000100011010000101000110000011000001011000000110101010110011011011111010110101111010,IMRCITAATRJVBD-UHFFFAOYSA-N
O(C1C2CCC1C3CNCC23)C4=C(C=CC=C4)C(=O)CBr,E5465EAD02969A92_DE0C201C445BDDD9_6035_UN,8.174255,00000000000000000000000000000000000000000000001000000000000000000000000000000000001100100101000010001100010000000100001001000011110010100110000111010011111101110111110,URVBAIHBWLKDBJ-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NCC2C(CC)CCCC2)C3CC3,579B03D72A903F36_E8AC68039EBF20E2_6041_UN,7.7146654,00000000000000000000001000000000000000000010000000000000000000100000000000000000001000010011000000001000000110000010101000000000110001110000000011010011010110101111010,HKEDFJSRRLFJDH-UHFFFAOYSA-N
C(CN1CC2CCC(C1)O2)=CC3=C(C)[NH]C4=C3C=C(C=C4)F,392FE110B1819660_9A0C027C226147A1_7019_UN,8.562731,00000000000000000001000000000000000000000010000000000000010000000100000000010000000101110000000110111100010100000000001011100100110010100110001011011011110111101111110,GUJISNKGSDCLIG-UHFFFAOYSA-N
CCNC5CCC1=C(C4=C(N1CC2=C(C=CC=C2)CC3CCNCC3)C=CC(=C4)Cl)C5,DA9D14EA681B2A7B_FE88563B62636A60_6034_UN,8.100321,00000000000000000000000000000000000000000000000000000000000000000100000000010000001101110011000010101101110110010010001011100100110101100110001011011011010110101111010,PRBHLDXTQPAZAU-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CCSC2)N3CCOCC3)F)CC4,CB7350B127C37DF5_EF7F3CC06C2D367E_6041_UN,7.9482703,00000000000000000001000000000000000010000010000000000000010000100010000000010001101101111011010110101000000111011001101011100000110011110110001011011011010111101111110,VQENNDFFVYVKCZ-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC[C@H]3[C@@H](C3)C4CCOCC4,6900701AC6FC0645_30951E476557FD2A_6041_UN,8.480229,00000000000000000000001000000000000000000010000000000000010000100100000000000000101000110011000000101100010101000000001011000100110011110110001011010011010111101111110,VRSNRUBZSXRBKN-HOTGVXAUSA-N
CC1=CC(=C(C=C1)OC(F)F)C=CC3CCC2COCCC2C3,4ED87458A0021AD8_CE7AE0DB8B9C193D_7019_UN,8.448465,00000000000000000000000000000000000000000010000000000000010000000000000000000000000000100000000000110100011101000100001000000011110010100110000111010010110001011011110,ITSBDOHOOUBYSB-UHFFFAOYSA-N
N4CCC1=C(C=C(C(N1CC3COC2=C(C=C(N)C=C2)N3)=O)C#N)C4,B7BF3A7C2BC69ACD_FF515DDC9CE0A924_6034_DP,8.442471,00000000000000000000000000000000000000000100000000000100010000000100000000010001101011100001100101101100110001110100011011100101110101010110001111011011111111110111110,NYWRJHCUBOMYPH-UHFFFAOYSA-N
C(C1(CC1)C2CCCCO2)=CC3=C[N](C)C4=C3C=CC(=C4)Cl,9EC5EC880DCBD7AF_FFE6DAC0540464EA_7019_UN,8.084036,00000000000000000000001000000000000000000000000000000000010000100110000000010000000101010000010010110101010101001000001011100100110010100100000001011000110011101111110,PJKTYOUOJMZKDE-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC4CC3CCOCC3CC4,7DFB066612C88434_FFEE434179855FCA_6041_UN,7.940732,00000000000000000000000000000000000000100000000000000000010000000100000000000100001000100011000000101100010011000000001011000100110011010110011011010111010111101111110,CNAZXAWVTXHYJA-UHFFFAOYSA-N
CCC2=C1N(C=C(C1=CC=C2)C3CCNCC3)C[C@H]4[C@@H](CNC4)C5=CC(=CC=C5)F,AB7250F4D340B63F_81A579CF97AA5B0D_6034_UN,8.405144,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010101100110100010010001011100100110100100110001001011011010110101111010,LACAJAMBIPWRLN-URXFXBBRSA-N
CN(C1CCNCC1)C2=NC(=NC=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,F42BFDF8EE94AA7B_EF122928FA3676A9_6041_DP,8.490802,00000000000000000000000001000000000000100010000000000000000000100100000000010101101101110011010010101000101110010001101011100100110101110110001001011111010010101111010,ZDUSULZPBAELOQ-QUCCMNQESA-N
CC1=C(C2=C([NH]1)C=CC=C2NCC3(CCCO3)C4CC4)C,8000862DCCF10162_72D53D0DA5623DDE_6041_UN,7.705049,00000000000000000000001000000000000000000000000000000100010000100110000000000000101100000011000110001100010001001000001011000100110111010110001010010111110111101111110,XRAXRRMQPXJZTE-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)Cl)C5CC5,343E33319DDAE15A_F366C791CC60AAE5_7022_UN,8.205873,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101001000110010000001011101100110001110110001011011111010110101111010,ZMATYTFSAGJLCC-HXOBKFHXSA-N
N(C(CF)C1=CC(=CC=C1)C#N)C(C2C3CCCC2CN3)=O,F06325E934A45D06_8ABC49C09600832E_6038_DP,8.559643,00000000000000000001000000000000000000000110000000000100000000000000000000000000101100000011100011001000110000110000011001000000110100100110001001010001011110100111110,NKWKHYSLDPYTLR-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)NC[C@@H]3[C@H](CN3)C4=CC=CC=C4,FD49686E0E00D5F4_3A96B60F136F04CC_7022_DP,7.4736323,00000000100100000000001000000000000000000110000000000010000000100010000000000001001000010011000000001000100100011000000001000100010101110110001011010011010110100111010,KSQHUERNNZYOBI-VQIMIIECSA-N
CC1=C(C=CC(=C1F)C#N)NCC(C2CCNCC2)C3=CC=CC=C3,119EF743510FC701_9AFBF5577107213A_6041_DP,7.781159,00000000000000000000000000000000000000000110000000000000000000000000000000000000001000110001000000101000100110010000001001000100110101110110001011010011010110101111010,PYCFKVXJKUVJPZ-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=CN2C[C@]3(C)COC[C@@H]4CCCN34)F,EAC361F5C823635B_F4B1473300E1BF1F_6034_UN,8.309264,00000000000000000000000000000000000000000010000000000000010000000110000000010001000101110000000111101100010111011001101011100100110000100110001011011110010111101111110,RZWGXXCDWJVZIA-MAUKXSAKSA-N
CC1=C(C2=C(C=C1)C=CN2C[C@]3(C)COC[C@@H]4CCCN34)Br,2A3F7DFD8D9BA3E5_DEBBA8C930A0FBB5_6034_UN,8.309265,00000000000000000000000000000000000000000000001000000000010000000110000000010001000101110000000111101100010111011001101011100100110000100110001011011110010111101111110,QJBJMJIVHWJJJI-MAUKXSAKSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NC(CCC)C3CCCCC3,262A2E772344EF99_14E58E4C7B3F18AA_6041_UN,8.082028,00000000000000000000000000000000000000100011000000000000000000000100000000000100000100010011000010000100110100010011001001000100110101110100001001010001000110101111010,IRRBEGGMJNQWNX-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C([N](C)C4=C3C=CC=C4)Cl,C1BCD2B84DE0C912_024FDE50961DDAB6_7019_UN,8.225704,00000000000100000000000000000000000000000000000000000000000000000110000000010000000101010000010010010101010100001000001001100100110000100100000011011010000010101111010,VEDZUFTULSVKMI-UHFFFAOYSA-N
N(C1C2CCC1CCC2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,57D91B1FE0C6F345_086B88B2738BFFA5_6038_UN,8.0902,00000000000000000001000000000000000000000010000000000000000000000100000000000000100000010011100011100100010100110010011001000100110001100100001011010011001110101111110,QHGOGDSZWAAHIR-UHFFFAOYSA-N
CCNC1=NC=CC(=C1)NCC(N2CC(C)OC(C2)C)C3=C(C=CC=C3F)F,67B06F107ADEDDF9_3D9AA52AE0234AF8_6041_DP,8.32817,00000000000000000000000000000000000000100010000000000100010000000100000000010101101001110001000100101000000110010011000011100100110111110110011011001111110111101111110,XCYGVUPPXZXXHK-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2SCCC3=C2C=CC=C3,19EBD94F1E9ABC97_F42A3EAF1360F542_6041_UN,7.85493,00000000000000000000100000000010000010000000000000000000000000000100000000100001011000101001010000101100010000001000001011000100110001010110011011011111010110101111010,KNCKKADMJPADAW-UHFFFAOYSA-N
FC2=C1N=CC=C(C1=CC=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,F8BF0D231A6D2D46_2236052DE78F8CA8_6041_UN,8.521412,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,JLCJNMLDJHBZQF-QRQCRPRQSA-N
N(CCC1=C[NH]C2=C1C(=CC=C2)F)C(C34CCC(C)(C3)CO4)=O,CB699DA0C28B4428_51C11AD3C692DC68_6038_UN,8.486279,00000000000000000000000000000000000000000010000000000000010000000110000010000000001100010011100110101100110111111001111011000100110110100110001001010001111111111111110,JFQMXRFXHHILMQ-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)N[C@H]4C6=C(OC5(C4)CCC5)C=CC(=C6)F,E3FA407C30C9769D_60614E619559CE6D_6041_DP,8.5674,00000000000100000000001000000000000000100010000000000000010000000110000000000101101101110001010011101100110110011100001011100100110111110110001011011001110011101111110,CYOPRUFTUNRSLM-IJIRQLBGSA-N
CC2=CC1=C(C=C(C=C1C)Br)[N]2C[C@]34CCCC[C@H]3CNC4,CC4C12F39A76E0CA_B2B0B1E5CA07FC7B_6034_DP,8.49542,00000000000000000000000000000000000000000000001000000000000000000110000000010000101101110011000010001100010100001000101011100100110000100110001011011111010110101111010,GFYDHIJSTHDGQY-HNAYVOBHSA-N
CC1=C(C=C(C(=C1)NC[C@]23CC[C@H]2CCCN3)Cl)C4CC4,87C8B61474A90E36_5E420ABE9B4F152F_7022_DP,8.053838,00000000000100000000001000000000000000000000000000000010000000100010000000000001001000010011000000101101110110011000001001000000110101110110001011010011010110101111010,NTFWULDMUMEHRL-RDTXWAMCSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CC(C)(CO2)C)F)CC3,0EED967B59639B56_2628871D9EC7BA4D_6041_UN,7.7466407,00000000000000000001000000000000000000000010000000000000010000000010000000110001101101110011010110001000000111011001101011100000110011110110011010011111110111101111110,MFLIHGLSVAIBIX-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CCN3CCNCC3(C)C)Cl,25C1700604A6567E_0FD0ACA5790B43AA_6034_UN,8.575065,00000000000000000000000000000000000010000000000100000000000000000110000000110111011101111011000010101001101110011001101111100100110101110110011011011111010110101111010,FUGWSIYOZQKOMW-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2C3(OCCC2)CCC3)F,E7493CAC4CEA9964_D6F792869844DBB4_7022_UN,7.744607,00000000000100000000000000000000000000000010000000000000010000000010000000100000000001110011010100101000110101011001001000100000110011110110001011011111110111101111110,VVSJCFKTOPXFPG-UHFFFAOYSA-N
CC1=NC4=C(C(=N1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)CCCC4,B5B0242686CBD626_3F34AA68D55ACF65_6041_DP,7.5123973,00000000000000000000000000000000000000100010000000000100000000100100000000000100101000110011000000101100110110010000001011000100110101110110001011010011010110101111010,RIYDOWFFYKYRJL-FUHWJXTLSA-N
N(CCC1=CC(=C(C=C1)Cl)Cl)C(C2C3CCCC2CN3)=O,3394A375B7C609AA_26D56801F4FA7FE1_6038_DP,8.007481,00000000000000000001000000000000000000000000000000000100000000000000000000000000101100010011100011001001110100110000011001000000110100100110001011010011011110100111110,AGVVGHXIQJMDAE-UHFFFAOYSA-N
N(CCC1=CC(=C(C=C1)F)Br)C(C2C3CCCC2CN3)=O,7A67AA6A10518F4D_7CA026AF2472A0FE_6038_DP,8.007474,00000000000000000001000000000000000000000010001000000100000000000000000000000000101100010011100011001000110100110000011001000000110100100110001011010011011110100111110,IRDVOAWSERKEOV-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N=C(O2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,35D98235BF2F76D1_9B21DFB27A92EF07_6041_UN,8.801927,00000000000000000000001000000000000001000010000000000000010000100100000000010101101101010011010110101100011100110000011011100100110001110110001011011011110110101111110,XNXXWQITWZVUIY-YJYMSZOUSA-N
N(CCC1=CC(=C(C=C1)Br)F)C(C2C3CCCC2CN3)=O,22EF775169AC078E_BB915492C7F843FC_6038_DP,8.007473,00000000000000000001000000000000000000000010001000000100000000000000000000000000101100010011100011001000110100110000011001000000110100100110001011010011011110100111110,PRDCDXGKYQXOLB-UHFFFAOYSA-N
N(CCC1=CC(=C(C=C1)F)F)C(C2C3CCCC2CN3)=O,DE6756BE106F62B8_48723C276B1CAD80_6038_DP,8.007478,00000000000000000001000000000000000000000010000000000100000000000000000000000000101100010011100011001000110100110000011001000000110100100110001011010011011110100111110,DVUKSPIPKRQGCZ-UHFFFAOYSA-N
N1CC2CCC1CN2C3=CC=C(C=C3)N[C@H]4[C@H](CCNC4)C5=CC(=C(C=C5)F)F,29F5449100AC462E_752E3152E140415F_6041_DP,7.6652436,00000000000000000000000000000000000000000010000000000010000000100000000000010001001001110011000000101000110100010000001011100100110101110110001011011011010010100111010,JRYHJDAJUDIJRO-ZZHIBBPDSA-N
CO[C@@H]1C[C@H](NC1)C2=NC=CN2CC3(CC3)C4=C(C=CC=C4)Br,00ECA2BC396D23AE_2296E6FE82791DBD_6034_UN,7.8326626,00000000000000000000001000000000000000100000001000000000000000100110000000010101001101010011010111001000100100011000100011100111110010100110001110011011110111101111110,XNKSHSMJWMPDQM-CJNGLKHVSA-N
C(C2CCCC1(CC1)C2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,0682DEBCE649C4EA_D681CD2C2F99E576_7019_UN,7.929628,00000000000000000000001000000000000000000010000000000000000000000010000000000000000001010000010010010000010110011000101000100000110001110000000011011010000010101111010,AAVLHYGBKQKNFS-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C#N)[N]2C=C(C=N2)NCC3C4(CCNC3)CCOCC4,E255F6386324937E_B2219866CF9C2DEC_6041_DP,8.325966,00000000000000000000000000000000000000000110000000001100010000100110000000010001101100110011001010101000110101011000001011101100110111110110001011011011010111100111110,RLUFCHUMTQTZBC-UHFFFAOYSA-N
BrC1=CN=C(N(C1=O)C[C@H]2[C@@H](CCNC2)C3=CC=C(C=C3)F)C4CC4,54948844AE2E87F7_B953DD54E3C12F50_6034_UN,8.217389,00000000000000000000001000000000000000100010001000000000000000100100000000010100101001110011100001101000100100110100011011100101110000100110001111011011011110100111110,STZTYZQRJVLHAR-HOCLYGCPSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CC3)C4=C(C=CC=N4)F,9BFF96BFB2B1A6BD_7B7A82313E2337F2_6041_UN,8.065126,00000000000000000000001000000000000000000010000000001000000000100110000000010001101100010011011010101000000100001000001011101100010001110100001010011011010110101111010,ZYZVTZSSPQYAKQ-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(C3=C(C)[N](N=C3)C4=C(C=C(C=C4)F)F)=O,2A2EE36C6A891495_243D4125893C9A22_6038_UN,8.344062,00000000000000000000000000000000000000000010000000001000000000100100000000010000101100010011101011011000010100100000011011101100110001110100001011011011011110101111110,BIRGXEKXXFQEHX-UHFFFAOYSA-N
C[N]1C=C(Cl)C(=N1)C=CC2=CC=C(C=C2)C3CCCC3,49903E582F134536_F3CCFE34F5DCD213_7019_UN,8.629437,00000000000000000000000000000000000000000000000000001000000000100100000000010000100100010000011010010001000100000000001011101100010000100100001010011010000010101111010,QLGODXAUJJXBEZ-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC(OC)C3CCCOC3,BFDE09354A092DB4_7C6C05832AC4314D_6041_UN,7.714301,00000000000000000000000000000000000000000010000000000000010000000100000000000001001000110101010100101100010111000000101011000110110011110110001011010111110111111111110,XOGTVXSDRIZGQI-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3C(C)(SCC3)C,AC3F360A3E5337B9_03044E1B4CF6D9CD_6041_UN,8.420275,00000000000000000000000000000000000010000010000000000000000000000110000000100001011100011011000010101100010110001000101011000100110001110110011011010111010110101111010,RBWKPGSBVHKBFR-UHFFFAOYSA-N
C(C2COC1(CCCC1)O2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,054CF95375AF785C_DBBD0EEBB6F3C7D7_7019_UN,7.948171,00000000000000000000000000000000000000000010000000000000010000000000000010000000000101010000010010010000010111011000101010110000110011110100000010011010110011111111110,QHHDWKIERZOTML-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(C)C4CCC(C3)O4,D9FE41D866846C62_90C4E17B8D630086_6041_UN,7.624773,00000000000000000000000000000000000000100000000000000000010000000110000000000100001100000011000011101100010010001001101011000100110011010100011011010111110111101111110,CCTTYFGJCAGWBL-UHFFFAOYSA-N
N1CCC4(CC1)OC5(COC2=C(C=C(C=C2)C3=CC=C(C=C3)F)F)CC4(N)C5,69898599C29DA2B6_13B93F09B2A8CF7B_6035_DP,8.443996,00000000000100000000000000000000000000000010000000000000010000100010000010000000001110110011000111101000110101011100001011000111110111100110001111010011110111110111110,GFAAJMFEXGNFFQ-UHFFFAOYSA-N
N(CC1C3CC2CC(CC1C2)C3)C(C4=C(C)C5=C([NH]4)C=C(C=C5)F)=O,319959B16624127F_FBB6C0393243B191_6038_UN,7.783431,00000000000000000000000000000000000000000010000000000010000000000100000000000001001100010001100110001100010100100000010001000100110100100100001011000011011110101111110,MULKXWFOGZXCTB-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)N[C@@H]4C6=C(OC5(C4)CCC5)C=CC(=C6)F,E26120F6051C3DEA_04F1F494CD4F060B_6041_DP,8.283144,00000000000100000001000001000000000000100010000000000000010000000110000000000100100101010011010011100100111100011100101011100100110111110100001011011001100011101111110,RDKWTIYYRCVWFZ-DMUMMCEESA-N
CCC2OC1=C(C=C(C=C1C2=O)NCC4C3CCC(N3)C4)F,B5D9A790E71763DA_084DC7E1FF526EE9_6041_DP,8.346858,00000000000000000000000000000000000000000010000000000100010000000000000010000000101100010111000010001100110100010110001011000001110111110100001111010011111111111111110,IECHQVWYJHAQRI-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC3CC4(CC3)CC4,C22CE9C96F4BE31A_6E003623F07B2C69_6041_UN,7.909708,00000000000000000000001000000000000000000010000000000000000000000110000000100000100000010011000010100100110100011000001001000100110001110100011011010111000010101111010,QEFDIIUTFFQUMW-UHFFFAOYSA-N
CC1=C(C=NC=C1N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,4ED9E8CAC290DF65_C34939E1DB104078_6041_DP,7.2516847,00000000000000000000000000000000000000000110000000000010000000100100000000000001101000110011000000101000100100010000001011000100110101110110001011010011010010101111010,GGBIBORYNULPAB-SJLPKXTDSA-N
CCC4CCC1=C(C3=C(N1CCNC(C)C2=CC=C(Br)S2)C=CC(=C3)C)C4,3BF1D75CCC40F872_53B071B0CC15DA97_6034_UN,8.567704,00000000000000000000000000000000000010000000001000000000000000000100000000010001011101011000000010001100110110010010101011100100110000100110011011011101010110101111010,VZBLBYYKCHJJKE-UHFFFAOYSA-N
FC1=CC(=C(C(=C1)F)NCC(OC)C2CCCOC2)F,9ECEFC6EDFAD635A_D354CEC815C992F4_6041_UN,7.9501867,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110101010100101000000111000000101000000010110011110110000011010011110111111111110,QWCDHIPRZCVEBC-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)NCC2(COCCNC2)F)F)C#N,10498E0978C484BF_10E77831DC74EE1B_6041_DP,8.3036785,00000000000000000001000000000000000000000110000000000100010000000010000000000000101000110011000101001000100101011000001011000000110111110110001010010011010111101111110,AHUPPRLBPANWLU-UHFFFAOYSA-N
CC(C)CC1=CC(=C(C=C1)NCC2C(CCN2)C3CC3)F,A24645787104CFFB_8AB27C77085CD30A_7022_DP,8.651096,00000000000000000000001000000000000000000010000000000010000000100000000000100001001100010011000010001000100100010001001001000000110101110110001010010111010110101111010,ZHONOFSHVBODEL-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NCCN(C)CC3COCCC3,E3ED29485D013D01_418F415B6480E4E8_6041_UN,6.9383698,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110011010011101100110111010001101000100000110011110110001011011001010111101111110,RKUORFNEKIXZMV-UHFFFAOYSA-N
N1CC5(C1)CCCN(CC2=NC=C(N=C2)NC3(CC[Si](C)(C)CC3)C4=CC=CC=C4)C5,5270961993265CF9_395CF3FBC2F651F7_6041_DP,7.9815445,00000000100100000000100000000010000000100000000000000000000000100110000000110101101001100011010000101000110000011001101011100100110101010110001001011101010110101111010,ZLQPMGNGDKTXNI-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NC34COC(C)(CC3)C4,96BBB05665505489_50247B3798DD2553_7022_UN,8.173876,00000000000000000000000000000000000000000010000000001000010000000110000000010000100100010011001111101000110111011001101011101100110011110110001011011011110111101111110,FOIHFXQTBQDTJI-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NC[C@@H]3[C@H](C(C)C)CCO3,18660442AA49CFCA_4DE7C6DAAF783AB1_6041_UN,8.351696,00000000000000000000001000000000000000000010000000000000010000100000000000100000001100010001000110001000000111000000101000000000110011110110000010010111110111101111110,IYYPFQYGVSZDPU-XJKSGUPXSA-N
NCC(OC1=CC=C(C2=C1CN(C)CC2)F)C3COCC3,AB41F021B05A2730_587D7CE433986562_6035_UN,7.7427893,00000000000000000000000000000000000000000010000000000000010000000000000000010000001111110101010111101100010101010101101011100011110010100110001111011001110101111111110,RDEBDTHRZNDIJF-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C3CCC2O3)NC5=CC(=C(C4=CC=N[N]4C)C=C5)F,8943FA1D559C4B5D_FAEFC7D201926DC9_6041_UN,7.905058,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010000011010000100010100000000001011101100000011110100001011011011100011101111110,LQZPTIFVDLMSDL-UHFFFAOYSA-N
C([C@]12C[C@H]1COC23CCC3)=CC4=C[N](N=C4C)C5=C(C=CC=C5)Cl,686C7B69BFDA3A8D_B3BE4D86DBBC62A3_7019_UN,8.257582,00000000000100000000001000000000000000000000000000001000010000100110000000010000100100010000001010110001010101001000001011101100110011110100001011011010110011101111110,LXTLQJMCOVLZKE-LPHOPBHVSA-N
C([C@]12C[C@H]1COC23CCC3)=CC4=C[N](N=C4C)C5=C(C=CC=C5)F,6D2C70B8BE9C4C0F_FE08975ED960339A_7019_UN,8.257578,00000000000100000000001000000000000000000010000000001000010000100110000000010000100100010000001010110000010101001000001011101100110011110100001011011010110011101111110,RFEKIZRCLAGMRF-LPHOPBHVSA-N
C[N]1N=C(N=C1N[C@@H]2C3=C(CCC2)C=C(C=C3)F)C4CCOCC4,44BFC6D75ECE788A_5AA1FA59598B003C_6041_UN,8.004608,00000000000000000000000001000000000000100010000000001000010000100100000000010101100100110011011010100100111101010000001011101100110011110110001011011011010011101111110,SWZBXIXBEIXVEP-INIZCTEOSA-N
C(CC23CC1CC(CC(C1)C2)C3)=CC4=C[N](C)N=C4C5=CC(=CC=C5)F,9AB994D5857A6CC1_C88F6F660C884077_7019_UN,7.7853346,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010000011010010100010100001000000011101100100000100100001011001010000110101111010,AHNWAXFDVYYQLX-UHFFFAOYSA-N
CCC[N]1C=C(C(=N1)C2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,C6B8C908710F1548_92CFDBCBCD4F0DFE_6041_UN,8.420884,00000000000000000000001000000000000000000010000000001000000000100100000000010001100101110011011010001000100110010011101011101100000001110110001010011111010110101111010,ZLEYVOMBGXPRTD-XLIONFOSSA-N
CC1=C(N=C(N1CC2(F)CCCOC2)C3CCCN3)C4=CC=CC=C4,C86AEC41DCF03CA3_892CB7B7981B786F_6034_UN,8.242252,00000000000000000000000000000000000000100010000000000000010000100110000000010101001101110011000011101000100101011000101011100100110010100110001011011011010111101111110,WEQZXEBEUYENAA-UHFFFAOYSA-N
CN1CCN(CC1)C2=NC(=CS2)C3=CC=C(C=C3)N[C@H]4C6=C(OC5(C4)CCC5)C=CC(=C6)F,07FEBFCAE063D79F_263B814BFCF59D75_6041_UN,7.928137,00000000000100000000000000000000000010000010000100000000010000100110000000010101010101111001010011101100111100011101101011100100110011110110001011011001110011101111110,LNTWFMGPDMTCGD-JOCHJYFZSA-N
N(CC1C3(C12CC2)CC3)C(=O)C4=CC=C(C=C4)C5=CC(=C(C(=C5)F)F)F,A7BA65A354D5CE55_3DD0AD0B5FDBB3D3_6038_UN,7.8139234,00000000000000000000001000000000000000000010000000000000000000100010000000000000001000010001100000001000010100101000011000000100110000100000000011010011011110100111110,KTQMULNIFXIPLG-UHFFFAOYSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)C[C@H]4[C@@H](CNC4)C5=CC=C(C=C5)Cl,88EA932CDB821271_EDE6A28025C109DA_6034_UN,8.624105,00000000000000000000000000000000000000000000000000000000010000100100000000010000101101110011000110101101110101010000001011100100110110100110001001011011010111100111110,NLSSBOGKZZCGBI-LVRVKJESSA-N
CC1=C(C=CC(=C1F)NCC2C3(CCNC2)CCOCC3)C#N,540302EC2394C1E0_1803A7CD37BBDEED_6041_DP,8.086701,00000000000000000000000000000000000000000110000000000100010000000010000000000000101000110011000000101000110101011000001011000000110111110110001011010011010111101111110,WNTMUUJWIGVONO-UHFFFAOYSA-N
CC1(C)[C@H]5CC[C@]1(C)[C@H](OCC4CC2(CC3(C2)OCCO3)CO4)C5,28D400F315EC6740_9489079ECA60E533_6039_UN,6.9216814,00000000000100000000000000000000000000000000000000000000010000000010000010100000000100000000000010000000010011001001101010010011110010000110110100110110110101011001110,KVKYPKPQLWNMLT-MBSQVXIWSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CCOC2(CCCCC2)C3)F)CC4,0482ED33756B220B_0FA8E4C82B0AF836_6041_UN,7.039309,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110011010001101000110111011001101011100000110011110110001011011011110111101111110,KOBLWOIWEGILAV-UHFFFAOYSA-N
N4C[C@@H]3CN(CC1=NN=C(C=C1)NC(CC)C2=C(C=CC(=C2)F)F)C[C@]3(C)C4,470F343DEEE1DDD4_C533E1448E176E2C_6041_DP,8.897272,00000000000000000000000000000000000000100010000000001000000000000110000000010101101101110011001010101100110110011011100011101100110101110110001011001111010110101111010,GSHWNQQMHWIMQK-NUOIPDLJSA-N
N1CC2CCC1CN2C3=CC=C(C=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,88B071B762786E21_AE419B1BF77BD368_6041_DP,7.817237,00000000000000000000000000000000000000000010000000000000000000100000000000010001101101110011010010101000110110010001101011100100110101110110001001011011010010101111010,YIXDWNVONNUUAI-IXFUEQBVSA-N
NC1(C2CCC(C1)CC2)COC3=C(C(=CC=C3)C4CNCCC4)F,DB900A5CFA1067AF_B3F66E03272A10A2_6035_UN,8.284447,00000000000000000000000000000000000000000010000000000000000000100010000000000000001010110011000100101000110101011100001001000011110101100110001111010011110111100111110,YNOOFWLTYWCXLC-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC4CCCN(CC3CC3)C4,39726F8F4659B521_5031A9AB60DD1078_6041_UN,8.446949,00000000000000000000001000000000000000000010000000000000000000000100000000010000101001110011000000101100010100010000001011100100110001110110001011011011010110101111010,WHCGAZRKYRMCPZ-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2=CC=CC=C2)F)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,FE5AD1C3C74580DD_A01CC1613ADFC1C2_7022_UN,8.2283745,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,IEJRRZDIULSZSL-NLFFAJNJSA-N
C([C@]12C[C@H]1COC23CCC3)=CC4=C(OC(C)C)C=CC(=C4)F,9F24CCC76A5C6B88_4E064FB18CC03477_7019_UN,8.035665,00000000000100000000001000000000000000000010000000000000010000000010000000100000000100010000000010110000010101001100001000000011110010100100000111010110110001011011110,JGCBSBZEXUXPKH-YJBOKZPZSA-N
CC1=C(C(=C(C=C1)F)C=C[C@@H]2CCCO[C@H]2C3=NC=C[N]3C)F,738BA00882D9BF88_800CAD670AB93F74_7019_UN,8.7027,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010000010110110000000101000000001011100100100010100100001011011110110011101111110,ZKMCFDSKHMTFFZ-SUMWQHHRSA-N
C[N]1C=CN=C1C(NC(=O)C2C3C4CC2CC34)C5=CC(=C(C=C5)F)F,7AF9E1C0633103A3_342F3A4694C18BD1_6038_UN,8.26966,00000000000000000000001000000000000000100010000000000000000000000100000000010101000101010001110010000000010100100000010011100100110000100100001011001011001010101111110,NQNPTAULNWOUBY-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC4CC3(CNC3)C4,DB0E0F3F20D71023_7B7A0C85B1966756_6041_DP,7.326559,00000000100100000000000000000000000000100000000000001000000000100110000000010101101101100010011010001000010010001000000011101100100101010110001010001111010110101111010,OSNXYFPSQMDISN-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC4CCN(CC2=CC=CC=C2)C3(CCC3)C4,3B50357144AE1993_0F2C3ED1AC8A175D_6041_UN,7.9691477,00000000000100000000100000000010000000000000000000000000000000000110000000110001100001100011010000101000110000011000001011100100110001010110011011011111010110101111010,VNUMTOCAMXCKEI-UHFFFAOYSA-N
O(CC1(CCOCC1)C2CO2)CCN3CCN(C)CC3,76F80D882807D249_410E83448397081F_6039_UN,7.3904276,00000000000000001000001000000000000000000000000000000000010000100010000000010001000001100100010100101000000001011001101011100010110010000110001001111000110101111101110,OHMNKVQLQBIJLV-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1)Br)N2CC3CCCN3CC4CCCN4,4B7DB300C8166450_0125C12FD70ABDBC_6034_UN,8.119488,00000000000000000000000000000000000000000000001000000000000000000100000000010001001101110011000010001100110100010000101011100100110000100110001010011011010110101111010,VESDCSHSHJDHKO-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1)F)N2CC3CCCN3CC4CCCN4,A069DF9616E66684_F0F60BFFAA19B752_6034_UN,8.11948,00000000000000000000000000000000000000000010000000000000000000000100000000010001001101110011000010001100110100010000101011100100110000100110001010011011010110101111010,LBVHAPOHJNHWFY-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NCC3(C)C(OCC3)C4CC4,6EE5003321EE2215_8E547BFD62D51766_6041_UN,8.214184,00000000000000000000001000000000000000000010000000000000010000100110000000000000101100010011000011101100010111001001101011000100110011110110001011010111110111101111110,PMQKBRMUHSHHTA-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)NC2CCCC(C2)C3=CC(=C(C=C3)F)F)C4[C@@H]5CNC[C@H]45,DBC90C5F8EE945B4_D60E9108DDB27BEF_6041_DP,7.9564548,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000110110010001001011100100110101110110001011011011010110101111010,IIPXOJRHXAVXNM-XDOHPFIESA-N
FC1=CC2=C(C=C1)C(=NC=N2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,9DACF7DFCE0BD1F2_0547878310FFCD03_6041_UN,8.476547,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,RJTFQLSWIXKPRA-VLIAUNLRSA-N
N(C1C3CC2CC(CC1C2)C3)C(C4=C(CC)[N](N=C4)C5=CC=C(C=C5)F)=O,E8D348F67884D10E_049E452043578286_6038_UN,7.8466015,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010011101011000100010100110010010011101100100001110100001011001011001110101111110,KAMYVPZBYPCYJO-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NCC2CCCN(C)C2C3=CC=CS3)C4CC4,80738FBDB9810838_803FF3C18BA8F512_6041_UN,8.180817,00000000000000000000001000000000000010000010000000000000000000100000000000010000111101111011010010101000000110010001101011100100110001110110001011011011010110101111010,UMVLWQODJXIPBO-UHFFFAOYSA-N
BrC1=CN=C(N(C1=O)C[C@H]2[C@@H](CNC2)C3=CC=C(C=C3)Cl)C4CCC4,AEC0F5B5FB12B1B9_DD256666CD064903_6034_UN,8.174963,00000000000100000000000000000000000000100000001000000000000000100100000000010100101101110011100011101001000100100100011011100101110000100110001111011011011110100111110,WEHCYTPCNZGSPK-HOCLYGCPSA-N
N1CC4CCC1C(CNC(=O)C[N]2C=CC3=C2C=C(C=C3)F)C4,D246AC0278D46D46_5C39C09F9237B396_6038_DP,7.861737,00000000000000000000000000000000000000000010000000000100000000000100000000010001101101010011100110101100110100110000011011100100110110100110001001011001011110100111110,KPMDYKBDJXYFJG-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=COC4=C3C=CC(=C4F)F,56A8176AF2DE9986_017400DB763931BF_6038_UN,7.9795322,00000000000000000000000000000000000000000010000000000000010000000000000000000000001100010011100010011100110100110000011000000100110010100100000011010011111110110111110,BPMTWVNVLSWFGJ-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=COC4=C3C=CC(=C4Cl)Cl,B044167941B2E72B_4753B2AA845172F7_6038_UN,7.9795246,00000000000000000000000000000000000000000000000000000000010000000000000000000000001100010011100010011101110100110000011000000100110010100100000011010011111110110111110,HWPYUAWVHGCRKL-UHFFFAOYSA-N
FC2=C1CCCC1=CC(=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,71255154E380CE5F_2A9FD09D3D928680_6041_UN,7.779129,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,VBGVRCOIQVXKBX-ZHRRBRCNSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CC34CCSCC4,21CE8C793935E4D9_2A4E0F577F6BF089_6041_UN,7.470659,00000000000000000000001000000000000010100000000000000000000000000110000000000100001000101011000000101100010010001000001011000100110001010110011011010111010110101111010,FZSHZOMVWJGRAQ-UHFFFAOYSA-N
FC2=C(C=C1C=CC=CC1=N2)NCC3N(C)CC4(CC3)CCC4,1BE3BED158487844_1D7AC751BD55269D_6041_UN,7.8302684,00000000000100000000000000000000000000000010000000000000000000000110000000010001001001110011010000101100010110011001101011100100110001110110001011011011010110101111010,FLLBNTPMFLJRNF-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2CCCC(C2)C3=CC(=C(C=C3)F)F)C4CCCC4,434B32395ACC2B84_D151DD32065F9640_6041_UN,8.58757,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011011010000000100100010000001011101100110001110100001011011011000010101111010,VPJVJKAEHPZHPW-UHFFFAOYSA-N
FC1=C(C=CC(=C1)NCC[C@@H]2CC[C@H]3C[C@@H]2C3(C)C)OC4CCOCC4,AFA1A92ED9CCF82A_D7F2D7A65829747F_6041_UN,7.6606774,00000000000100000000000000000000000000000010000000000000010000000010000000100000001000110101000000101000110111011100101000000011110011110110000111010111110111111111110,NYYSFWSKOHHAPT-BXWFABGCSA-N
C[N]1C=CN=C1C(NC(=O)CC2CC3CCC2O3)C4=C(C=C(C=C4)F)F,70FCD538D1E1FEE8_5956F0DF96D48712_6038_UN,7.823704,00000000000000000000000000000000000000100010000000000000010000000100000000010101000101010001110010000000110100110000011011100100110010100100001011011011101111111111110,RFFBJDBNHGQUJJ-UHFFFAOYSA-N
C1(=CC2=C(C=C1)CC3CCC(C2)C3=O)NC4=CC(=CC(=C4)F)C#N,814C0663A4C4E73E_A2DBE57F62F261EC_6041_UN,8.302129,00000000000000000001000000000000000000000110000000000000000000000000000000000000000000010001000010000100010100000000001000000101110001110000001111010001101010100111110,YFUOYBRPORPYIY-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CCCC3=C2N=CC=C3)F,EA75017EA106A1A5_B3CE885A8B78BB41_6041_UN,7.460639,00000000000000000000000000000000000000000010000000000000000000000100000000100000101001110011010000101100010100000001001001100100110001110110001011011111010110101111010,UTNLEUXMLQIIMA-UHFFFAOYSA-N
C1(=NC4=C(C(=C1)C2=CC=CC=C2)C=C3OCCOC3=C4)NC5=C[N](C[Si](C)(C)C)N=C5,981C9BF83AF24402_21D8037600B03DF9_6041_UN,8.003959,00000000000000000000100000001010000000100000000000001000010000100100000010110101100100100001011011101100010001011101001011101100000011010110011011011101110111111111110,LQBKLZUJIQVCRA-UHFFFAOYSA-N
CN6CCC(CNC(=O)C4C1C2CC5C3CC(C1C23)C45)C6C7=CC(=C(C=C7)Cl)F,E5FF10E48C3139FB_C9E90EF3BA624402_6038_UN,8.56671,00000000000100000001000000000000000000000010000000000000000000100000000000010000101101110011110010001101010110110001111001100000110000100110001011011011011110101111110,ATUZFYAWXOOGMK-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4(CCCCC4)C5=C(C(=CC=C5)F)F,EBA2210436D51BE6_34AAD80C9CE376D2_6041_DP,8.156925,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010010101111010,WKAWJMKRXJFJQC-YLQYIJTPSA-N
FC1=CC(=C(C=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)C=C,E2C2EA71F261FF57_DF0D18A06F4E22EF_6041_UN,8.288509,00000000000000000000001000000000001000000010000000001000000000100100000000010001101101010011011010111000000100010000001011101100110001110110001011011011010110101111010,NDHNGGIJTSFTDX-IERDGZPVSA-N
N1CCCC2=C1C=C(C(=C2)NCC4=CC=C(CN3CCCN(C)CC3)C=C4)F,C77475B27655BDC4_D8A9E3E7E0C93A67_6041_DP,7.226665,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010000101100110110010001101011100100110101110110001011011011010110101111010,PLVIRYMRPRKBDV-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC[C@@]34CCCN[C@H]3CCCC4,14D6B02D8D8B00A7_3B3E5E7F89FCDC71_6041_DP,7.166582,00000000000000000000000000000000000000100000000000001100000000100110000000010101101101000011011010101100110010011000001011101100110101010110001011011111010110101111010,SBXSGNQHFPHQRN-AZUAARDMSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC5(CC4=C(C=CC=C4F)F)CCCC5,2E495E41577B26A8_8E547616395A17FC_6041_DP,8.495041,00000000000000000000001000000000000000100010000000000000000000000110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010110101111010,DKMHYUXIROANLF-GWTOYCKXSA-N
CC1=C(C(=C(C=C1)NCC2CNCC(O2)(C)C)F)C#N,0ECBA9BEF3E46D57_06DFF5D43EA4F511_6041_DP,7.991564,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110011011000111110111101111110,FEGLTXWCBCKLPO-UHFFFAOYSA-N
FC2=C(C=C1C=C[NH]C1=C2)NCC3C(CC)CCCC3,5FB278C03715D6A1_856CAFA8DBB41354_6041_UN,8.594334,00000000000000000000000000000000000000000010000000000000000000000100000000000000001100010011000010001100010110000010101001000100110101110100001011010011010110101111010,JUEOUHXJRRNCPH-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCC2(CCC3(CC2)OCCO3)C4=NC=CC=C4,96BB13D80BC82BD3_69001CB339C79B54_6041_UN,7.9626913,00000000000000000000100000000010000010000000000000000000010000100110000010100000111100101011010010101000010001001000001011010100110011010110011011011111110111111111110,VJNPRDYVBYHCPS-UHFFFAOYSA-N
C2(=C1OCCCOC1=CC(=C2)C#N)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F,AE0082F220E51790_872A6518B0171471_6041_DP,8.008479,00000000000000000001000000000000000000000110000000000010010000100000000010000001001000110111000101101100110101010100001011000100110111110110001011010011110011110111110,HANXLRCJFZMYHJ-DNVCBOLYSA-N
C1(=CC2=C(C=C1)[N](N=C2)C3CCCCO3)NC4=C[N](C[Si](C)(C)C)N=C4,CA14E5DF92B260A3_D86B97409BD9A89C_6041_UN,7.709547,00000000000000000000100000001010000000000000000000001000010000100100000000110001100100100001111110101100010001111001011011101100111011010110011001011101010111101111110,OZCCUDIUYZYOHZ-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2C[C@H]3C[C@H](F)CN3CC4=CC=CC=C4)C5=CCNCC5,38A2161CA37BE052_7FE5C6C0B99A09D0_6034_UN,8.663435,00000000000000000000000000000000000000000010000000100000000000100100000000011001001101110001000010111100110100010000001011100100110000100110001001011011010110101111010,MFHBVBCEAVGNRS-XZOQPEGZSA-N
CN1CCCCC1CCOCCC3COC2(CCCC2)O3,5DF861D73A103DA4_3FD56BB3035C4BAB_6039_UN,7.121435,00000000000000000000000000000000000000000000000000000000010000000000000010010000000101100100010011101000010011011001101011110010110010000110000000111010110111111101110,OPTVULXTVDSRKQ-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC=C2NCCC3CCCN(C)C3,A4E58B1668C743F6_AFA32057F12DFDC4_6041_UN,8.377641,00000000000000000000000000000000000000000010000000000100000000000100000000010000101101110001010010101100110110010001101011100100110101110110001011011011010110101111010,AVCQGLPZEBQMHR-UHFFFAOYSA-N
CC4=CC1=C(C=C(C=C1C)NCC2(CCCO2)C3CC3)[NH]4,C4EF3376FCD74701_CDC004B8AF22FD4B_6041_UN,7.483984,00000000000000000000001000000000000000000000000000000100010000100110000000000000101100000011000110001100010001001000001011000100110111010110001000010101110111101111110,JQALKTCYGYVDCT-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)N[C@@H]2C3=C(CCC2)C(=CC(=C3)F)F)[C@H]4C[C@@H]5CC[C@H](C4)N5,F5580DD841A58962_640C77709A2B40BB_6041_DP,8.022526,00000000000000000001000000000000000000100010000000000000000000000100000000000101100101110011010010101100110100010001101011100100110101110100001011011001010110101111010,NXJOGDZALGBHKQ-UTAOTPEMSA-N
FC1=C(C(=CC(=C1)NC[C@@H]2CNCC(O2)(C)C)F)C#N,3739B6FCF9DA49D5_94C74C523561AF5E_6041_DP,7.955258,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110001011000111110111101111110,SIZLIANDSPDOMD-JTQLQIEISA-N
C(C[C@]12C[C@H]1CCC2)=CC3=C[N](N=C3C)C4=CC(=CC=C4)F,E9C6A537B6C50C6C_143F1F73F0B33599_7019_UN,8.283495,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011010000110101111010,KNIQCYGSWFWCRO-APWZRJJASA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3(CCCN(C)C3)C)Cl,94D04FF049924DB2_4D9152CCC215F66F_6034_UN,8.105224,00000000000000000000000000000000000010000000000100000000000000000110000000010110110101111011010010101001001110011001101111100100110001110110011011011111010110101111010,WNENBCPRCJBBSZ-UHFFFAOYSA-N
NCC1=CC2=C(C=C1)C(=O)C=CN2CC3(CC3)C4=C(C=CC=C4)Br,AFC7C668051F8B6B_288234E759125307_6034_UN,8.876592,00000000000000000000001000000000000000000000001000000000000000100110000000010000001011010000000001101100010100001100000001100101010000100110001111011011111110100111110,ASHQEOPUDUXOFX-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(C3=C(CC)C=CC(=C3)F)=O,D334A1739199C2C3_C8B2A859DEF88C44_6038_UN,8.032983,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010001100010001000110100110010011000000000110000100000000011010011011110101111110,OQPCMJIYWKXCNZ-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CCCC3)C4=CC=C(C=C4)F,FB5653E5B52C9A60_81393FBADB35BCFC_6041_UN,7.7442517,00000000000000000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001001011011010110101111010,PFRKNEZUVJZNBR-FQEVSTJZSA-N
CCNCC1=CC2=C(C=C1)N(C=C2)CC3CC3(C)C4=NC=C(C=C4)F,619138C0B698F92A_36092C0ADA08D03F_6034_UN,8.241148,00000000000000000000001000000000000000000010000000000000000000100110000000010000001101110000000010101100010110001011100011100100010000100110001001001111010110101111010,AFZZLXQZGLZJLI-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(C)CCCC2)F)CC3,F902AC57391AD7D9_EEF910E8ED96E1A4_6041_UN,7.830187,00000000000000000001000000000000000000000010000000000000000000000010000000010001101001110011010010001000000110011001101011100000110001110110001010011111010110101111010,GEJCIRBPXWGCAS-UHFFFAOYSA-N
CCN1C(CC2=C1C=C(C=C2)F)C3=NC=CN3C[C@H]4[C@@H](CCNC4)C5=CC=C(C=C5)F,D50C811E95FE3475_B791630C2EB17351_6034_UN,8.067772,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101100110110010010001011100100110000110110001011011011010110101111010,ORCQSZRKLQLMDK-XUPADYDASA-N
CCC2=C1N(C=C(C1=CC=C2)C3CCNCC3)CC4(CCNC4)C5=CC(=CC=C5)F,D6509E419546F4D5_F42FFD052AC322F7_6034_UN,8.333563,00000000000000000000000000000000000000000010000000000000000000100110000000010000101101110011000010101100110100011010001011100100110100100110001001011001010110101111010,FHAMZQMTJKGAPX-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=NC=C2NCC3CCCN(C)C3C4=CC=CS4,3171C8CFFA403D8B_1047331C21621622_6041_UN,8.622366,00000000000000000000000000000000000010000010000000000000000000100100000000010001111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,CZAXJQINRBXUKT-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CCOC2(CCSC2)C3)F)CC4,43A4345462914486_2A1700D405C4EBAC_6041_UN,7.0677814,00000000000000000001000000000000000010000010000000000000010000000010000000010001100101111011010011101000110111011001101011100000110011110110001011011011110111101111110,ONWZYJDYYRHWTE-UHFFFAOYSA-N
CC2=C1N=CC=C(C1=C(C=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5)F,9FA707829343E2B3_306F22204402314A_6041_UN,7.9557753,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011111010110101111010,HKIVTEFFJOCLSJ-MWTRTKDXSA-N
FC1=NC2=C(C=C1)C=C(C=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,B776F2AF5D4FF00D_2A9F8DE6CD35866E_6041_UN,8.531548,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,YJOBQSICDYHTMS-ZHRRBRCNSA-N
CC1=C(C=C(C=C1)F)NC2CCN(C)C23CCCNC3,AA90C8B72D4924C3_2C8D46928E6AFA9F_6041_DP,7.875849,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101110011010010101000110110011001101011100000110101110110001011011111010010101111010,RAXQZQIHPVNMFM-UHFFFAOYSA-N
CCNC5CCC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3=CSC=C3)C=CC(=C4)Cl)C5,F8C05B5561582964_069FF5F9F6D56A74_6034_UN,7.584904,00000000000000000000000000000000000010000000000000000000000000100100000000010000101101111011000010001101110110010010001011100100110101100110001011011011010110101111010,YCHFNKFFXHDSFF-PGHIUSFISA-N
CC1=C(C=C(C=C1)Cl)NC2CCN(C)C23CCCNC3,2EC54B0F5F87D663_3705387AF4FDBEE8_7022_DP,7.8758373,00000000000000000000000000000000000000000000000000000100000000000010000000010001101101110011010010101001110110011001101011100000110101110110001011011111010010101111010,WGDOXENUVLRMSE-UHFFFAOYSA-N
N(C1C2CCCC1CCC2)C(=O)CCC3=CC(=C(C=C3)Cl)F,0DE20391891C2531_C39BDDD09BA243F3_6038_UN,7.3738923,00000000000000000000000000000000000000000010000000000000000000000000000000000000000000010011100000000101110100110000011000000000110011100000000011010011001110100111110,VQHJDKFFNGLXIC-UHFFFAOYSA-N
N(C1C2CCCC1CCC2)C(=O)CCC3=CC(=C(C=C3)Br)Cl,ED38D984D75C4BB5_A89FFB4CCD3B41E0_6038_UN,7.373881,00000000000000000000000000000000000000000000001000000000000000000000000000000000000000010011100000000101110100110000011000000000110011100000000011010011001110100111110,KTZBYQIXSVMRND-UHFFFAOYSA-N
N(C1C2CCCC1CCC2)C(=O)CCC3=CC(=C(C=C3)Cl)Cl,86D69E01F9D0B205_D2C666590EC808A8_6038_UN,7.3738747,00000000000000000000000000000000000000000000000000000000000000000000000000000000000000010011100000000101110100110000011000000000110011100000000011010011001110100111110,YGISWTRPLGMJQJ-UHFFFAOYSA-N
CN6CCC1=C(C5=C(N1CC2CC4(C2)CC3(CCC3)C4)C=CC(=C5)Cl)C6,2D53DA954685998C_1C1F8611116F3280_6034_UN,7.0371847,00000000000100000000000000000000000000000000000000000000000000000110000000010000100101110000010010101101010100011001101011100100110000100110001011011000010110101111010,FYYPNRQTGUZJBJ-UHFFFAOYSA-N
N3CCC(OC2=CC=C(CNCC1N(CC)CCC1)C=C2)CC3C4=CC=C(C=C4)F,30AE37D0D9A40043_66BEC70CB91C955B_6035_DP,8.513658,00000000000000000000000000000000000000000010000000000000000000100000000000010001001101110011000011101000100110010110101011100111110110100110001101011011110111101111110,BFLSUIHYTIKUTQ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC(CC)C2CCCCO2)Cl)C3CC3,69CF62537A29A3E8_FC6D90526F8AF609_7022_UN,7.887708,00000000000000000000001000000000000000000000000000000000010000100000000000000000000000010011000100100001100111010010001000000000110011110100000011010111110111101111110,PSIKLRIHIFWYGE-UHFFFAOYSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC2=C[N](N=C2)CC3=NN=C4CCCC[N]34,99D087F4BFE0D684_8055263A967E2730_6041_UN,8.100539,00000000000000000000100000000010000000100000000000001000000000000100000000110101100101100011011010101100010000011001001011101100111001010110011011011111010110101111010,DZCDJQKKHVSJNR-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)OCCC2)[S](C4=C3[NH]C=CC3=CC=C4)(=O)=O,331BCF02A1254D4E_AFE11ACE43508980_6029_UN,8.800513,00000000000000000000000000000000110000000000000000010101011111001101010001000000111100001000001011101110011001001100011011001100101110001110001011111001110111110111110,PPDHBDILCDCRAY-UHFFFAOYSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F)C5,14A5896E04878D88_A2A12A44B744A186_6041_DP,7.9228086,00000000000000000000000000000000000000000010000000000010000000100100000000010001101101110011010010101100110100010001101011100100110101110110001011011011010010101111010,LJTXXWYMXNWUSD-WAIKUNEKSA-N
C1(=C(C2=C(C=C1)OCO2)F)NCCC3CC(C)CC(C3)(C)C,3FFE611C6B0B26F1_2BBC9CE5764CCE59_7022_UN,8.313432,00000000000000000000000000001000000000000010000000000000010000000010000010100000001100010001000011001100110111011101001010010000110001110110010011010111110111111111110,KIDGBYGEWMEABJ-UHFFFAOYSA-N
C2(=C1CCOCC1=CC=C2)NC3=C[N](C[Si](C)(C)C)N=C3,941DD58D8C6312B5_30E6F0C2898B5E74_6041_UN,6.7940984,00000000000000000000100000001010000000000000000000001000010000000100000000110001100100100011011010101100010001011001001011101100110011010110011011011101010111101111110,OWSSBMLVNLLBDX-UHFFFAOYSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3CCN(CCC)C3)C4,FE45A44B884BC668_91387ADEFBCD0A19_6041_UN,8.02183,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101100011010010101100110010010011101011100100110101010110001011011101010110101111010,IIJWSLALFIOHPU-UHFFFAOYSA-N
FC2=C(C=C1C=CC=NC1=C2)NCC3N(C)CC4(CC3)CC4,C4D4B9FABD0917C8_5DFBAFA39836093A_6041_UN,8.174102,00000000000000000000001000000000000000000010000000000000000000000110000000010001001001110011010000101100010110011001101011100100110001110110001011011011010110101111010,GBXVEWGEIFUBOW-UHFFFAOYSA-N
N4CCCC1=C(C=C(S1)NC2=CC(=C(C=C2)N3CCCCCCC3)F)C4,00FD037F03F9A8D8_5904A89ABF2001D5_6041_DP,7.4189963,00000000000000000001000000000000000010000010000100000000000000100000000000010000011101111011000010001100110100010000001011100100110101110110001010011011010010100111010,YAAHKDVWVJSVAP-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCCCC23CCCNC3)F)CC4,DA9FBA4312D0A641_FB4CB30DE622F169_6041_DP,7.4174294,00000000000000000001000000000000000000000010000000000100000000000010000000010001101001110011010000101000110110011001101011100000110101110110001011011011010110101111010,UQYSFGYPBGDZST-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2O[C@H](CC2)C3=CC=CC=C3)Cl)C4CC4,B3782D52DFF557A5_98ED3D0AFCB63115_7022_UN,8.011667,00000000000000000000001000000000000000000000000000000000010000100000000000000000001100010011000110001001000110000000001000000100110011110100000011010011110111101111110,VCGIANSTGXLSAV-DYESRHJHSA-N
C[Si](C)(C)C1=C(C=CC=C1)NC3=CC2=C(CCCN2)C=C3,98BAB7DDEBF90C6E_AE17C74B400D611E_6041_DP,7.6750946,00000000000000000000100000000010000000000000000000000100000000000000000000100000101000100011010000101100110000011000001001000100100101010100011011011111010010101111010,MZRRMWHYDFMCNR-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC23CCCNC2CCC3,DAAE7FDB6312EE2D_20544B212C4047C0_6041_DP,7.7856474,00000000000000000000100000000010000000000000000000000100000000000110000000100001101000100011010010101100110000011000001011000000110101010110011011011111010110101111010,ADALKCRBWAOPBC-UHFFFAOYSA-N
NCCCC(OC1=CC2=C(C=C1)N=CC3=C2CCCC3)C4=CC=C(C=C4)F,373C67DA21399DA7_70D29B061930557A_6035_UN,8.101172,00000000000000000000000000000000000000000010000000000000000000000100000000000000001010010010000000101100110100010100001001000111110010100100001111010001110111100111110,LTCONLFCQPOSIL-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2C[C@]34CNC[C@H]3CCCC4,88B8FAA7BBE264A2_202AA243D192DAC5_6034_UN,8.511563,00000000000000000000000000000000000000000000001000000000000000000110000000010000101101110011000010001100010100001000101011100100110000100110001011011111010110101111010,GFYDHIJSTHDGQY-BEFAXECRSA-N
CC4(C)OC1=C(C=C(C=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C=C4,44BC999AD88D342F_55A164FBE9A300D6_6041_DP,7.8952737,00000000000000000000000000000000000000000010000000000100010000100010000000100000101000110011000000111100110100011100001011000100110101110110001011010111110111101111110,LBNILXWTQJVTQQ-GHTZIAJQSA-N
FC1=CC4=C(C(=C1)NC[C@@H]2CCN(C)[C@H]2C3=CN=CC=C3)OC=C4,D08DAC3193EF484C_F1F52F1DAC92870D_6041_UN,8.938109,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011010110101100010110010001101011100100110001110110001001011011110110101111110,BROXLPVSJJHHKG-YJBOKZPZSA-N
C(C1CC2CCC1CC2)=CC3=C[N](C)N=C3C4=C(C=C(C=C4)F)F,22D57B8676F6131B_B203E414B1F0E415_7019_UN,8.387455,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010000010100000000001011101100110000100100001011011010000010101111010,LYSUNNLGFOGRCO-UHFFFAOYSA-N
O(C(=O)[C@@H]1[C@H]2C[C@@]1(CC2)C3=CC=C(C=C3)C(F)(F)F)CC4C=CCN4,442E2461CD44A468_B2F03291AC3E00CA_6031_UN,7.8213515,00000000000100000000000000000000000000000010000000000000000000100010000000000000001100000001000110011000111101011000001001010010110000100110000000010011011111110111110,OEWYXDSJZVZTBH-IXDVWKHKSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC3(CCCCC3)C4CCCCC4,078D7F54E812E535_01C8FC3C29D3A66C_6041_UN,7.737691,00000000000000000000000001000000000000000010000000000000000000100110000000010101001101010011010010001100011110001000001011100100110001110100001011011011010110101111010,YGWUPMKBBPQHRX-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3(CCC)CCCN3)Cl,650F02C12583D3E0_E0CA343B29165755_6034_UN,8.121539,00000000000000000000000000000000000010000000000100000000000000000110000000010111011101011011000010001001101110011011001111100100110101110110001010011111010110101111010,NDVRVCGJNJUXQA-UHFFFAOYSA-N
C[N]2C=C1N=CC(=CC1=N2)NCC(N3CCOCC3)C4=C(C=CC=C4)F,E65235313DB0B1F5_993E5E53AC4DECAE_6041_UN,7.7549634,00000000000000000000000000000000000000000010000000001000010000000100000000010001101101110001011110101100010101010000001011101100110011110110001011011011010111101111110,GWAWGHFEWOILLZ-UHFFFAOYSA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CC4=C[NH]C5=C4C=CC(=C5)F,55417AEEFDB33FC8_9D5FCCFB6AD85DB4_6038_UN,7.415252,00000000000000000000000000000000000000000010000000000000000000000100000000000000000100010011100010000100110100110000010001000100100111100100001001000001001110100111110,GVTLYVKXXNUKPF-UHFFFAOYSA-N
C(CN1CC2CCC(C1)O2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,432936FDA289C811_B9CED884225AD93C_7019_UN,7.898017,00000000000000000001000000000000000000000010000000000000010000000000000000010000000101110000010110111000010110010000101011100000110011110110001011011010110111101111110,PKLQMNOVQPMWLE-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NC2=CC3=C(N=C2)CCOC3,501F1B60D76D79FB_0BF06583FDBA4316_6041_UN,7.25069,00000000000000000000100000000010000010000000000000000000010000000100000000100001010100101001010011100100010001011000001011000100110011010110011011011111010011101111110,PAVFNBKUUNFLPB-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)F)CC#N)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F,A8EFF74379FBA3B8_7FD95FF7F79B9476_6041_DP,8.168518,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,GQOSXXVISGPJJU-KZULUSFZSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCN(C)C3C4=CC=CS4,9A22086C4A73B805_81244E9076844666_6041_UN,8.176053,00000000000000000000000000000000000010100010000000000000000000100100000000010100111101111011010010101100010110010001101011100100110001110110011011011111010110101111010,DKUXZNNXSBEDAX-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,E0BB17D5F7C38708_A9754C4BF2709900_6041_UN,8.4864435,00000000000000000000000000000000000000100010000000000000000000100100000000010101100101110011010010101000100110010001101011100100010001110110001011011111010010101111010,JMZGMJDRXIYXKO-DYXWJJEUSA-N
CN(C)CC1=C(C=C(C=C1)NC[C@H]3O[C@H]2CCC[C@@H]2NC3)F,A6439448423EF141_124B943B9BFDEE56_7022_DP,7.6725607,00000000000000000000000000000000000000000010000000000100010000000000000000100000101001110011010110101100110100010001001011100000110111110110001011011111110111101111110,OPQBRDXTEKXXEK-PVAVHDDUSA-N
NCC2=NC1=C(C=CC(=C1)Cl)N2C[C@H]3[C@H](CC(C)(C)C)CNC3,D7D8752A3245E3BF_B88848F97197F4B8_6034_UN,8.126215,00000000000000000000000000000000000000100000000000000000000000000110000000110101101111110011000010001101010110011001000011100100110100100110011010001111010110101111010,XIFUIHOUDGNEQN-OLZOCXBDSA-N
NCC2=NC1=C(C=CC(=C1)F)N2C[C@H]3[C@H](CC(C)(C)C)CNC3,DB68AB1D5F5EE1D9_50AC2A98467836AC_6034_UN,8.126215,00000000000000000000000000000000000000100010000000000000000000000110000000110101101111110011000010001100010110011001000011100100110100100110011010001111010110101111010,ZNOISDNAFXBKMT-OLZOCXBDSA-N
FC2=C(C=C1C(=CC=NC1=C2)NCCC(C3CC(C)(C)OCC3)CC4=CC=CC=C4)F,A64B63BCE278CE6C_9B52385D4A82D273_6041_UN,8.196165,00000000000000000000000000000000000000000010000000000000010000000110000000100000101000010001000000101100110111011001101011000100110011110110001011010111110111101111110,UCCKWMORYMOPKD-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=C(C=C3C(=C2)CNCC3)F)C4,21A7F9A219309588_1F52F7C20F35B848_6035_UN,7.977483,00000000000000000000000000000000000000000010000000000000000000000000000000100000001001110001010011101100110100010101001001100011110000100110001111011111110101101111110,KXERXIXWQVFPCB-QMYADUOMSA-N
C[N]1N=C(C=C1NCC2=C(C=CC(=C2)C3OCCO3)F)C4CCCC4,4AD1896888B6AF3A_6373130E5A8A9234_6041_UN,7.7571726,00000000000000000000000000000000000000100010000000001000010000100100000010010101101100010000011010001000000111000000001011111100010011110110001010011011010111111111110,AIHFFENMPDYVQB-UHFFFAOYSA-N
N(C1=CC=C(C=C1)N2CC3CCC(C2)O3)C(=O)C=CC5=C4C=CC=CC4=C(C=C5)F,8224E1108495E95D_859E2CB516304289_6038_UN,7.773775,00000000000000000001000000000000000000000010000000000000010000100000000000010000000101110000100110111100010100100000011011100100110011110110001001011001111011110111110,XKWINBVQHHLFAC-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NCC2=C(C=N[N]2C)C3CCC3,DC3801C31273FCE5_90A028FD1D0825F9_7022_UN,8.374292,00000000000100000000000000000000000000000010010000001000000000100100000000010001101100010000011010011000000100010000101011101100100000100100001010011011010110101111010,BNWPWCKJERSAOB-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C3=NC(=C(C)C=C3)F)=O,CF35393E4D0ACF30_ED54951A3090EBBA_6038_UN,8.095684,00000000000000000000000000000000000000000010000000000000010000000100000000000001001100010001100110101000110100110000011011000000110010100100001011010011111111111111110,OHNRNHVGJVGNSZ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CCCN(C)C3C4=CC=CS4,C3D6FB426F86BF7E_059F230C453D3D63_6041_UN,8.425855,00000000000000000000000000000000000010100000000000000000000000100100000000010100111101101011010010101100010010010001101011100100110001010110011011011111010110101111010,JYGUXNZBNAWDRE-UHFFFAOYSA-N
C[Si](C)(C)C1=C(N=C(C=C1)NCC2=CC=CC3=C2CCCN3)F,7072C951B6E3C92B_9F3950A55B9F6AF3_6041_DP,7.103599,00000000000000000000100000000010000000100010000000000000000000000100000000100100001000110011010000101100110100011000001011000100110101110110011011011111010110101111010,USGHCHMDAWISCB-UHFFFAOYSA-N
FC1=C(C=C(C=C1)CC=C)N[C@H]3CC[C@@H](N2CCN(C)CC2)CC3,2B2C62C8472F7030_A9D103E1C00B5D56_6041_UN,7.7780247,00000000000000000000000000000000001000000010000000000000000000100000000000010001000001110011010000111000100100010001101011100000110001110110001011011011010110101111010,ZOYZSXPIOFJHNS-HDICACEKSA-N
CC1=N[N](C(=C1)NC(CC)C2CC3CCC2C3)C4=CC=C(C=C4)F,A980B8607E8708BD_27E5AE8E7784EC7E_6041_UN,8.195929,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011001010000000110110010010001011101100110001110100001011011111000110101111010,YQPMQLVNCFEMAM-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NC[C@@]23CCCN[C@H]2CCCC3,4B0CDCC2F0DC76F4_59F92AB1485754A2_6041_DP,7.698565,00000000000000000100100000000010000000000000000000000100000000000110000000100001101000100011010000101100110000011000001011000000110101010110011001011101010110101111010,OVNDJVWRYXAGDA-VQTJNVASSA-N
FC1=C(C2=C(C=C1)CCC2)N[C@H]4[C@H](C3=CC=N[N]3C)OCC4,7B89ED486C74B607_3393DA7BBCC9423E_6041_UN,8.0487,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111000100110101010000001011101100010011110100001010011011110011101111110,RIZJIFPVDXKESN-RHSMWYFYSA-N
N(C1C2CCC(CC1)C2)C(=O)CC3=CC(=C(C=C3)Br)Br,72C1A7F1CBB33BF4_0D3E12044218B6AD_6038_UN,7.386034,00000000000000000001000000000000000000000000001000000000000000000000000000000000000000010011100010000000110100110000011000000000110011100000000011010011001110100111110,NKWLDLDKURWRSK-UHFFFAOYSA-N
CC1=C(C(=NC=C1)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,38CEF9E80E4BE8C1_EAD1201399D05218_6041_UN,8.200586,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000110010000001011100100110001110110001011011111010110101111010,IMNHGBPDOBUGCB-KDOFPFPSSA-N
N(C1C2CCC(CC1)C2)C(=O)CC3=CC(=C(C=C3)F)Cl,BBDC569F1B696A94_9FF263C66BA3D468_6038_UN,7.386023,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000010011100010000001110100110000011000000000110011100000000011010011001110100111110,BGGGOPFXCQQPCP-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CC3=CC(=C(C=C3)Cl)Cl,F4D8E5299B54DBC5_5A1CF566329DE0DF_6038_UN,7.386027,00000000000000000001000000000000000000000000000000000000000000000000000000000000000000010011100010000001110100110000011000000000110011100000000011010011001110100111110,ADDWJBBAHMLZAG-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CC3=CC(=C(C=C3)Cl)F,83C2216FCFA04A02_FAFEB1B8DE6BB157_6038_UN,7.3860207,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000010011100010000001110100110000011000000000110011100000000011010011001110100111110,HPMTZDNPSKWPSX-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CC3=CC(=C(C=C3)F)Br,41EAEC9D42515B23_9641DA6AB474B342_6038_UN,7.386024,00000000000000000001000000000000000000000010001000000000000000000000000000000000000000010011100010000000110100110000011000000000110011100000000011010011001110100111110,VSKZEICEQALHQI-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CC3=CC(=C(C=C3)I)Br,C8731927BA37272E_888CAEF170B7F8F6_6038_UN,7.386024,00000000000000000001000000010000000000000000001000000000000000000000000000000000000000010011100010000000110100110000011000000000110011100000000011010011001110100111110,DHXSCSJPDZFOLI-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CC3=CC(=C(C=C3)Br)Cl,5F57860F7A2E8BF6_4B9B781808AA4092_6038_UN,7.3860197,00000000000000000001000000000000000000000000001000000000000000000000000000000000000000010011100010000001110100110000011000000000110011100000000011010011001110100111110,ZQAYKWPYVUFTIH-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CC3=CC(=C(C=C3)Br)F,0B6BC6BE97AF27AC_9FB3A9B2754A7557_6038_UN,7.3860154,00000000000000000001000000000000000000000010001000000000000000000000000000000000000000010011100010000000110100110000011000000000110011100000000011010011001110100111110,BDJWYEYIOBCVOR-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CC3=CC(=C(C=C3)F)F,77C699CE40F503A8_D2AF6D3E000A372B_6038_UN,7.386009,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000010011100010000000110100110000011000000000110011100000000011010011001110100111110,KXEATBZBNXULPG-UHFFFAOYSA-N
CC1=C[N](N=C1)CC2=C(C=C(C=C2)NCC3N(C)CC4(CC3)CC4)F,ECB7299F321FB20B_35A7D91F29BBC26F_6041_UN,7.8074102,00000000000000000000001000000000000000000010000000001000000000000110000000010001101101110011011010101000010110011001101011101100110001110110001011011111010110101111010,DHDBNZBIKHZNTB-UHFFFAOYSA-N
C(CC1CCOCC1)=CC2=C[N](C)N=C2C3=C(C=CC(=C3)F)F,4E5EB3659A8FD409_48526F74F7075736_7019_UN,7.904477,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100110000011010110000000101000000001011101100110010100110001011011010010111101111110,DCJZWMMWVRRWMC-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3COC2(CCCCCC2)O3)F)CC4,1D85025DFEB2B48F_0D687667540100EA_6041_UN,6.8399982,00000000000000000001000000000000000000000010000000000000010000000000000010010001101101110010010111001000010111011001101011110000110011110110001010011011110111111111110,YYHZQRWRTWZMPU-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)N(C=N2)CC3(CCNC3)C4=CC(=CC=C4)F)C,CAF84E1CC45E334E_25794D87E4301BF6_6034_UN,8.321842,00000000000000000000000000000000000000000010000000000000000000100110000000010101101101110011000010001100110100011000001011100100110000100110001011011111010110101111010,OOBWJSVFHPIGFM-UHFFFAOYSA-N
N2CC[C@@H]1CN(C[C@@H]1C2)C3=NC(=NC=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,B1A9976F63D8FF0E_EB9AF7E4A235A4C1_6041_DP,8.630977,00000000000000000000000001000000000000100010000000000000000000100100000000010101101101110011010010101100111110010001101011100100110101110110001001011011010010101111010,WBLWJVUJLNQNCZ-FKPGQJDZSA-N
N(C1=CC=C(C=C1)C24CC3CC(CC(C2)C3)C4)C(=O)[C@@H]5CCO[C@H]5C6=CC(=C(C=C6)Cl)F,D35352BD8DA05423_7296AF8D201D4D04_6038_UN,7.59709,00000000000000000000000000000000000000000010000000000000010000100010000000000000000100010111100011000101010101101000011000000100100011110100000011010011111011110111110,UPXUUWOYPDSHEX-OSNHUQGQSA-N
N(C1=CC=C(C=C1)C24CC3CC(CC(C2)C3)C4)C(=O)[C@@H]5CCO[C@H]5C6=CC(=C(C=C6)F)F,5D77DA78DB417EB9_11034EAF25F8B481_6038_UN,7.597082,00000000000000000000000000000000000000000010000000000000010000100010000000000000000100010111100011000100010101101000011000000100100011110100000011010011111011110111110,WMONXLCXQUZFCE-OSNHUQGQSA-N
CC1=CC(=C(C(=C1)F)NCC23COC(C)(C2)CCC3)F,F32DB58EB39B3E5B_A579F434503FA941_7022_UN,8.409192,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100010011000011001000010111001001101000000000110011110110000011010111110111101111110,CPYBJEUJOWLBHJ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=NC=C2NC4C[C@H]3CCC[C@H](N3C)C4,3C473492529FD4B2_EFB0C34115984832_6041_UN,8.266973,00000000000000000000000000000000000000000010000000000000000000000100000000010001100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,XCNRMOCOIXQXGZ-MQVJKMGUSA-N
CC1=C(C=C(C(=C1)NC2=NC(=N[N]2C)[C@H]3CCCN3)Cl)C4CC4,2B30E3B2EBCCB385_4572DC68C73B4BDF_7022_DP,8.204008,00000000000000000000001001000000000000100000000000001000000000100100000000010101101100010011011010001001101110010000001011101100010101110100001010011111010010101111010,KGGUAVYYVNOVNI-CQSZACIVSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC3C4CC5CC3CC(C4)(F)C5,6CB23311D896385D_32F0A7CD53857C43_6041_UN,8.155995,00000000000000000000000000000000000000100010000000001000000000100110000000010101100101010010011010000100010100001000000011101100100001110100001011001111000010101111010,OELGJFAZNGPZEF-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NCC3=N[N](C)C4=C3CNCC4,2CDE9563918243D7_F48D8E7BD7543E58_6041_DP,8.23046,00000000000000000000001000000000000000000010000000001000000000100100000000010001101100110001011010101100110110010000101011101100110101110110001011011011010110101111010,BIOWXZAMYGTZNE-UHFFFAOYSA-N
CN1CCCCC1CCOCC4CC2(CC3(C2)OCCO3)CO4,C110F2ED7AA7F35B_36EC36FA69E3CEBA_6039_UN,7.091504,00000000000100000000000000000000000000000000000000000000010000000010000010010000000101100000010011101000010011011001101011110010110010000110100000111010110111111101110,ZQFCUMJXPAOEIB-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCCC2CCCCN2,17D5446CC348A62C_FE025D3E0AF27E56_6041_DP,8.000113,00000000000000000100100000000010000000000000000000000100000000000100000000100001101000100011010000101000100000011000001011000000110101010110011011011111010110101111010,QRYROWOISNMZCQ-UHFFFAOYSA-N
CC1=NC5=C(C(=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)C=CC(=C5F)F,D90308F440E28062_116D212756A600DB_6041_UN,8.202079,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011111010110101111010,SRORVVAOAFFKQS-CMJOXMDJSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)N[C@H]5[C@H](C4=CC(=C(C)C=C4)C)C5,36F7832E141B8FAB_06A1343CEDCA04E1_6041_UN,8.018612,00000000000000000000001000000000000000100010000000000000010000100100000000000101000101110010000010100100110101010000001011100100110011110110001011011111010011101111110,CUAAACCAGHCLRZ-PZJWPPBQSA-N
C(C2CCCC1(CC1)C2)=CC3=C[N](N=C3C)C4=C(C=CC=C4)Cl,79DAD6B08BD67BAD_87581A6D525AC67C_7019_UN,8.104418,00000000000000000000001000000000000000000000000000001000000000100110000000010000100100010000001010010001010100001000001011101100110001110100001011011010000010101111010,YCTNMVYEIZTVSB-UHFFFAOYSA-N
C(C2CCCC1(CC1)C2)=CC3=C[N](N=C3C)C4=C(C=CC=C4)F,527C52CE9A44110A_CAEEC0B550869745_7019_UN,8.10441,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011010000010101111010,GKGNWLMPLWOQMD-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC(N(C)C)C3CCCCC3,A99E98431D1CB749_15B0036C01193BB5_6041_UN,7.683572,00000000000000000000000000000000000000100010000000000000000000000100000000100101001001110001010000101100010110010000101001100100110001110100011011011111010110101111010,RMZMQSFSUWFIFD-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NCC2N(C)CC3(CC2)CCC3)C=C,A2CDEFA73D586CF4_8B53FEF34CC63E66_6041_UN,7.7206683,00000000000100000000000000000000001000000010000000000000000000000010000000010001001001110011010000111000010110011001101001100000110001110110001011011011010110101111010,OPQXHGYBGZVTOT-UHFFFAOYSA-N
CC1=C(N=C(N1CC2NC3CC2C=C3)C4CCCN4)C5=CC=CC=C5,8764C93DB60FB326_FA0380AB66C4AECB_6034_UN,8.376056,00000000000000000000000000000000000000100000000000000000000000100100000000010101001101000011000010111000110000010000101011100100110100000110001011011011010110101111010,PSQYZRBDFQKKBI-UHFFFAOYSA-N
C2(=CC1=C(C(=CC=C1)Cl)S2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,37655FEA407BC071_59E72308C24274FD_7022_UN,8.295535,00000000000000000000001000000000000010000000000100000000000000100100000000010101111101011011010010101101010100010000001011100100110001110110001011011011010110101111010,MHPSEFOIGMFSPJ-QRWLVFNGSA-N
CC4(C)CCC1=C(C3=C(N1CC2CCCCN2CC)C=CC(=C3)Br)C4,AAE186185C9241BD_67BA60F917F93829_6034_UN,7.666305,00000000000000000000000000000000000000000000001000000000000000000110000000110001000101110000000010101100010110011011101011100100110000100110011011011110010110101111010,FRAYIVCGTGIMOR-UHFFFAOYSA-N
C2(=CC1=C(C(=CC=C1)F)S2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,B3137283BDC32300_BEFB46FA3DDA460D_7022_UN,8.295513,00000000000000000000001000000000000010000010000100000000000000100100000000010101111101011011010010101100010100010000001011100100110001110110001011011011010110101111010,FHNCEQZCZUHFBS-QRWLVFNGSA-N
CC1=C(C=C(C(=C1)NC[C@H]2[C@@H](C2)C3CCC3)Cl)C4CC4,1B9795311D61C41B_577350D8C77030A7_7022_UN,7.6687956,00000000000100000000001000000000000000000000000000000000000000100000000000000000001000010011000000001001000110000000001000000000110001110000000010010011010110101111010,SRKQHWGTUOYVHH-HOCLYGCPSA-N
C(N1CCNCC1)C2=C3C(=CC=C2)C=C[N]3CC4(CCNC4)C,1C11E939B834AE5C_BF68A0C32C99FA28_6034_DP,8.335012,00000000000000000000000000000000000000000000000000000000000000000110000000010001101101100011000010101100110010011001101011100100110100000110001001011001010110101111010,YWNVSQGFTZTEJQ-UHFFFAOYSA-N
CCN3CC[C@@H](NC(C2C1CCC(CN1)C2)=O)[C@@H]3C4=CC(=C(C=C4)Cl)F,1434BA6F9B85EDEA_813AA2C9AC30CAD9_6038_DP,7.7515073,00000000000000000000000000000000000000000010000000000100000000100000000000010001101101110011100011101001110110110010111011100000110101100110001011011011011110101111110,CTUGZSMTGUCRRA-NHZWXWKPSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CC3)C4=NC=C(C=C4)F,648E258832348C08_D0846DA389CDBCE5_6041_UN,8.044117,00000000000000000000001000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100010001110110001011011011010110101111010,ZYFXFQGHSYPNCS-INIZCTEOSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CC3(OCC2)CCC3)F)CC4,E7F5293B0A962842_4A77A758C59A57DD_6041_UN,7.1110134,00000000000100000001000000000000000000000010000000000000010000000010000000010001101001110011010000101000010111011001101011100000110011110110001011011011110111101111110,AKPKBGMVPADQPF-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,EF4DF67E6E91DB7E_72B508316CE4E1C5_6038_UN,8.261097,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010001100011101100110100110010011001000100110000100100001011010011011110101111110,JGMFDUVHZASSED-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C3(CCNC2)CCOCC3)F)[N]4C=CC=C4,6E43D954E7229254_DDD29EE34E467133_6041_DP,8.064434,00000000000000000000000000000000000000000010000000000100010000100110000000010000101101110011000010101000110101011000001011100100110111110110001011011011010111101111110,DURIWBIAEBQISW-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2C3CCCC2COC3)F)CC4,482A8EA5D123779A_A6A1A6F932978C9C_6041_UN,7.414152,00000000000000000001000000000000000000000010000000000000010000000000000000010001100001110011010001101100010111010001101011100000110001110110001011011011010111101111110,NBHKSLQJPSWJTC-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC3(CC3)CC4CC4,29CD261BC21630E3_2BB620EEDD3459B3_6041_UN,8.4767275,00000000000000000000001000000000000000000010000000000000000000000110000000000000101000010011000000101100010100001000001001000100110001110100001011010011010110101111010,CBNGUTINOILFSP-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC3=CC(=C(C=C3)N4CCOCC4)F,561F6782541D61AB_1EE2E85C4B184895_6041_DP,8.130632,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101110011010110101000100111010000001011100100110111110110001011011011010011101111110,GSUKYDWSDFNBNN-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C3=CC(=NC4=C3C=C(F)C=C4)C)=O,10C20B312D82945C_7D2935AD0741B109_6038_UN,7.9385214,00000000000000000000000000000000000000000010000000000000010000000100000000000000001100010001100010101100110100110000011011000100110010100100001001010001111111111111110,PUBGJTWJDFIRTK-UHFFFAOYSA-N
N5CC1=C(C=C(C=C1)NC2=C(C=C(C=C2)F)C3CC3)C4(CC4)C5,40B25F6FEE094BA0_12EBC049341FA4C9_6041_DP,8.755829,00000000000000000000001000000000000000000010000000000000000000100010000000000000001000110011000000101100010100001000001001000100110101110110001011010011010010100111010,WMLLMFJZFQHMLY-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC(CC)C3CCCCO3)F,E199AA86E57752D9_70582D78150E9E72_6041_DP,7.8011627,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000010011000100101100110111010010001011000000110111110110001011010011110111101111110,FOXQEGLZZYKARW-UHFFFAOYSA-N
C[N]1N=CC(=C1)C4=NC2=C(C3=C(S2)CCCC3)C(=C4N5CCNCC5)C6=CC(=CC=C6)F,C82B665BFBE9F4D0_E9FD30BF61C0A456_2201_UN,7.5536566,00000000000000000000000000000000000010000010000100001000000000100100000000010001111101111001011010101100110100010000001011101100110001110110001011011011010010101111010,HCZUZZNVZJUXSQ-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2C3(CCC2)CCC3,9E9AFD500E7CE05F_A7A949B18D9F38D0_6041_UN,7.4391365,00000000000100000000100000000010000000000000000000000000000000000110000000100001001000100011010010101000010000001000001001000000110001010100011010011111010110101111010,QNFPTDCYFWDMJV-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)F)NCC(CC)C2CCOCC2,5EB0B0A933B6906C_C5D749122551583C_6041_UN,7.9827194,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110011000000101000000111000010101000000000110011110110000011010111010111101111110,XIXKPXGDLHABPH-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2C=CC=C(C2=NC=C3)F)C4,D868C0096BD0B4BB_A584CAEE68A677C0_6035_UN,8.208995,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010011101100010100000101001001100111110000100100001101011110110111101111110,ATNQMFMSKDCFLC-QRDCCXFBSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2C=CC=C(C2=NC=C3)Cl)C4,E4AA202609C2641A_0B6C70FE09C1EC67_6035_UN,8.208993,00000000000000000000000000000000000000000000000000000000000000000100000000100000000001110000010011101101010100000101001001100111110000100100001101011110110111101111110,OHGHTGQIBAZGPS-QRDCCXFBSA-N
CC1=C(C3=C(N1CCC2CCCN(C)C2)C=CC=C3)C4=CCNCC4,10AE237DE34948BC_0450088EA0C0EEA2_6034_UN,8.101789,00000000000000000000000000000000000000000000000000100000000000100100000000011000001101100001010010111100110010010001101011100100110000000110001011011111010110101111010,FTTDUOBVTQZAEO-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCC(CN2)(C)C)F)CC3,982F2000F8273E97_155AC239569E8D1C_6041_DP,7.871648,00000000000000000001000000000000000000000010000000000010000000000010000000110001101001110011010000101000100110011001101011100000110101110110011011011111010110101111010,GJRLFTGRVNBXTI-UHFFFAOYSA-N
C1(=CC2=C(C=C1)NC(=CC2=O)C3CC3)C4=C(SC)C=CC=C4,101FCD4A2F60269C_DD8C1D96743D236B_6006_UN,9.46517,00000000000000000000001000000000000000000000000000000000000100101100000000000000010000001011010001100100010000000100000001000101000000000100000111010011101010001111110,OEPLFBBKHZSTBP-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC4CC3(CCN(C)CC3)OC5=C4C=CC=C5)F,E4011A903C1FBAAF_486811804B212D43_6041_DP,7.1599865,00000000000000000000000000000000000000000010000000000000010000000010000000010000001001110011010001101100110100011101101011100100110111110110001011011011110011101111110,AIYXWVJZAMVSIT-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4CCCC(C4)C5=CC(=C(C=C5)F)F,CE0C1C4C10CC8755_82546C6B96C5E137_6041_DP,8.278645,00000000000000000001000000000000000000100010000000000000000000100100000000000101100101010011010010100000110100010000101011100100110101110100001011011011000010101111010,YIUMUSZDJGFLHG-YBUMUKGHSA-N
CC1=C[NH]C2=C1C=CC(=C2)NCC4(C)CCOC3(CCC3)C4,2B896EBB30CD6762_B5149C0E20E24EAD_6041_UN,7.5338144,00000000000100000000000000000000000000000000000000000100010000000110000000000000101100000011000010101100010011001001101011000100110111010110001001010101110111101111110,SNOZEWTYJGIOLK-UHFFFAOYSA-N
C[N]1C=CC2=C1C=C(C=C2)NC35CC(OC34CNC4)(C)C5,6CAF5F7DB1F842D3_2E820D525C5ED03C_6041_DP,7.431624,00000000100100000000000000000000000000000000000000000100010000000110000000010000101101100011010111001100110010011001000011100100110111010110001000001101110011101111110,JLZRXBVHGSBPLW-UHFFFAOYSA-N
C1CC(CN1)C3=CC2=C(C=CC=C2)N3CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,96EA14A133A8303E_A36CA50450F47851_6034_UN,8.4545555,00000000000000000000000000000000000000000000000000000000000000100100000000010001101101110011000010001101110110010010101011100100110100100110001011011011010110101111010,KIKPYNWHKZUTJA-UHFFFAOYSA-N
O([C@@H]([C@H]1NCCC1)C2=CC=CC=C2)C3=C(C)C=C(C=C3C#N)Cl,ED758F697C40D5AE_477E41C47062432C_6035_UN,7.9317646,00000000000000000000000000000000000000000100000000000000000000000000000000000000001100010011000111001001100100010100001001000111010000100100001111010011110011101111110,HCYDUQKRJDMMTO-PKOBYXMFSA-N
C1(=CSC(=N1)C2OCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,D3C5C323FBEFF5C8_93D7A973DF7E3209_6041_UN,8.541108,00000000000000000000000000000000000010100010000100000000010000100100000010010101110101111011010110001000100111010001101011110100000011110110001010011011010011111111110,OUVDAWHBVZLNCG-HIFRSBDPSA-N
FC1=C(C(=CC=C1)NCC[C@@H]2CC[C@H]3C[C@@H]2C3(C)C)C4CC4,A904B252A6BCEA10_3929910A129A863C_6041_UN,7.765189,00000000000100000000001000000000000000000010000000000000000000100010000000100000001000010001000000001000110110011000101000000000110001110000000011010111010110101111010,SJJSNVOUPVYDCC-BPUTZDHNSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CCCC23CCOCC3,946B7437B83E9B76_1DE04959A52BFFE9_6041_UN,7.3414545,00000000000000000000100000000010000000000000000000000000010000000110000000100001001000100011010010101000010001001000001011000000110011010110011011011111010111101111110,PEOFMAPNJBPIET-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC3CC2(CNC2)C3)Cl)C4CC4,04A40554AA0F93D1_FD906B355EC59FE9_7022_DP,7.9213862,00000000100100000000001000000000000000000000000000000000000000100010000000000000001000110010000000001001010110001000000001000000100101110110001010010011010110101111010,OBFFSBFMMCZFBG-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)C[C@H]3[C@@H](CNC3)C4=CC=CC=C4)CC#N)F,1A67956E6EE38014_1C0AA1C6558C0540_6034_UN,7.719241,00000000000000000000000000000000000000000110000000000000000000100100000000010000101101110011000010001100010100010000000011100100110000100110001011001011010110100111010,FWKLXOHMHWLQJE-WMZOPIPTSA-N
O[C@H](CBr)C1=C(C=CC=C1)NCC(C)(C)CC2CCOCC2,DC66E39D0FC981B9_5892A6E95875FCA6_6041_UN,8.155736,00000000000000000000000000000000000000000000001000000100010000000010000000100000001000100011000001101000100011001001001000000000110111110111000011010111110111111111110,ZBFAPWYSPKUXLN-QGZVFWFLSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC4(CC3(CNC3)C4)C5=CC=CC=C5,88E15FC3807322DD_134C74000216E995_6041_DP,8.092522,00000000100100000000000000000000000000100010000000000000000000100110000000000100001000110010000000101100010110001000000011000100100101110110001011000111010110101111010,RBASUVPKZJOMPJ-UHFFFAOYSA-N
N(CC1C2CCC(C1)CC2)C(=O)C3=COC4=C3C=C(C=C4F)F,FF79F4F3F8FBA7BF_165E5B568B79B69D_6038_UN,7.986412,00000000000000000000000000000000000000000010000000000000010000000000000000000000001100010111100011001100010100100000011000000100110000100100000001010001111110110111110,DSSHAYSPWPKFAS-UHFFFAOYSA-N
N1CCN(CC1(C)C)C2=NC(=CN=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,369ABB707AC4197A_CBABD7220A21A81F_6041_DP,8.150755,00000000000000000000000000000000000000100010000000000100000000100110000000110101101001110011000000101000100110011001101011100100110101110110001001011111010110101111010,BUQNQZXCVZALJE-PKOBYXMFSA-N
N(CC1=CC2=C(C=C1)COCC2)[S](C4=CC3=C(C=C(C)[NH]3)C=C4)(=O)=O,4F6F60A5CA0706C5_09611D163513AF6A_6029_UN,8.805403,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100101000001010101110011001001000011011001100111110001110001011111001010111111111110,SWXFFFPMAZVHLT-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC=C2NCC3CCN(C)C3C4=CC=CS4,D54111F8522B8286_5031F5D950F1F3E8_6041_UN,8.639613,00000000000000000000000000000000000010000010000000000100000000100100000000010000111101111011010010001100010110010001101011100100110101110110001010011011010110101111010,WIZCWONENNCMAQ-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NCC2CCNC(C2)(C)C)F)C#N,CBFC18F0B6C1E1A7_A3FFB83432DA7825_6041_DP,8.179022,00000000000000000000000000000000000000000110000000000000000000000010000000100000001000010011000000101000100110011001101001000000110101110110011011010111010110101111010,FMJFNMOZTQZDCV-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC3CC2CCOCC2CC3)Cl)C4CC4,032D76806E4D2E8F_C4267DFB948173F7_7022_UN,7.8215237,00000000000000000000001000000000000000000000000000000000010000100000000000000000001000110011000000101101010111000000001000000000110011110110000011010011010111101111110,CHIPZAUACNQTBX-UHFFFAOYSA-N
CC2=C1OCC[C@@H](C1=C(C=C2)C)OCCN3C(C)COCC3,C1E3B9235C3665AA_9D6C5DABE39649DD_6039_UN,8.1329,00000000000000000000000000000000000000000000000000000000010000000000000000010000000001100100000100101100010011010101101011100011110010000110010111111110110111111111110,CIAAHQYTAYSUFH-LYKKTTPLSA-N
FC1=CC2=C(C=C1)C(=CN2CC3CCN(C)C3C4=CC=CC=C4)C5CCNCC5,36869B01CE8C9E4F_C6833B2F0C277AF2_6034_UN,8.380388,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110001010010101100110110010001101011100100110000100110001001011011010110101111010,HDXBWXHWAGMMHQ-UHFFFAOYSA-N
C1(=CC(=CC=C1)CC2CCC2)NC3=CN=C([Si](C)(C)C)C=C3,5784694552E81CC6_24C22BA5E880D332_6041_UN,7.34258,00000000000100000000100000000010000000000000000000000000000000000100000000100001000000100001010000100000000000001000001001000100110001010100011001011101000110101111010,BADDIBYANBCFCX-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NCCC3CCCN(C)C3,8E6664EB27560A15_DC9D2570843874D6_6041_UN,7.395853,00000000000000000000000000000000000000000010000000000000000000000000000000010000001001110011010010101100110110010001101001100000110001110110001011011001010110101111010,WLAUDSAXPFSXBL-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(C)CCC=C3)C4=CCNCC4,9FF9B71E192467DB_753BE6BF83C33B4C_6034_UN,8.43903,00000000000000000000000000000000000000000010000000100000000000100110000000011000001101110001000010111100110110011001101011100100110000100110001001011001010110101111010,GVQICTTVCSSZIL-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CC4(C3)CCOC4,23309EC82CF91F92_8118AD8D85DC6994_6041_UN,7.138833,00000000000100000000000000000000000000100010000000000000010000000110000000000100001100110010000010101100010111001000001011000100110011110110001011010111010111101111110,AMDPRJMFPCANJQ-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=CC2=O)CC3(CNCC3)C4CCOCC4,4CC0E16FC82F3852_EFB42BDE1E36D066_6034_UN,8.55022,00000000000000000000000000000000000000000000001000000000010000100110000000010000101101110011000011101100110101011100001011100101110010100110001101011001111111110111110,CDBFAOCTCCRTNT-UHFFFAOYSA-N
C(C1CC2CCC1CC2)=CC3=C(CC)OC4=C3C=CC=C4,694763BFE014085F_0E0693A194C7C5E3_7019_UN,8.740448,00000000000000000000000000000000000000000000000000000000010000000000000000000000000100000000000010010100010000000010001000000100110010000100000011010010100100001011110,NYFRCBRBXPACEV-UHFFFAOYSA-N
N1CCC(CC1)C2=N[NH]C(=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,3BC18C4BD4D0CC27_52350E8445F647DB_6041_DP,8.144525,00000000000000000000000000000000000000100011000000001000000000100100010000010101101101110011011010101000100110010001101011101100110101110110001001011011010010101111010,MRKMGZDSAMBMKX-APWZRJJASA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC3CN(C)C4(C3)CCOCC4,029EAD96AAE861C8_2153C68B237C3565_6041_UN,7.7594047,00000000000000000000000000000000000000000010000000000000010000000110000000010001100101110001010011101100110111011001101011100100110011110110001011011111010011101111110,LNKZDSKXRLHFTO-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3NCC3(C)C)Cl,B1E8206D4A75D6FD_1C91632E6DDFB86C_6034_UN,8.589341,00000000100100000000000000000000000010000000000100000000000000000110000000110111011101011011000010001001101100011001100111100100110101110110011010001111010110101111010,CVSXPJJXBKDBTF-UHFFFAOYSA-N
C1(=C(C=CC=C1)C(F)F)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,C89B16CF85A805EE_0D40FFDFB795FE4E_7022_DP,7.9521027,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101100011010010001000000110000000000011100100110101110110001010001011010110101111010,LCDNAMOAENLNIF-WCQYABFASA-N
N(CCC1CC2CCC1O2)C(CN3C4=C(N(C)CC3)C=C(C=C4)F)=O,8F5BF76642AD88F4_74EAF7860F379846_6038_UN,8.027957,00000000000000000000000000000000000000000010000000000000010000000000000000010001001101110001110110101100110100110001111011100000110010110110001011011001111111111111110,LIINWBRFLFTCPS-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)F)NCC23CC(C)(CO2)CCC3)F,B530A8EE7282801D_92632029F5F0E232_7022_UN,7.4586096,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100010011000110001000010111001001101000000000110011110110000011010111110111101111110,ICZMYYUJKYQROB-UHFFFAOYSA-N
CN(CC1CNC1)C2=NC(=CN=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,B84EFE4892520026_19C194CC5915F16E_6041_DP,8.218511,00000000100100000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100100101110110001001011111010110101111010,CZCGTSMIBRPQQZ-XLIONFOSSA-N
FC1=CC2=C(C=C1)C(=NC=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,19DC863EEB431F30_6525B8DE939EED01_6041_UN,8.192975,00000000000000000000000000000000000000100010000000000000000000000100000000000100100001110010010000101100010110010001101001100100110001110100001011011011010110101111010,XMDCVVVJSMNOER-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2C[C@H]3N[C@@H]4CC[C@H]3C4)C5CCNCC5,AE34938FD3534028_22F7C5697E2EA86B_6034_UN,7.6264358,00000000000000000000000000000000000000000000000000000000000000100100000000010001001101100011000010101100110000010000001011100100110100000110001001011001010110101111010,QIYRDHGNEQNQED-SQGPQFPESA-N
CC1=C(C=C(C(=C1)NC[C@@H]2C[C@H]2C3=CC=CO3)Cl)C4CC4,59EE76888003120B_08C2046780E7B0B7_7022_UN,8.700162,00000000000000000000001000000000000000000000000000000000010000100000000000000000001100010011000010001001000110000000000000000100010001110100000010010011110110101111110,WZTKHUUXADLMSK-DZGCQCFKSA-N
COC1=CC=C(C=C1)C[N]2N=C(C(C)C)C3=C2N=CC=C3NCC45CCC(C)(CC4)CO5,FC12338CFC6CB400_F2EABE2DD233FF70_6041_UN,8.237463,00000000000000000000000000000000000000100000000000001000010000000110000000110101101100000011011110101100010001011101101011101111110011010110011101011101110111111111110,CNBBDHBNYDBHBR-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CCC2NC3=C(OC2)C=CC(=C3)F)C=CC=C4)C5,E43C8B36E60E7E3D_9EB5E8A5CDA86391_6034_UN,7.898022,00000000000000000000000000000000000000000010000000000000010000000110000000110000100101010011000110101100110101011101101011100100110000110110001011011101110111101111110,GZQMZOHNSIPFQU-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC3CC2CC2CC3)Cl)C4CC4,30454AF2180C0561_1D90436EBDDA304F_7022_UN,7.914595,00000000000000000001001000000000000000000000000000000000000000100000000000000000001000010011000000001001010110000000001000000000110001110000000011010011010110101111010,BKNFEWWEUHDNAJ-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CC=CCCC)C3=CCNCC3)F,7609E6DC00BFD8B5_766BB193D1D3C193_6034_UN,9.118607,00000000000000000000000000000000000000000010000000100000000000100100000000011000001101110001000010111100110100010011001011100100110000100110001011011011010110101111010,VKMDREDYVRHLSF-UHFFFAOYSA-N
CC1=CC(=C(C=C1)C)[C@@H]2CCCC[C@H]2OCC3OCCNC3,4D41D0A171C102A6_4211AD86A99CDFE7_6039_DP,8.672763,00000000000000000000000000000000000000000000000000000000010000100000000010000000001000100011000101101000100011010000001011000011110010000110000111010111110101111111110,GNSOKMKSXDCTSL-WFTITGEASA-N
CC1=C(C=CC(=C1F)NC[C@@H]2CNCC(O2)(C)C)C#N,51AAD61870B9D823_0AB44721E61A6997_6041_DP,8.146229,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110011011000111110111101111110,LSNMGDTYTNYRMS-LBPRGKRZSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2CC(CCC)N3CCNCC3,5B308CA8167F72AA_BF59CD4125126F99_6034_UN,8.324557,00000000000000000000000000000000000000000000001000000000000000000100000000010001001101110001000010101100110110010011101011100100110000100110011011011111010110101111010,NZKVHSXWJPRYDL-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)OCCC2)[S](C4=CC(=C3[NH]C=CC3=C4)CC)(=O)=O,E5CA80241E4487B4_985EBB5AAD06F028_6029_UN,8.726181,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100001010001010101110011001001110011011001100101110001110001011111001110111111111110,XLDXNSXYHSHEQR-UHFFFAOYSA-N
CCC2=C1N(C=C(C1=CC=C2)C3CCNCC3)C[C@H]4[C@@H](CNC4)C5=CC=C(C=C5)Cl,6CDCDDD8BECEE384_A804545A3812EC44_6034_UN,8.4187565,00000000000000000000000000000000000000000000000000000000000000100100000000010000101101110011000010101101110100010010001011100100110100100110001001011011010110101111010,NPKKZKBDVRBDCD-URXFXBBRSA-N
FC2=C1CCCC1=CC(=C2)NC3CCN(C)C34CCCNC4,0267516A88F8E31E_23E311F5CB215A92_6041_DP,7.4795427,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101110011010010101100110110011001101011100000110101110110001011011001010010101111010,WWHPOKSKGCRHFR-UHFFFAOYSA-N
FC1=CC(=CC(=C1)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,E26CEBD75EAE0413_38C93ECD7FE84D0B_6041_UN,8.605091,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001001011111110111101111110,UICZWHASFYNVDB-HOTGVXAUSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,AE27D09EFA7AF3D0_A569B18B8F4B043D_6041_DP,8.108037,00000000000000000000000000000000000000000010000000000100000000100100000000100000101000110011000000101100110100010000001011000100110101110110011011010111010110101111010,QVRZYBNMNQNQRC-AZUAARDMSA-N
CN5CCC1=C(C4=C(N1CC3(CC2=CSC(=N2)C)CCNCC3)C=CC(=C4)Cl)C5,8768225BACB9FEB1_BD7CBDFAFEB7D81D_6034_UN,8.166868,00000000000000000000000000000000000010000000000100000000000000000110000000010000111101111001010010101101110110011001101011100100110000100110001011011101010110101111010,FIQTWFVNFCCZET-UHFFFAOYSA-N
C2(=CC1=C(C=CC=C1F)S2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,3D9D0D3AF20B5210_05B3AB3F34D8E15B_7022_UN,8.348783,00000000000000000000001000000000000010000010000100000000000000100100000000010101111101011011010010101100010100010000001011100100110001110110001011011011010110101111010,UIKCJHKXFMHOEZ-SZNDQCEHSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NCC2=CC=CC3=C2CCNC3,C56ABCC6CA5D5C28_6288E59A12D72298_6041_DP,7.710942,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100001010000101100110000011000001011000100110101010110011011011101010110101111010,SUQUFPSATHYDSA-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC(C)CC3CCOC3,FD34DED672DE1708_399FCE109CB6D5C3_6041_UN,8.151109,00000000000000000000000000000000000000100010000000000000010000000100000000000100000100110001000010100100110111010001001011000100110011110110011011010111010111101111110,XLENKPVZKSTTAG-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NCC3(CC2CC2)CCCC3)F)F,64448B8BB4D1B05A_531441F215770D68_7022_UN,8.267895,00000000000000000000001000000000000000000010000000000000000000000010000000000000001000010011000010001000000100001000001000000000110001110000000010010011010110101111010,ZVYJSPOHOVONFI-UHFFFAOYSA-N
C[N]1C=CN=C1C2=CC=C(C=C2)NC34CCC(CC3)(F)CC4,948CDD599E5966EC_0E3D085BF1FA2BFA_6041_UN,7.8169856,00000000000000000000000000000000000000100010000000000000000000100110000000010101000101010010010010000000110100011000001011100100110001110100001011011011000010101111010,UMXXRJYQMCTHSF-UHFFFAOYSA-N
O[C@@H](CF)C1=CC(=CC=C1)NCC2N(C)CC3(CC2)CCC3,1EB22011E5E175C0_4423D18F3A73C4DB_6041_UN,8.240595,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001100011010000101000110010011001101001100000110111110111001001011011110111101111110,BAOBMNYBNSOXMP-DJNXLDHESA-N
O[C@@H](CCl)C1=CC(=CC=C1)NCC2N(C)CC3(CC2)CCC3,13D88C3514408115_E72BCC0559A23C2A_6041_UN,8.240558,00000000000100000000000000000000000000000000000000000000000000000010000000010001001001100011010000101001110010011001101001100000110111110111001001011011110111101111110,GGFRNZCWBOPJTM-DJNXLDHESA-N
C([CH]2C[C]1(C[CH2]C1)C2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,526B73EF50DE7B9E_03E6CEAC637D3EE0_7019_UN,7.949528,00000000000100000000000000000000000000000010000000000000000000000010000000000000000001010000010010010000010110011000101000100000110001110000000010011010000010101111010,PTLMGBYHRGSXNG-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2=C(C=CC=C2)F)NC[C@@H]3CNC[C@H]3C4=CN=C[N]4C,A52BB8C2CA2AFA7B_DA33EDDE78F401A8_7022_DP,7.334002,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001011001011010110101111010,DSNZVROMPPVJNE-QFBILLFUSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CC3)C4=CC=C(C=C4)F,899A3FED247F9EA7_941D41458546F948_6041_UN,7.5208015,00000000000000000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100010001110100001010011011010110101111010,CZTHHRAEXPKMNA-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NCC2(CCN(C)CC2)N3CCCCC3)OC=C4,5CADE7A1A4AE8562_58AB3C2C044B5499_6041_UN,7.838541,00000000000000000000000000000000000000000010000000000000010000100010000000010001101101110011010110101100010100011001101011100100110001110110001001011001110110101111110,SAKQQLMEKBLNNK-UHFFFAOYSA-N
N(C1C2CCN(C1)CC2)C(=O)C3(CCCC3)C4=CC(=CC(=C4)F)F,E334715F0575B34D_46D01DE2F8B8E2F2_6038_UN,7.638862,00000000000000000000000000000000000000000010000000000000000000100010000000000001000001110011100010101000110100111000011001100000110001100110001001011001011010100111110,HFWQQNYTCIBTLM-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)C2OCCO2)C)NC4CCN(CC3=CC(=C(C=C3)F)F)CC4,14F8B1BD11C4B632_9E52501AB72118C7_6041_UN,8.308029,00000000000000000000000000000000000000000010000000000000010000100000000010010000100101110010000010101000100101010000001011110100110011110110001011011111010111111111110,ZXRSSUXHTSRXBM-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4=CC=C(C(=C4C)F)F,61E7D4F33C2447FC_F18C900D1DB7E0B7_6041_DP,8.565923,00000000000000000001000000000000000000100010000000000000000000000100000000000101100101010011010010100000110100010000101011100100110101110100001011011111000010101111010,PDDACNNFMWRFOI-BTTYYORXSA-N
C1(=CC2=C(C=C1)[NH]C=C2C3CC3)NC4=CC=C(CC[Si](C)(C)C)C=C4,756410D1B6E66267_440FCAE36FB18F1E_6041_UN,7.9463835,00000000000000000000101000000010000000000000000000000000000000100100000000100000000100100001010010000100010000001001101001000100000101010100011001011101010110101111010,RXKHVKSEHNOQLO-UHFFFAOYSA-N
CC1=C(C(=NO1)C2=CC=C(C=C2)F)NC3CCN(C)C34CCCNC4,8C04CAD7BBB7BC32_0FF3505082B664C3_6041_DP,7.9601326,00000000000000000000000000000000000000000010000000000100010000100110000100010001101101110011011111101010110110011001101011101100110101110110001011011111110010101111110,YRRSUKCPCSADRI-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC(CC)C3CCOCC3,04EFE57EFE2AB74A_22D1E2867922B1B1_6041_UN,8.068339,00000000000000000000000000000000000000000010000000000000010000000100000000000001001000110011000000101100010111000010101011000100110011110110001011010111010111101111110,CTHPZTLDEMWPII-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)N[C@H]4[C@@H](C4)C5=C(C=CC=C5F)F,0484AD7B4DACE66A_6040C9910DA7E2B3_6041_DP,8.296175,00000000000000000001001000000000000000100010000000000000000000100100000000000101100101010011010010100000110100010000101011100100110101110100001011011011000010101111010,MUVNGKRWYIWGTQ-KQVLKZGSSA-N
CN1C(CCCC1)CC=CC3=CC=C(C2=C(F)C=CC=N2)O3,BAE9BBC5E5A72C47_88C5B9B65E2B2AA7_7019_UN,8.228728,00000000000000000000000000000000000000000010000000000000010000100100000000010000000101110000010110111000000110010001101011100100110000100100001011011010110110101111110,HIEDBNAPVSMQJT-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)CCC2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,669B4B8957813276_AE92ABCB19D9AB21_6041_UN,8.2037525,00000000000000000000000000000000000000000010000000000000000000000000000000000000100001110011010010001100010110010001101000100100110001110000001011011011010110101111010,BLYFNGTYOFDDIU-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=NC=CN2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5)Br,9BAC725A112C5866_EA90A92D6BD76F0A_6034_UN,8.620917,00000000000000000000001000000000000000100010001000000000000000100100000000010101100101010000010010101000000100010000001011100100110001100110001011011010010110101111010,BMJCUKSPMUKCJO-IERDGZPVSA-N
N4CC1=C(C=C(C=C1)N[C@@H](CC)C2=CC(=C(C=C2)C)F)C3(CC3)C4,A73514DDBBBAB3E9_A8854B89DF4CD02B_6041_DP,8.093029,00000000000000000000001000000000000000000010000000000000000000000010000000000000001000110011000000101100110100011010000001000100110101110110001011010111010110101111010,UTVBYLXDQWLWCG-FQEVSTJZSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NCC4OC3(CCC(C)(CC3)C)CC4,ADEBC1353CDEEE70_3D0B8F208BA23DE5_6041_UN,7.8764725,00000000000000000000000001000000000000000010000000000000010000000110000000110101001101010011010110001100011110001001101011100100110011110100011011011111110111101111110,TTXREXMSVAWHOP-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=NC=CN2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5)F,7FC0BA626E16F38F_19482296D9AE45FE_6034_UN,8.620904,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101010000010010101000000100010000001011100100110001100110001011011010010110101111010,DRLHATPHTZHYEI-IERDGZPVSA-N
CC1=C(C=C(C=C1)F)C3=NC2=C(C=CC=C2)[N]3CC4CCC5(CN4)CCCC5,F39BE6015F547C27_398B2ADB38314715_6034_DP,8.086219,00000000000000000000000000000000000000100010000000000000000000100110000000010101001101010011000010101100110100011000001011100100110000100110001011011011010110101111010,VZXAYEYPONXQAQ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C#N)NC(C2CNC2)C3=CC=C(C=C3)F,C77639CA4405776A_435B0C54D883BC82_6041_DP,7.7449994,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110010000000001000000100000000000001000100000101110110001011000011010010100111010,NALKBCBMOLYMQJ-UHFFFAOYSA-N
CC1=N[N](C(=C1)NC(C3CC2CCC(N2C)C3)C4=CC=C(C=C4)Cl)C5CCCCO5,A92C70822E78F942_A81037BF2F274B5F_7022_UN,7.7182426,00000000000000000001000000000000000000100000000000001000010000100100000000010101100101010011111111100001010111110000111011101100110011110100001011011111010011101111110,DUDRKWZAVPXWOA-UHFFFAOYSA-N
C(C2C1CC3CC(C1)CC2C3)=CC4=C([N](C)N=C4C5=CC=CC=C5)Cl,FD748EC88185236E_46777C9A64B1A4C1_7019_UN,8.640981,00000000000000000000000000000000000000000000000000001000000000100100000000010000100100010000011010010101010100000000000011101100100000100100001011001010000010101111010,KKGLZQYPMZOKFB-UHFFFAOYSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)C[CH]4C[C]3(C[CH2]C3)C4,FF7E0BD7DDAD2FA0_3AB69BA6A3087D68_6034_UN,8.315975,00000000000100000000000000000000000010000000000100000000000000100110000000010110010101011000000010001001011100011011001111100100110001110100001010011110010110101111010,WOVGHOYWLXROFH-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC3CCC2(CCCC2)C3)F,CA7F153500342BD3_7F1A6F8C411CCE6A_7022_UN,7.982917,00000000000000000000000000000000000000000010000000000000000000000010000000100000000001110011010010001000110100011001001000100000110001110000001010011111010110101111010,NRTHFMKVBQOFDF-UHFFFAOYSA-N
FC2=C1N=CC=C(C1=CC=C2)NCC3CCCN(C)C3C4=CC=CS4,BF8F7B33A5316377_D8A8BA2DCA03B7F6_6041_UN,8.527964,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,IAELTHYFBYFQOK-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3(CC3)C4CCCCC4,02601494D2D867AA_169C25D0B48FA50A_6041_UN,8.174926,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010011011010000100110100011000001011101100110001110100001001011001000010101111010,LNTCIDBAFJOQHE-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C[N](C)N=C3C4=CC(=CC=C4)F,155C20D91049B561_CF46ED2CE5EC858C_7019_UN,7.5554338,00000000000100000000000000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001011011010000010101111010,BKJNTFSDDJGYCD-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N(C=C2C3=CCNCC3)CC4(CCC)CCCN4,F165D95CFC1D9D5B_AB96AAE60DFB67C7_6034_UN,8.505714,00000000000000000000000000000000000000000010000000100000000000100110000000011001001101110011000010111100110110011011001011100100110100100110001001011001010110101111010,XOCQGFFTPUZOCI-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CC3(C)CCCN3CC4=CC=CC=C4)C5=CCNCC5)F,059B4299D30C4420_42E648ECB3CC6090_6034_UN,8.649372,00000000000000000000000000000000000000000010000000100000000000100110000000011001001101110001000010111100110110011001101011100100110000100110001011011011010110101111010,ARNRTJWQDITUBQ-UHFFFAOYSA-N
CN(C1CCNC1)C2=NC(=NC=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,E4B9EDC72B0D02FB_75E30DC5A8AA90C1_6041_DP,8.441953,00000000000000000000000001000000000000100010000000000000000000100100000000010101101101110011010010101000101110010001101011100100010101110110001001011111010010101111010,FGNIPIFKMGJZJL-QIONWKSUSA-N
C(C1CCCC=CCC1)=CC2=C(Cl)[N](C(=N2)N(C)C)C3=CC=C(C=C3)F,380B8B1070D0A69F_E1BA3DCE3954850C_7019_UN,7.6690354,00000000000000000000000001000000000000000010000000000000000000100100000000110101000101110000010010010101001100000000001011100100110001110100001010011110000010101111010,BSLPUSJQTYMSPP-UHFFFAOYSA-N
CCN3CCC1=C(C(=CC(=C1)NC(C)CC2CCCCN2C)F)C3,EB6EAF4024B7DF1D_50E30F611D13A6B2_6041_UN,7.2600183,00000000000000000000000000000000000000000010000000000000000000000000000000010000100001110001010000101100110110010011101011100000110001110110011011011111010110101111010,YQRHJFHHCSBPHT-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C3=C2CCCC3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,CBBD4DFE5428A0A5_5C0A27C2D7C8C77C_6034_UN,8.416416,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,PIEMNRCKHRRACC-NSYGIPOTSA-N
C[N]1N=C(C=C1F)NC2(CC2)C3=CC4=C(C=C3)OCCO4,58FF4F861CF1C814_5EC8F59E04592A4F_6041_UN,8.060774,00000000000000000000001000000000000000100010000000001000010000100110000010010101100100010010011010100100110101011100001011101100000011110110001011011011110011111111110,RIOAJOKVPSXPJI-UHFFFAOYSA-N
CN4CCC1=C(C3=C(N1CCC2CCC(C)CC2)C=CC(=C3)Cl)C4,93A38F56256FFB63_73323C669412EF78_6034_UN,7.60863,00000000000000000000000000000000000000000000000000000000000000000100000000010000100101110000010010101101010100010001101011100100110000100110001011011100010110101111010,CBTBALKNSSKYQP-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CC4(CN3)CCC4,82CBDBE0D529E5FF_5F5416E0D9B07A25_6041_DP,7.4780955,00000000000100000000000000000000000000100000000000000010000000000110000000000101001100000011000010101100110010011000001011000100110101010110011011010111010110101111010,WIZQCBPFCIXGBW-UHFFFAOYSA-N
N1CC2CCC1CN2C3=CC=C(C=C3)NC4=C(C=C(C=C4)C5CCOCC5)F,2A641DDD8F0CD31C_4C4DD9ECA4703277_6041_DP,7.560992,00000000000000000000000000000000000000000010000000000000010000100000000000010001001001110011000000101000110101010000001011100100110111110110001011011011010011100111110,FXRMBWMSDJLEOF-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC2CCCC3=C2C=N[N]3C)C4CC4,4AE46DACF420D169_FA8914629EF33C21_6041_UN,8.134331,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010011011010000100110110010000101011101100100001110100001011011011000010101111010,XMRLTALDBQWHKL-UHFFFAOYSA-N
C1(=CC(=CC=C1)CC2CNCC2)C3=C(C(=C(C=C3)Cl)C#N)F,196E2519A96FDE3C_0E27FA7D50E16A8F_6005_UN,7.82033,00000000000000000000000000000000000000000110000000000000000000100000000000000000001100110011000010001001100100010000001001000100110000100110001011010011010100100111010,FYHWBQCCESEMKS-UHFFFAOYSA-N
N(CCC1C3CC2CC(CC1C2)C3)[S](C4=CC(=CC5=C4[NH]C=C5)Cl)(=O)=O,CBD8445AFCC4167D_939C65F470C85005_6029_UN,7.734715,00000000000000000000000000000000110000000000000000010101001111001101010001000000111100011000001011001111111100011000011001001100111100101100001001011001010110110111110,NBVDXBDWIGAUFV-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,7415041FDF31D6E4_B1E110563B0B7A8D_6041_UN,7.7191606,00000000000000000000000000000000000000000010000000001000010000100100000010010000101101110001011110101000000111010001101011111100110011110110001011111111110111111111110,XPESLVPYFGEBJM-ROUUACIJSA-N
C(=CC1=CC(=CC(=C1)F)F)NCC2(CCN(C)CC2)N3CCOCC3,FBC33C2B558D1643_96E69005B8FAC4E5_7022_UN,8.183298,00000000000000000000000000000000000000000010010000000000010000100010000000010001101001110011010100111000000101011001101011100000110011100110001001011001010111101111110,LIRREZCRMIGMFE-UHFFFAOYSA-N
C[N]1N=CC(=C1)C4=NC2=C(C3=C(S2)CC(C)CC3)C(=C4N5CCNCC5)C6=CC=C(C=C6)Br,64ABD57C6DC87241_8246674EEEBDB404_2201_UN,8.301948,00000000000000000000000000000000000010000000001100001000000000100100000000010001111101111001011010101100110100010001101011101100110001110110001011011111010010101111010,HLNYJRMDIWIUSZ-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CCC2CCNCC2)C=CC(=C3)C)C4,8926DEAE5980019A_2CC5D5CAEC6E54A6_6034_UN,8.570065,00000000000000000000000000000000000000000000000000000000000000000100000000010000001101100001000010101100110010010010101011100100110000000110001011011101010110101111010,POLDIDURNMKZGR-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCC3CN(CC2=CC=NC=C2)CCO3,61ED4259282ACA3B_DDF3BB9A57DD98CF_6041_UN,8.174344,00000000000000000000100000000010000010000000000000000000010000000100000000110000111101101011010110101000000001011000001011100100110011010110011011011111110111101111110,WXBDWFMPLCZNSW-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)N[C@H]2C4=C(OC3(C2)CCC3)C=CC(=C4)F,2419498689A3DFF1_CE2BD8AADC29B140_6041_UN,7.77596,00000000000100000000100000000010000000000010000000000000010000000110000000100001000000110001010001100100110100011100001011000100110011110100011011011111100011101111110,AAAJYDZMUMTVBX-QGZVFWFLSA-N
FC2=C1N=CC=CC1=CC(=C2)NCC3N(C)CC4(CC3)CCC4,CFB3CF99232990FE_C2EA3D4DFB8C6183_6041_UN,7.8237877,00000000000100000000000000000000000000000010000000000000000000000110000000010001001001110011010000101100010110011001101011100100110001110110001001011011010110101111010,BHHUUTZVRIYVFE-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C[N](N=C3C4=CC=CC(=C4)C)C5=CC=C(C=C5)F,DE83BCE2D1C61F99_BA75DA338D467D01_7019_UN,8.081037,00000000000100000000000000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011010000010101111010,QUFVHVRXZGDQNZ-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=CC=C2NC(CC)C3CCCCO3)C,7520AE28CEB9E8F1_9AB27CBE51FBC6F4_6041_UN,8.299565,00000000000000000000000000000000000000000000000000000100010000000100000000000000100100000011000110100100110011010010001011000100110111010100011011010111110111101111110,PHHKXBSYOALJMP-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[CH]3C[C]4(C3)C[CH2]C4,FFB33792FE34203C_EFB4B102C6037625_6041_UN,7.1501207,00000000000100000000000000000000000000100010000000000000000000000110000000000100001000010010000000101100010110001000001001000100110001110100001011010111010110101111010,YRHVKYDGPNSSFC-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NCC3(C)C=CCCC3)C,86F68A69EDEFDAF5_0F8D4CFAB297E734_6041_UN,8.4257345,00000000000000000000000000000000000000000000000000000100000000000110000000000000101100000011000010011100010010001001101001000100110101010100011011010111010110101111010,BAKYKGTZLABTQX-UHFFFAOYSA-N
C1(=NC=C(O1)C2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,749788B946D5D0C8_5B3245E6B80E4188_6041_UN,8.274453,00000000000000000000001000000000000001000010000000000000010000100100000000010101100101110011010110001000101110110001111011100100000001110100001000011011110010101111110,AOJZYVJORQEHPU-ZBFHGGJFSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NCCC3CCN(C)CC3,9FF7CD780773ED79_8E3400F3854AB9C7_6041_UN,8.365945,00000000000000000000000000000000000000100011000000000000000000000100000000010100001101110011010010101100110100010001101011100100110101110110001001011001010110101111010,JUHWIZDOVZJLSX-UHFFFAOYSA-N
CCC2=C1N(C=C(C1=CC=C2)C3CCNCC3)CC4CC4(C)C5=NC=C(C=C5)F,BD305E00D9F709FC_5D33D40E938B141F_6034_UN,8.647439,00000000000000000000001000000000000000000010000000000000000000100110000000010000001101110001000010101100110110011011101011100100110000100110001001011111010110101111010,GWIPECQYIAWDOL-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCC3C[N]2C=CN=C2CN(C3)CC4=CC=CC=C4,10A3C444E1AD05DD_245D833D57865CEE_6041_UN,8.543181,00000000000000000001100000000010000010100000000000000000000000000100000000110101111101101010010010001100010000011000000011100100110001010110011010001111010110101111010,XCGIGNFKNSSMNX-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(C)CCCC3,F76BC229F146A835_AFB824AD0659992F_6041_UN,7.577287,00000000000000000000000000000000000000100000000000000000000000100110000000010100101101100011010010101000000010011001101011100000110001010110001000011111010110101111010,DCNRCYYRMVVJHS-HNNXBMFYSA-N
CC2=NC1=C(C=CC(=C1)F)N2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,C5235BC41BF64605_8998D920242618DC_6034_UN,7.2996325,00000000000100000000000000000000000000100010000000000000000000000110000000110101000101010000000010001100010110011000101011100100110000100100011011011110010110101111010,GHULFJWTCBCMAS-SQWLQELKSA-N
CC2=NC1=C(C=CC(=C1)Br)N2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,15C264FFF3BB419D_397CF7D79F81A0A0_6034_UN,7.299625,00000000000100000000000000000000000000100000001000000000000000000110000000110101000101010000000010001100010110011000101011100100110000100100011011011110010110101111010,DTUUXASHOJZQIK-SQWLQELKSA-N
CC1=C(C=C(C(=C1)NCC2CCCC(CC)C2)Cl)C3CC3,C75F0296178437F8_F7097420E60D2B8F_7022_UN,7.969348,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010011000000001001000110000010101000000000110001110000000011010111010110101111010,HVQGHDWDIDQGBM-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,055310E135AE3195_2B141B5F2741FD6C_6038_UN,8.241772,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010011100001101100010100110010011001000100110000100100001011010011011110101111110,XIIAMIMEICBIAU-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)OCCC2)[S](C4=CC(=C3[NH]C=CC3=C4)C)(=O)=O,4D01D1D7DE40E7CC_0A26DA0591462155_6029_UN,8.927182,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100001000001010101110011001001100011011001100101110001110001011111001110111111111110,RYLKSUWLRXEOPL-UHFFFAOYSA-N
FC1=C(C=CC=C1)C2=CN(C(=N2)C3CCCN3)CC4CNCCC45CCN(C)CC5,6242F21BF6EC1206_9E6C0C883C751CCE_6034_UN,7.8082294,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101110011010010101000110100011001101011100100110100100110001011011011010110101111010,HGEMCBPBRAUZQA-UHFFFAOYSA-N
CC1=C[NH]C2=C1C=CC(=C2)NCCC4CCN(C3CCN(C)CC3)CC4,1678CC90ED02DF20_78DE5AA8393E857A_6041_UN,7.6528153,00000000000000000000000000000000000000000000000000000100000000100100000000010000101101100001010010101100110000010001101011100100110101010110001001011101010110101111010,ZPZVVGVJWFKKEV-UHFFFAOYSA-N
FC1=CC5=C(C(=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)C=NC=C5,DB009546310B9D0B_779819BFF8C30836_6041_UN,8.488827,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,ZCCCSQHLWQUUFJ-ZHRRBRCNSA-N
CN4CCC1=C(C3=C(N1CC2CNCC(C)C2)C=CC(=C3)Cl)C4,2BEB878DC0AE4431_7153DECBE522E485_6034_UN,7.911264,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101110010010010101101010110010001101011100100110000100110001011011101010110101111010,YBRAXQOTDRFUQD-UHFFFAOYSA-N
FC2=C1OC=CC1=C(C=C2)NC3=CC=CC(=C3)CC4CCCN(C)C4,B0E43A89E810CC44_24B85DDE6D3E537B_6041_UN,7.7276278,00000000000000000000000000000000000000000010000000000000010000000000000000010000000101110001010011101100010110010001101011100100110001110110001001011001110110101111110,HPLJOTNNEDDKKZ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3(C)C(OCC3)C4CC4,5E6E11790DE747E1_AFE11EAD21E6CDD7_6041_UN,8.12858,00000000000000000000001000000000000000100010000000000000010000100110000000000100001100010011000011101100010111001001101011000100110011110110011011010111110111101111110,JIFZWTGUDDGBPP-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CC(CCC2)F)Cl)C3CC3,9C23F6771D783CE0_F25FCF6C15EFE17B_7022_UN,8.120474,00000000000000000000001000000000000000000010000000000000000000100000000000000000001000010011000000001001000110000000001000000000110001110000000011010011010110101111010,UWCCOBPWYJKEGW-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@@H]2[C@@H](CCC2)C3=CC=CC=C3)Cl)C4CC4,10E96109EF3F9ED8_85D9E2ACECE2C6EC_7022_UN,8.528948,00000000000000000000001000000000000000000000000000000000000000100000000000000000000000010011000010000001100110010000001000000100010001110000000011010011000010101111010,MHPHSZPTQYATFQ-PXNSSMCTSA-N
FC1=CC=C(C=C1)[N]2C(=NN=C2C3CC3)NCC6C4(C5=C(C(C)(CC4)C)C=CC=C5)C6,B313802FECBEBD47_38447E9876F6CAAC_6041_UN,8.282914,00000000000000000000001001000000000000100010000000001000000000100110000000110101101101010011001010001100011100001001101011101100110001110100001011011111010110101111010,SKHSRSMKUDSONG-UHFFFAOYSA-N
CC1=C(C=N[N]1C)C2=C4C(=CC(=C2)C=CCC3CCNCC3)OCO4,98C7EBBE6B830978_3AC4A04CD91243EB_7019_DP,8.012977,00000000000000000000000000001000000000000000000000001000010000100100000010010000101100100001011010111100110001010100001011111100110000000110001011011111110111111111110,PLQIWQUEHZDGSD-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC3CCN(C(CC)C)C3,6D2E90311EEBF321_90B82688611A3EE6_6041_UN,8.29323,00000000000000000000000000000000000000000010000000000000000000000100000000010000101101110011000010101100010110010011101011100100110001110110011011011111010110101111010,STBFVZJBYXVANA-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC5(CC4=C(C=CC=C4F)F)CCCCC5,7B8136C2BDCDDD2E_3483C93FB6E3067D_6041_DP,8.439499,00000000000000000000001000000000000000100010000000000000000000000110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010110101111010,PZXOWWMDYCUKRT-AQKKSAQBSA-N
N(C1=CC2=C(C=C1)CCOC2)[S](C4=CC3=C(C(=C[NH]3)CC)C=C4)(=O)=O,FFEADCBB8B1D344B_C23968B3D69554E5_6029_UN,8.615233,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100101011001010100110011001001010011011001100111111011110001011111001010111111111110,VQFWPWYWOWTPTF-UHFFFAOYSA-N
NC4CCC1=C(C3=C(N1CC2(CC)CNC2)C=CC(=C3)Cl)C4,BEAB919C17740092_7C39CB3EFBAEC3BE_6034_UN,8.080845,00000000100100000000000000000000000000000000000000000000000000000110000000010000101111110010000010001101110100011010101011100100110101100110001011011001010110101111010,PYERNUCNWIZOIX-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC4C5CC6CC4CC(C5)(F)C6,44C6586544D3D089_287EF4931E227B4B_6041_DP,7.5702167,00000000000000000000001000000000000000100010000000000000000000000110000000000101101101110011010010101100010110001000000011100000110101110110001001001001010010101111010,BACSEXBRTRXRPU-DXBHYYJCSA-N
C[N]1C=C(C=N1)NC2=C(C=C(C=C2Cl)C45CC3CC(CC(C3)C4)C5)Cl,6E33BD46FAE8FBD4_573365FAE1BAC0B7_7022_UN,8.387844,00000000000000000000000000000000000000000000000000001000000000100110000000010001100100010000011010000101010100001000000011101100100001110100001011001011000010101111010,UGSIQSCVXRRIGZ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3C(C(C)C)OCC3,CD20A596EC648FF6_A18291A74F6E2A79_6041_UN,8.226089,00000000000000000000000000000000000000100010000000000000010000000100000000100100001100010011000011101100010111000000001011000100110011110110011011010111110111101111110,XELMIAIKSFUJPR-UHFFFAOYSA-N
C(C1CCNCC1)C3=NC2=C(C=CC=C2)N3CC4CC4(C)C5=NC=C(C=C5)F,F700A08B108CB3F0_41E1A842D751599F_6034_UN,8.484725,00000000000000000000001000000000000000100010000000000000000000100110000000010101001101110001000010101100110110011001101011100100110000100110001011011011010110101111010,ZYKUOIXZADZNOM-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C(N=C2)NCC3N(C)CC4(CC3)CC4,775A58AEB1A30562_BA368D1C33A1DF21_6041_UN,8.22022,00000000000000000000001000000000000000100010000000000000000000000110000000010101001001110011010000101100010110011001101011100100110001110110001001011011010110101111010,IHLQKQKRFZCRSW-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C(F)(F)F)F)NCC(=O)C2C4CC3CC(CC2C3)C4,1214ABE1B706B717_621E3301ED53CC52_7022_UN,7.667199,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010000000100001100011100001000000000000000100011110000000011000011111110100111110,MNSHRMNCTKGRII-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,FAA060796FC79B3F_09772F7E5C479C0F_6041_UN,7.909072,00000000000000000000000000000000000000000010000000000000000000000000000000000000100001110011010010001100010110010001101000100100110001110000001011011011010110101111010,PFBAPELTCDGWSE-UHFFFAOYSA-N
N(CC1=CSC(=N1)C2=CC=CO2)C(C3CC4CNC3C=C4)=O,A46D3C9465BAE23B_DEB1A3D997992FEC_6038_DP,8.222368,00000000000000000000000000000000000010000000000100000100010000100100000000000001111100001010100111111000010000110000010011000100100100000110001001000001111110110111110,RZOPXNVXIOROJC-UHFFFAOYSA-N
C1(=C(C=CC(=C1)F)OC2CCCCC2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,8D8BBD7DA57AC49C_A6BCDE49CA6387ED_7022_UN,8.25074,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010101101011101111110011110110001111011111110111111111110,HPNCFRZYZVDMMR-VXKWHMMOSA-N
CC1(CCO1)C2=CC(=CS2)NC3C4CC5CC3CC(C4)(F)C5,B41302E61EA4EE45_E9B00E3F37F5DF0C_6041_UN,7.317937,00000000100100000000000000000000000010000010000000000000010000100010000000000000010100011010000010000100010101001001101010000000100011110100000001010001110011101111110,HUTLSPGERXSRQY-UHFFFAOYSA-N
N(CC1C3CC2CC(CC1C2)C3)[S](C4=C(Cl)C=CC5=C4[NH]C=C5)(=O)=O,8C87294DA9C37F54_1EC65BADCB840543_6029_UN,7.8687544,00000000000000000000000000000000110000000000000000010101001111001101010001000000111100011001001011001111011100001000010001001100111100101100001011001011010110110111110,NRLBEPHTDQDGAH-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)N[C@H]4[C@H](C3=C(C)[N](N=C3)C)C4,E766290D0C8D0019_87770BAE99CBB7FD_6041_UN,8.559032,00000000000000000000001000000000000000000010000000001000010000100100000010010000100100010010011010000000100111010000001011111100000011110110001010011111010011111111110,BLDFXGYCQPFNJL-BLLLJJGKSA-N
N3CCC(C)(COCCC2COC1(CCCC1)O2)CC3,F25ECB32A2AAA3EF_DC1808B4085A94FE_6039_DP,8.296495,00000000000000000000000000000000000000000000000000000000010000000010000010000000001100100101000010101000110011011001101011010010110010000110000000110001110101111101110,CKYLXTYKLWUWRM-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NCC4=CC=C(CN3CCN(C)CC3)C=C4,AF9F22FF6A6D3F37_F1B84A0D81C8FFDA_6041_UN,7.64977,00000000000000000000000000000000000000000010000000000000000000000000000000010001001001110011010010101100010100010001101011100100110001110110001011011001010110101111010,GVXQYQFXNYYJHV-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NCC(CC)C3CCOCC3,9CAF120BBFE6E4B5_0BA0D6F8C2EED4E2_6041_UN,7.486781,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110011000010101100010111000010101000000000110011110110000011010001010111101111110,ZHKUKQOWXMFZGF-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CC4(OCC3)CCC4,732D5AE966F6E460_FEC7BDCC592CFAA8_6041_UN,7.746567,00000000000100000000000000000000000000000010000000001000010000000110000000010000101100010011011010101100010101001000001011101100110011110110001001011001110111101111110,XOHPBZYBVRLJGG-UHFFFAOYSA-N
C1(=CC=C(C=C1)CCN2CCOCC2)NCC3(SC)CCN(C)CC3,30F2E5ED584143C3_E3725FAC2D64247A_6041_UN,7.637495,00000000000000000000000000000000000000000000000000000000010000001010000000010000011001101011010100101000000011011001101011100000110011010110001001011101010111101111110,OOMMCUXTCXSDMA-UHFFFAOYSA-N
CC2=C1N(C3=C(C(C1=CC=C2)=O)CCCC3)C[C@H]4[C@@H](CCNC4)C5=CC=C(C=C5)F,3093C73FCC310EC2_93CD53211653474C_6034_UN,8.043126,00000000000000000000000000000000000000000010000000000000000000100100000000010000101001110011000001101100110110010100001011100101110000100110001111011011111110101111110,BCLFTTMDTXOLGR-FPOVZHCZSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCCOC23CCOCC3)F)CC4,853BE9B775764980_7F8EC8E3AEFCE67E_6041_UN,6.884783,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110111010100101000110111011001101011100000110011110110001011011011110111111111110,MGIMZDFUWLNXNF-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CCCOC2)N3CCOCC3)F)CC4,5CF904A1F66DE8E4_E144D285C48B0EB4_6041_UN,7.643075,00000000000000000001000000000000000000000010000000000000010000100010000000010001101001110011010101101000000111011001101011100000110011110110001011011011010111111111110,UGTQXTQPKCECME-UHFFFAOYSA-N
CC1=NC(=CC(=N1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C4CC4,3949FCAC617BD4CD_5FE22792DD627F34_6041_DP,8.081753,00000000000000000000001000000000000000100010000000000100000000100100000000000100101000110011000000101000100100010000001011000100110101110110001001010011010110101111010,AEMLIJHRGJJVHO-FUHWJXTLSA-N
C1(=CC2=C(C=C1)OCCCC2=O)NC3=CC=CC4=C3[N](C)C=C4,C7868D93BEBE23C3_BA5925AF3C349E82_6041_UN,8.990205,00000000000000000001000000000000000000000000000000000000010000000100000000010001000101000100010010000100010001000100001011100101000011010100001111011001111011111111110,LBFUCTUPIXHSCT-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC2CC3(CO2)CCNCC3)C=CC(=C4)Cl)C5,4B0100873A61A730_EB943DF717D0E3D6_6034_UN,7.2794867,00000000000000000000000000000000000000000000000000000000010000000110000000010000101101110001010110101101110101011001101011100100110010100110001011011001110111101111110,YVUHTKGQGYCLBJ-UHFFFAOYSA-N
NCCC(OC1=CC2=C(C=C1)CNCC23CC3)C4=CC=C(C=C4)Br,C433125931EEFB55_85A9FB79E4DD9DD5_6035_UN,8.0336685,00000000000000000000001000000000000000000000001000000000000000000010000000000000001010110011000001101100110100011100001001000111110110100110001111010001110101100111110,YFCGYNNUDLXUHV-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)N[C@H]3[C@H](CCNC3)C4=CC(=CC=C4)F,47D9E2111E2A85F5_878D996E08E3D57B_7022_DP,7.760439,00000000000000000000001000000000000000000110000000000010000000100010000000000001001000110011000000101000100100011000001001000100110101110110001011010011010010100111010,PPHCOEBIHQQQDC-YLJYHZDGSA-N
C(CCC1CCOCC1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,7CDF309766FAF70C_0AFD2923A6383AB1_7019_UN,7.8065176,00000000000000000000000000000000000000000010000000000000010000000000000000000000000001110000010010110000000111010000101000100000110011110110000011011010010111101111110,XGCXKUFCECNREG-UHFFFAOYSA-N
O(C(CC1CCOCC1)C=C)CCN2CCN(C)CC2,2F531E0117A6355F_23F00600C5C52B3E_6039_UN,8.118633,00000000000000000000000000000000001000000000000000000000010000000000000000010001000001100000010100111000000001010001101011100010110010000110001001011000110101111101110,TYKHJRATFCVXST-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CN=C2NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,49793758DB588FD2_CB42883CA9CC8C42_6041_UN,8.629306,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,UHARTULXPBROJU-IERDGZPVSA-N
BrC1=CC2=C(C=C1)N(C=C2C3CC3)CC4(CC)COCCN4,90BF50933E988A43_999BEA44EE17C95C_6034_UN,8.458694,00000000000000000000001000000000000000000000001000000000010000100110000000010001001101110001000111101100110111011010101011100100110010100110001001011001010111101111110,VRDQPHSXADDDNT-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2=C(C=CC=C2)F)NC[C@@H]3CCCN(C)[C@H]3C4=CN=C[N]4C,473893EF6E4DB3F9_E0544717B1A8B339_7022_UN,7.7137537,00000000000000000000000000000000000000000010000000000000000000100100000000010101101101110011010010101000000110010001101011100100110001110110001011011111010110101111010,NXOBVJGFKUZPCX-FDDCHVKYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=CC=C(C=C2)CC3=NN=C4CCC[N]34,59A1C3DAE73607B6_C124D7B37094BA38_6041_UN,8.375017,00000000000000000000100000000010000000100000000000001000000000000100000000100101100101100000011010101100010000011000001011101100110001010100011011011111010110101111010,GWRKQAUSIQNNPZ-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3C4CCCC3COC4,A99381A11234A3E9_0FDEF54D87FFEDB1_6041_UN,8.058539,00000000000000000000000001000000000000000010000000000000010000000100000000010101000101110011010011100100011101000000001011100100110001110110001011011011010011101111110,FQBUILCJIMMKFT-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC4C(C)(C4)C5=C(C=CC=C5F)F,103AE478B895BDBC_EF806AA93280094E_6041_DP,8.367567,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011001100011100100110101110110001011001111010010101111010,DRBJSABBDIRXTD-BKZZUPSISA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,39697567C8A8D1A5_20C6B028F148DA10_7022_UN,8.08107,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101001000100010000001011101100110001110110001011011011010110101111010,KULRPIJRPRYTQE-VGSWGCGISA-N
FC1=CC3=C(C(=C1)C=CC2CCCC(CC)C2)OC(OC3)C4=CC=CC=C4,EFB51114D45F30F4_9D832B464A3AB3BD_7019_UN,7.964332,00000000000000000000000000000000000000000010000000000000010000100000000000000000000000010100000000110100010111000110101010010100110000100100000011010000110101011011110,FSGHUNWZZYRCGZ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CC3(CC2)CCC3)Cl)C4CC4,C735C55BA39B6BBA_C625E455D1E6F205_7022_UN,7.6665196,00000000000100000000001000000000000000000000000000000000000000100010000000000000000000010011000010000001110110011000001000000000110001110000000010010011000010101111010,WWJMNMZKUAODGG-UHFFFAOYSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,B0370B366B0E75B9_79E541E81ADC6F9C_6041_UN,8.114996,00000000000000000000001001000000000000000010000000000000000000100100000000010101101101010011010010101100011110010000001011100100110001110110001011011111010110101111010,DFAHPXONCKNKGK-KUHUBIRLSA-N
CN5CCC1=C(C4=C(N1CC2(CC2)C3CC3)C=CC(=C4)Cl)C5,60DB77FDB25EF962_EE3BDAB185969DE1_6034_UN,7.7465568,00000000000000000000001000000000000000000000000000000000000000100110000000010000100101110000010010101101010100011001101011100100110000100110001011011000010110101111010,KCDSVXGKHQMHQJ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C3=C([NH]2)N=CN=C3NC4CCN(C)C45CCCNC5,7343C3782EB619D4_29A81ACA9788B089_6041_DP,8.477988,00000000000000000000000000000000000000100010000000000100000000000110000000010101101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,UCNFZJQGZMGWPH-UHFFFAOYSA-N
NCCC(OC1=CC2=C(C=C1)NCCCC2)C3=CC=C(C=C3)Br,5AE61834404F6BDD_F32D4E1274C87748_6035_UN,7.97423,00000000000000000001000000000000000000000000001000000000000000000000000000000000001010010011000001001100110100010100001001000111110110110110001111010001110111100111110,NTEZYTFXJZSUHS-UHFFFAOYSA-N
N4CCC1(CC1C=CC2=C(Cl)[N](C(=N2)N(C)C)C3=CC=C(C=C3)F)CC4,2ECBC02E88E80916_7213FE039BFB74B9_7019_DP,7.5461907,00000000000000000000001001000000000000000010000000000000000000100110000000110101001101110001010010111001111100011000001011100100110001110110001011011111010010101111010,AMTSZFYRNVLSAG-UHFFFAOYSA-N
FC2=C(C=C1C=CC=CC1=N2)NC3CCN(C)C4CCCC34,9D61C4E84582405C_52EED2C68138CC46_6041_UN,8.725565,00000000000000000000000000000000000000000010000000000000000000000100000000010001100001110011010010101100110110010001101011100100110001110100001011011011010010101111010,STIDGWSZFQJXDG-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC23CCC(CNC2)C3)Cl)C4CC4,0BBFA52C1593FFED_B4EE1AC174C2095D_7022_DP,7.215433,00000000000000000001001000000000000000000000000000000010000000100010000000000001001000110011000010101001110110011000001001000000110101110110001011010011010010101111010,OIQDSCMVARMIDI-UHFFFAOYSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=C(C=NC=C1I)I)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,3F60BB3E2EBF9BDA_A34EAD9CA57C2C60_6035_UN,9.093291,00000000000000000000000000110000000000000000000000100000000000100110000000001000000000010000000011110100010110001101101011000111110010100100001111010110100001001111110,QCNWLFPFFNEUDL-FLQCZVMJSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC[C@@]34CCCN[C@H]3CCCC4,781AF1B661D5132C_AD83A6BFD51C38A7_6041_DP,8.278939,00000000000000000000000000000000000000100010000000001100000000100110000000010101101100010011011010101100110100011000001011101100110101110110001011011011010110101111010,YWZKTMHKGCGYBM-PKOBYXMFSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=C(C=NC=C1Br)Br)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,09D5EC8CED44F297_8B183206AB2F03F6_6035_UN,9.093288,00000000000000000000000000100000000000000000001000100000000000100110000000001000000000010000000011110100010110001101101011000111110010100100001111010110100001001111110,KZYZXDHAVBVDNY-FLQCZVMJSA-N
CN1CCC(CC1)[N]2N=CC3=C2N=CC(=C3)NC[C@H]4[C@H](CCNC4)C5=CC=C(C=C5)F,2F39CB904BF12692_7E2E5A6492D35729_6041_DP,7.806283,00000000000000000000000000000000000000100010000000001100000000100100000000010101101101110011011010101100110100010001101011101100110101110110001001011011010110101111010,LIJPDOLCHYXPBY-WMZHIEFXSA-N
FC2=C1N=CC=CC1=CC(=C2)NCC3CCCN(C)C3C4=CC=CS4,1D00D69F19B275B3_5DBB9533E52F33D8_6041_UN,8.561238,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,QULVSVOZITXOFS-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NCC3CCCN(C)C3C4=CC=CS4)C,6433AAE87C3D49EC_101A330CB1195BA6_6041_UN,8.293028,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110011011011111010110101111010,RSQOLWXCSMCKRQ-UHFFFAOYSA-N
CC1=C[NH]C2=C1C=C(C=N2)NCC3CCCN(C)C3C4=CC=CS4,4CC3958851B3CBE5_76A48E49DBC3C207_6041_UN,8.615212,00000000000000000000000000000000000010100000000000000000000000100100000000010101111101101011010010101100010010010001101011100100110101010110001001011111010110101111010,LYGGQOSLYBXKCB-UHFFFAOYSA-N
COC1=C(C=CC(=C1)C(F)(F)F)NCC23COC(C2)C=CC3,7F86B2E44B0EE75B_36FBD016E73FE528_7022_UN,8.154113,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100000010010111011000011101001100000000000011110011110110000111000011110111111111110,PQQFYLZPCBYPNB-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NC24CC(OC23CNC3)(C)C4)CC=C,D921985BA990A495_0E875170405D1FBE_6041_DP,7.514975,00000000100100000000000000000000001000000000000000000100010000000010000000000000101100100011000111011000110010011001100011000000110111010110001010000111110111101111110,GZSGNYHRFMLLCI-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NC(CC)C2CCCCO2)C3CC3,83FCA30239201930_A2C2A7D1454D6BEA_6041_UN,7.7821236,00000000000000000000001000000000000000000010000000000000010000100000000000000000000000010011000100100000100111010010001000000000110011110100000011010011110111101111110,JJNFMNPWWKGTKL-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NCC2N(C)CC3(CC2)CC3)F)F,3F9BF069F6213473_4B69C597735D1B0B_7022_UN,7.9627047,00000000000000000000001000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011111010110101111010,BRZCFUHGFPWDMY-UHFFFAOYSA-N
CC4CC1=C(C=CC(=C1)NCC2CCN(C)C2C3=CC(=C(C=C3)Cl)F)O4,123D0194D47DD78C_C90F6F4D2DA5AA46_7022_UN,8.405496,00000000000000000000000000000000000000000010000000000000010000100000000000010000101101110011010010001101010110010101101011100100110011110110001011011111110111101111110,XYUHQXMERQWONA-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NCC3(CCNC3)C4CC4)C,DDEFFE6C8C4DB414_A7382C136BDEB434_6041_DP,8.4088545,00000000000000000000001000000000000000000010000000000100000000100110000000000000101100110011000010101100110110011000001011000100110101110110001011010111010110101111010,XSQLYSWSEQYCTR-UHFFFAOYSA-N
CC(C)C1=CC2=C(C=C1)N(C(=C2)C)C[C@H]3[C@@H](CNC3)C4=CC(=CC=C4)F,F6DF6458EB8408F6_C89EC53BDC3BCEC1_6034_UN,8.486414,00000000000000000000000000000000000000000010000000000000000000100100000000110000101101110011000010001100010100000000100011100100110000100110011011001111010110101111010,WVZPSGHNBPDTPH-UNMCSNQZSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)N[C@H]3[C@@H](C3)C4CCCCC4)C,C3E8784013D7AA65_9457D91C85418A6E_6041_UN,8.610114,00000000000000000000001000000000000000000010000000000000000000100100000000000000100000010011000000100100110100010000001001000100110001110100001011010111000010101111010,JRTSEJXHJHGPPA-QFBILLFUSA-N
N(CC1C2CCC(C1)C=C2)C(C3=C(C=C(CC)C=C3)F)=O,3375671E79DE3A04_165E84B64C839D32_6038_UN,8.577307,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011000010100100010011000000000110000100000000011010011011110101111110,RLHUZYHWYWPGTO-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)C#N)F)NCC2C(CCNC2)(C)C,D429D284B5D354FA_6A84A7AB0EE9FFF6_7022_DP,8.325487,00000000000000000000000000000000000000000110000000000100000000000010000000100000101000110011000000101000100100011001101001000000110101110110001011010111010110101111010,PBAKGTJRGIGIII-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CC=N2)NCC(N3CC(C)OC(C3)C)C4=C(C=CC=C4F)F,175845D9C6AFBD69_47700DA946952C3A_6041_UN,8.56089,00000000000000000000000000000000000000000010000000000000010000000100000000010001101101110001010110101100010110010001000011100100110011110110011011001111110111101111110,NTTJTPVGUDJQPY-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCCCC2C3=CC=CC=C3)Cl)C4CC4,C1C7985FF4FC4C8B_CCAA2EA990A7EBF4_7022_UN,7.7152867,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010011000000001001000110000000001000000100110001110000000011010011010110101111010,QMNIVPUQZHWIMN-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C3=C2C=CC=CC2=C(N=N3)NCC4CNCC(O4)(C)C)F,5370196C88E3EC40_D24858D43F50CAA6_6041_DP,8.243242,00000000000000000000000000000000000000100010000000001100010000100110000000100101101000110010001100101100010110001001000011001100100111110110001011000111110111101111110,WEIBUBVFOIHGJM-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@@H]3C[C@H]3C4CCNC4)Cl,64866053F7E699B4_4EA46399309BE6B8_6034_DP,7.752193,00000000000000000000001000000000000010000000000100000000000000100100000000010110011101111011000010001001101100010000001111100100110101110110001010011011010110101111010,HEFGWQWEMFRPEY-ZWBSKUQPSA-N
N3CC1=C(C=C(C=C1)NCC2(CN(C)C)CCCC2)C3,C0D265B54B86A2E7_69DE3E0B234C1235_6041_DP,7.21495,00000000000000000000000000000000000000000000000000000000000000000010000000100000101101100011010010001100010010001001001001100000110101010110001010011101010110101111010,ZOYUQLKOPNOXAO-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(C)CCC2)F)CC3,EFFF19334D1A1F8A_F60FB07B23851382_6041_UN,7.8944507,00000000000100000001000000000000000000000010000000000000000000000010000000010001101001110011010000001000000110011001101011100000110001110110001010011111010110101111010,QBBWUVVIWLJRJZ-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)N[C@@H]2CCN(C)[C@H]2C3=CC(=C(C=C3)F)F)C4[C@@H]5CNC[C@H]45,65C8AEDF2DC3B2E3_05F9D4290500F199_6041_DP,8.462193,00000000000000000000001000000000000000100010000000001000000000100100000000010101101101110011011010101000110110010001101011101100110101110110001011011111010110101111010,PFCQWSVIVMKCON-XODXUGTQSA-N
CC2=C1C=C[NH]C1=C(C=C2)NCC3N(C)CC4(CC3)CCC4,67D5405232E135B2_10241D657ADABFA3_6041_UN,7.8939414,00000000000100000000000000000000000000000000000000000010000000000110000000010001001101100011010010101100010010011001101011100100110101010110001001011111010110101111010,DJMMVHURKBLESK-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC3CC4(CC3)CCCCC4,06724FB2E647DAA6_95E7510A3BC76C84_6041_UN,8.307511,00000000000000000000000000000000000000000010000000000000000000000110000000000000100000010011000010100100110100011000001001000100110001110100001011010011000010101111010,JAEGSQNESTXHQO-UHFFFAOYSA-N
C2(=C1OC=CC1=CC=C2F)NCC3CCC(C)(CCC3)C,5986782734AE0D28_31BA5D1D76555F48_7022_UN,7.741924,00000000000000000001000000000000000000000010000000000000010000000010000000100000001100010011000110001100010110001001101000000100110001110100000010010111110110101111110,XBGPARTYDSBANV-UHFFFAOYSA-N
BrC2=C1N(C3=C(C1=CC=C2)CSCC3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,B4E548291FAE0995_95D2897F8E33F9AC_6034_UN,8.549204,00000000000000000000001000000000000010000000001000000000000000100100000000010101100101111000010010101100010100010000001011100100110001100110001011011010010110101111010,LPICYRAZTZODFC-MWTRTKDXSA-N
FC1=CC2=C(C(=C1)F)C(=C(C#N)C=N2)NCC3C4(CCNC3)CCOCC4,C1AB98F2102741C7_C849E7D9B3161BD3_6041_DP,8.262405,00000000000000000000000000000000000000000110000000000100010000000110000000000000101000110011000000101100110101011000001011000100110111110110001011010011010111100111110,NSEDGRVUIBBSQX-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC4(C3CCNCC3)CCOCC4,AE55F8040C35CC95_832A3C910AD6ECBF_6041_DP,7.3135448,00000000000000000000000000000000000000100000000000000000010000100110000000000100001000100011000000101100110011011000001011000100110111010110011011010111010111101111110,DQLFKWIHZPWKSL-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3CC2(CCN2C)C3)F)CC4,98176F9601C9A5AB_47BA0396CF6F7C54_6041_UN,7.6264367,00000000100100000001000000000000000000000010000000000000000000000010000000010001101001110010010000001000010110011001101011100000110001110110001010011111010110101111010,ZPNYVAZQDQPMTG-UHFFFAOYSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NCC34CC(C)(C3)CO4)C5,3F1BB6CED0015E1D_8C77FCDE278632FB_6041_UN,7.1517954,00000000000100000000000000000000000000000000000000000000010000000110000000010000101101100011010110101100110011011001101011100100110111010110001011011101110111101111110,VKYITHBGBUOTRJ-UHFFFAOYSA-N
NCC1=CC2=C(C=C1)C(=O)C=CN2CC3NCCC4=C3C=C(C=C4)Br,FEF8A526BFEB0E48_24011AE77704511C_6034_UN,8.773914,00000000000000000000000000000000000000000000001000000000000000000100000000010001001011010001000001101100110100010100001011100101110100100110001111011001111110100111110,DWBXRKGIYAGGCI-UHFFFAOYSA-N
C([CH]2C[C]1(C[CH2]C1)C2)=CC3=C[N](C)N=C3C4=C(C=CC=C4)Cl,E4E7D19A4038762F_1A4A11987492DE23_7019_UN,7.5133204,00000000000100000000000000000000000000000000000000001000000000100110000000010000100100010000011010010001010100001000001011101100110000100100001010011010000010101111010,CEVQZLMRGZQKCV-UHFFFAOYSA-N
[NH]1N=CC2=C1C(=CC(=C2)NC4C[C@H]3CCC[C@H](N3C)C4)F,ACAADD41142DA3D5_5E495A510E44CF52_6041_DP,7.7528534,00000000000000000000000000000000000000000010000000001000000000000100010000010000100101010001011010100100110110010000101011101100110101110100001001011001000010101111010,VPNUOFVLESVOKT-AGUYFDCRSA-N
ClC1=C(C=C(C=C1)CCC=CC2CC(C)(C)OCC2)Cl,7C9D16ED2554DF0B_F1FD64161A06BF88_7019_UN,8.086853,00000000000000000000000000000000000000000000000000000000010000000010000000100000000000010000000000110001000111001001101000000000110010100100000011010110110101001011110,PCWRGJAKVIGQIS-UHFFFAOYSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)C[C@H]4[C@@H]3CNC[C@@H]3C4,9CE524A84DF6900C_F417199CDC6E8BB2_6034_UN,8.469484,00000000000100000001000000000000000010000000000100000000000000100100000000010110011101111011000010001001011100010011000111100100110001110110001010001111010110101111010,SPNJQSQSUNOSLD-ROOJKOGMSA-N
N(CC1C2CCC(C1)C=C2)C(=O)C(=CC3=CC(=CC=C3)F)F,5BCAEA0151AA5403_FC7C10A28C7639E5_6038_UN,7.7842984,00000000000000000000000000000000000000000010000000000000000000000000000000001000001000010011100000011000010100100000011000000000110000100000000001010001011110100111110,TUTAGMZGTDKCSO-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC3CC4(CC3)CCC4,31BF224B204ACD11_5C4A326E88D966C8_6041_UN,7.8538723,00000000000100000000000000000000000000000010000000000000000000000110000000100000100000010011000010100100110100011000001001000100110001110100011011010111000010101111010,XVPRTTRJIPYOJC-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC4CCCN(CC3=CC=CS3)C4,355913526CE91E90_F9D36477B0DD41A0_6041_UN,8.213009,00000000000000000000000000000000000010100000000000000000000000000100000000010100111101101011000010101100010010010000001011100100110001010110011011011111010110101111010,UZWZPJAWAAPHTJ-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC3CNCC(C3)(C)C,48198EB77F779908_24352CD12F92C32A_7022_DP,7.8227706,00000000000000000000000000000000000000000010000000001100000000000110000000110000101100110010001010101000000110011001000011101100100101110110001011001111010110101111010,JXRUSWSLTDULDN-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NCC(OC)C3CCCO3,F47844F9A6911884_5204340E330E09D5_6041_UN,8.252501,00000000000000000000000000000000000000000010000000000000010000000100000010000001001100010001010111101100010111000000101011000110110011110110001011010011110111111111110,GLDWCKYWXHBTQG-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(=O)CCC3=CC(=C(C=C3)Cl)F,C4643AA2AEFE410A_0FC8B55245A7E1A0_6038_UN,7.8293567,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001001110100110000011000000000110010100000000011010011011110100111110,KPCJIWQWHJVCTE-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(=O)CCC3=CC(=C(C=C3)Br)Cl,887024FD78C377BB_64CC93CE133EE3B3_6038_UN,7.829353,00000000000000000000000000000000000000000000001000000000000000000000000000000000001000010011100010001001110100110000011000000000110010100000000011010011011110100111110,JPFBPMMWQIRWQV-UHFFFAOYSA-N
CC2=C1N(C3=C(C(C1=CC=C2)=O)CCCC3)C[C@H]4[C@@H](CNC4)C5=CC(=CC=C5)F,FE60CAAD44F092AF_E31A46E3254A931E_6034_UN,8.001642,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000011101100010110010100001011100101110000100110001111011011111110101111110,MXPALHROXIOWCC-AVRDEDQJSA-N
N(CCC1CC2CCC1C2)C(=O)CCC3=CC(=C(C=C3)Cl)Cl,31E3C3923E508E32_1E950EDBD0CDAAFB_6038_UN,7.8293476,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010011100010001001110100110000011000000000110010100000000011010011011110100111110,ZIMJCMCVHRFJLI-UHFFFAOYSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC3=C[N](N=C3C4=CC=CC(=C4)C)C5=CC=C(C=C5)F,CCEB65932266750B_0BFA8766698C2168_7019_UN,8.341343,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010000001010010000000100000000000011101100110001110100001011011010000110101111010,YJPZEQIAEDGLBN-DVECYGJZSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)N[C@H]3[C@@H](C3)C4CCOCC4,02270EEDCD233E69_9915951A5FF9374C_6041_UN,8.059953,00000000000000000000001000000000000000100010000000000000010000100100000000000100000000110011000000100100110101010000001011000100110011110110001011010111010011101111110,UXXJVTIOKREOCN-WMLDXEAASA-N
FC2=CC(=C1CCCC1=C2)NCC3CCN(C)C3C4=CC=CS4,3E3BEEB662A1871E_945CDEE77B5AF10D_6041_UN,7.9350133,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010001100010110010001101011100100110001110110001010011011010110101111010,GWNCFMQWFHPWOC-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@@H]2CCO[C@H]2C3=CC=CC=C3)Cl)C4CC4,7DC6064E0FB59BD3_63B99FABBD2AE4A9_7022_UN,8.712058,00000000000000000000001000000000000000000000000000000000010000100000000000000000000100010011000111000001100111010000001000000100000011110100000011010011110011101111110,PJAWHJMFVWKRED-QUCCMNQESA-N
FC1=C(C(=C(C=C1)F)CC#N)NC(C2CNC2)C3=CC=C(C=C3)F,1847838EB8423552_372A6BCBE0C0A5E7_6041_DP,7.6895156,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110010000000001000000100010000000001000100000101110110001011000011010110100111010,NOHKCOQRABDKEC-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)NCC(C2CCNCC2)C3=CC=CC=C3)F)C#N,B425E17AD3987075_4ED827B00E8D0A47_6041_DP,7.7891417,00000000000000000000000000000000000000000110000000000000000000000000000000000000001000110001000000101000100100010000001001000100110101110110001011010011010110101111010,DAPUHGLBFKPJTJ-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC4CC(OCC4)C5=CC=C(C=C5)F,B18262D1AC8AB469_B6C75CED9AD84F09_6041_DP,8.256069,00000000000000000000001000000000000000100010000000000000010000100100000000000101101101110011010011101000110111010000001011100100110111110110001001011001110011101111110,OASREPWIJNXIAF-WHWMZARZSA-N
NC4CCC1=C(C3=C([N]1CCC2CNC(C2)(C)C)C=CC(=C3)Cl)C4,01794A971F8B5F9B_946161040C3B9302_6034_DP,7.9024835,00000000000000000000000000000000000000000000000000000000000000000110000000110000001111010011000010001101110110011001101011100100110101100110001011011101010110101111010,JXMSHOVTFCOXRR-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@H]2[C@@H](C2)C3=CN=CC=C3)Cl)C4CC4,F59B6F29729F7617_224AD4852293385A_7022_UN,8.492434,00000000000000000000001000000000000000000000000000000000000000100100000000000000001000010011000000101001000110000000000001000100010001110100001011010011010110101111010,XEWADJMZLLTSJR-RDJZCZTQSA-N
N1CC5(C1)CCN(CC2=NN=C(C=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F)CC5,5ED6EFC78CF9FE96_65320281B9A59283_6041_DP,8.178241,00000000100100000000000000000000000000100010000000001000000000100110000000010101101101110011011010101000110110011001101011101100110101110110001001011011010110101111010,SSKKMMGZOOAZCZ-IRLDBZIGSA-N
C(C1COCCN1)C2=C[N](C3=C2C=CC=C3)CC4(CNC4)C,758697B3AAED6823_0BE25444BCA4BDAE_6034_DP,7.892462,00000000100100000000000000000000000000000000000000000000010000000110000000010000101101100011000110101100110001011001001011100100110110000110001001011001010111101111110,AIQLAQVZXUKAGT-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CC2CCSC2(C)C)C=CC(=C3)Br)C4,AB0E3103ECCA34E9_21B3ACE71D0B629C_6034_UN,8.25186,00000000000000000000000000000000000010000000001000000000000000000110000000110000010101011000000010001100010110011001101011100100110000100110010011011110010110101111010,IGQDMCAPZTUNLL-UHFFFAOYSA-N
O(C3CCN(CC1=CC=CC=C1)C2(CCC2)C3)CCC4CC(C)(C)OC4,4D2553F8E2B6AAC0_60F47A0A09B84783_6039_UN,8.214613,00000000000100000000000000000000000000000000000000000000010000000010000000110000000101100000000011101000010011011001101011100011110010000110000101011100110111111111110,JMKADGBTAWZBQI-UHFFFAOYSA-N
BrC1=CC2=C(N=C1)N(C=C2C3CC3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,F645F8CD69EE0882_D2E2A1EC2D2F96E5_6034_UN,8.437922,00000000000000000000001000000000000000100000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,ODKKCOZFSJCEBE-ZHRRBRCNSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCCC3)C4=CC=C(C=C4)F,2DFD60B3A6CAE534_8E1D3B8064D0C639_6041_UN,7.7369633,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100010001110100001010011011000010101111010,DNTLGCDSOFVSEK-UHFFFAOYSA-N
CC1=C(C=CC=C1)NCC2=NC=CN2CC3CC34CCC(F)(F)CC4,9B4806922A951F6B_9C1FCF5A641AC004_6034_UN,8.361849,00000000000000000000001000000000000000100010000000000000000000000110000000010101001101010001000010001000010110011000001011100100110001110110001011011011010110101111010,OLFHELNDPFILAK-UHFFFAOYSA-N
C2(=C1CCCCC1=CC=C2)NCC3CCN(C)C3C4=CC(=C(C=C4)Cl)F,CB97E76A6C0F8735_57D40C0AB410DD2D_7022_UN,8.644528,00000000000000000000000000000000000000000010000000000000000000100000000000010000101101110011010010001101010110010001101001100100110001110110001011011011010110101111010,NMSCEDTVTGOWCN-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NCC23COC(C)(C2)CCC3)F)F,54003CE2D6823D9A_56B8D4648A6EDB62_7022_UN,8.026121,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100010011000011001000010111001001101000000000110011110110000011010111110111101111110,KPXUVCVRBOFPKE-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC4CC3(CCN3)C4,F39177709D6A8D3E_E355F0A28435D6BD_6041_DP,7.7368264,00000000100100000000000000000000000000100010000000000000000000000110000000000100001000010011000000101100110110011000001011000100110101110110001011010111010110101111010,RBXYTZGENZYGOE-UHFFFAOYSA-N
CC1=C(N=C(N1C[C@@]23[C@](CCC2)(F)CNC3)C4CCCN4)C5=CC=CC=C5,0A0512E5FF11F703_A6E1E41C94727141_6034_UN,8.66905,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101110011000010001100110100011000101011100100110100100110001010011011010110101111010,GMXUJZXKPIHUSY-IPKCRJEZSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3C(CCCC3)C4CC4,0EDF426D4A140600_7649BEE37594B625_6041_UN,7.970848,00000000000000000000001000000000000000000010000000000000000000100100000000000001001000010011000000101100010110000000001001000100110001110100001011010011010110101111010,XUUTUZRZOCROHO-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCC2=C(C3=C(C=C2)CCCC3)F,65C5EEF610B076CC_923789785173BFB0_6041_UN,7.414058,00000000000000000000100000000010000010000010000000000000000000000000000000100000011100111000010010001100010100001000001000000100110001110100010011011111010110101111010,VDPAWGUHGOIXSW-UHFFFAOYSA-N
FC2=C1N=CC=CC1=CC=C2NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,A7DD9DCAE5DEAF96_A803A20A3E7DE3A8_6041_UN,8.365142,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,AWNJNNBFTZHVLL-ZHRRBRCNSA-N
N(C2=C1CCOC1=CC=C2)C(C4=CC3=C(C=C(SC)C=C3)[NH]4)=O,4E86AAED9CE9B1DF_8865BD6BBE865360_6038_UN,9.039703,00000000000000000000000000000000000000000000000000000010010100001100000000000001010100001011110111000100010001100100011011000100000111010100001011010001111011111111110,MFZYVGKKRQIKQB-UHFFFAOYSA-N
C([C@]12C[C@H]1COC23CCC3)=CC6=CC4=C([N](N=C4C)C5=CC=CC=C5)N=C6Cl,9E2F055E6706C9D7_703CD77512E3996A_7019_UN,7.8002844,00000000000100000000001000000000000000100000000000001000010000100110000000010101100100010000001010110101010101001000001011101100110011110100001011011010110011101111110,AGBDGHNMHAQUEX-JTSKRJEESA-N
BrC1=CN=C(N(C1=O)C[C@@H]2CNCC[C@@H]2C3=CC=CC=C3)C4CCC4,9D41BC03B3C8B9C3_AA73B0C4B20D311A_6034_UN,8.437796,00000000000100000000000000000000000000100000001000000000000000100100000000010100101001110011100001101000100100110100011011100101110000100110001111011011011110100111110,MVVZXGOQAVBLBW-DLBZAZTESA-N
C[N]1N=C(C=C1NC2C3=C(CCC2)[N](N=C3)C4=C(C=CC=C4)F)C5CCCC5,521697F0A9861BE0_91EC5DE4A4118FD8_6041_UN,8.21851,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011011010000100110100010000001011101100111001110100001011011011000010101111010,NWVAEPSZGPKYDJ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2C3(C2)CCOCC3)F)CC4,8506853C7BC6C935_108FE9FCC4C6B071_6041_UN,6.847968,00000000000000000001001000000000000000000010000000000000010000000010000000010001100001110011010000101000110111011001101011100000110011110110001011011011010111101111110,IHOQHVSKNOOIPJ-UHFFFAOYSA-N
O(C3CCC4C1CC(C2OC12)C34)CCN(C)CC5=CC=C(C=C5)F,03EFB41CB356919E_C4A0A8EA4EBCA773_6039_UN,8.611167,00000000000000001001001000000000000000000010000000000000010000000000000000000000000001110000010110101100010101010001101000100011110010100110000101011000110101111111110,SUYGPZFOMRORIS-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C(C3=C(C)C4=C([NH]3)C=C(C=C4F)F)=O,12E59D04B7D6E43E_FE40503F1106C8CF_6038_UN,7.920806,00000000000000000001000000000000000000000010000000000010010000000100000000010001001101110001100110101100110100110000011011100100110110100110001011011011111111111111110,TZYQRYZFFXQABM-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3(C)CCNCC3)Cl,E984272A9FC76463_116DD3A3A190E28C_6034_UN,7.982277,00000000000000000000000000000000000010000000000100000000000000000110000000010110011101111011000010101001101100011001101111100100110101110110001011011111010110101111010,XFMUVYZLUSIHRY-UHFFFAOYSA-N
CCC1=C(C=CC(=C1)F)NC2CC3CC2C4CCCC34,3C964BCD91A5D1C4_4E0470067BDA16DD_6041_UN,8.319932,00000000000000000000000000000000000000000010000000000000000000000000000000000000000000010011000010000100110100010010001000000000110001110000000011010011000110101111010,ICLRBICTGHHJMK-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CC3(CCNCC3)C4=CC=CC=C4)CC#N)F,8CF567C6729E9957_351D777C16A33582_6034_UN,7.7709856,00000000000000000000000000000000000000000110000000000000000000100110000000010000001101110001000010101100110100011000001011100100110000100110001011011011010110100111010,FXQZVTYNKWJUCQ-UHFFFAOYSA-N
FC2=C(C=C1C(=C[N](C1=C2)CC3(CCNCC3)C4=CC=CC=C4)CC#N)F,8CF567C6729E9957_05FE1E9A5AC8DFC0_6034_DP,7.7709613,00000000000000000000000000000000000000000110000000000000000000100110000000010000001101110001000010101100110100011000001011100100110000100110001011011011010110100111010,FXQZVTYNKWJUCQ-UHFFFAOYSA-N
CC4=NC1=C(C=C(C=C1F)NC3CC2CCC(N2C)C3)O4,4E44C579D149DD52_C0F0435E4A846D7C_6041_UN,8.032875,00000000000000000001000000000000000000000010000000000000010000000100000000010000100101010001110111100100110110110000111011100100110001110100001001011101100010101111110,SMTKVBYMIXMGDA-UHFFFAOYSA-N
C([C@]12C[C@H]1COC23CCC3)=CC4=C([N](C)C5=C4C=CC=C5)Cl,75A73F50F3F7965E_C3CD6F99CF24135B_7019_UN,8.463325,00000000000100000000001000000000000000000000000000000000010000000110000000010000000101010000010010110101010101001000001011100100110010100100000011011010110011101111110,FFNYVMVLOCJPHX-UGSOOPFHSA-N
CC1=C(C=C(C=C1)CC#N)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F,D824B5BF7F026C68_4A57EDCC4D5581F8_6041_DP,7.5239115,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110101111010,CHQPVOLDYAATPM-OXQOHEQNSA-N
O(C(CC1=C(C=C(C=C1)F)F)C#N)CC3CC2(CCNCC2)O3,09AB61FF40BF6DAC_520EE4049B8D4F07_6039_DP,8.19838,00000000100100000000000000000000000000000110000000000000010000000010000010000000001000110001000101101000110101011000001011000010110010100110001011010011110101110111110,ARIHOBPBOOEZPJ-UHFFFAOYSA-N
CN3CCN(CCOCC2COC1(CCCCC1)O2)CC3,4960E15E425793BE_95C439DCF0899223_6039_UN,6.811293,00000000000000000000000000000000000000000000000000000000010000000000000010010001000101100100010110101000010001011001101011110010110010000110001001111000110101111101110,ANHHXFJQKXELSR-UHFFFAOYSA-N
FC2=C1N=CC=C(C1=CC=C2)NC4C[C@H]3CCC[C@H](N3C)C4,0D8188BB6F9596D5_275F4A70FEF9E9E6_6041_UN,8.101545,00000000000000000000000000000000000000000010000000000000000000000100000000010000100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,PFCWKLYXDDYLDZ-AGUYFDCRSA-N
N1CC3(C1)OC4(COC2=C(C=CC=C2)OC(F)F)CC3(N)C4,2AE11CA6CBBB6103_93951720908584D5_6035_DP,8.011515,00000000100100000000000000000000000000000010000000000100010000000010000010000000101110100011000111001000111101011100000011000011110111100110001110100011110111110111110,KFPZGFMZGGGTIB-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2C3(CC2)CCOCC3,5D96CD34F85D60D5_652A20BC6297524C_6041_UN,7.3805475,00000000000100000000100000000010000000000000000000000000010000000110000000100001001000100011010000101000010001001000001011000000110011010110011011011111010111101111110,ORGCKIAKTTZFNI-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NC3=C2CCCCC2=NC4=C(C)C=CC=C34,83808D86888F8056_A859D5C9D3C4DF2C_6041_UN,7.988867,00000000000000000000100000000010000010000000000000000000000000000100000000100000110100101011010010100100010000011000001011000100110001010100011011011111000010101111010,FKQDBFCIQDUOTP-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NC[C@]23CC[C@H]2CCCN3,4CD732082CE5CD2A_03EF04F461694B43_6041_DP,8.109171,00000000000100000100100000000010000000000000000000000010000000000110000000100001001000100011010000101100110000011000001011000000110101010110011011011111010110101111010,CGPWQNBTSIWCBB-CRAIPNDOSA-N
CC1=C(C=CN=C1F)NCC2CCCN(C)C2C3=CC(=CC=C3)Cl,6AF0143613C9A81A_25F6E065E5F7701A_7022_UN,8.064098,00000000000000000000000000000000000000000010000000000000000000100100000000010000101001110011010000101001000110010001101011100100110001110110001011011111010110101111010,AMBNTPNLSGYTGP-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NCC3CCCC(CC)CC3,1E75C953C3AD66FB_400EBA44295C6258_6041_UN,8.045706,00000000000000000001000000000000000000000010000000000000000000000100000000000001001000010011000000101100010110000010101001000100110001110100001011010011010110101111010,QVDOTELBJFEHON-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC2C3(COCC2)CCCC3,EC18291AAF50C626_3B1B704F34BDECCA_6041_UN,7.557272,00000000000000000000000000000000000000000110000000000000010000000010000000000000001000110011000010101000010111001000001000000000110011110110001011010011010111101111110,AQHRGPAPIQJJIZ-UHFFFAOYSA-N
CSCC3(C=CC2CCC1COCCC1C2)CCOCC3,B7E9AD1BB02D955D_8CF1CC957150E51E_7019_UN,8.579939,00000000000000000000000000000000000000000000000000000000010000000010000000000000000000101000010000110100010011001001001010000000110010000110000001010000010101011001110,YVRNTMQXKBNBCG-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCOCC3)C4=C(C=C(C=C4)F)F,A6E647C64A0A2264_605A21A5B0F9C62A_6041_UN,8.021508,00000000000000000000001000000000000000000010000000001000010000100110000000010001100100110011011011100000100101011000001011101100110011110110001011011011010011101111110,OOWPGYAIRRILAQ-UHFFFAOYSA-N
N3CCC1=C(C=CC(=C1)NC2=CC=CC(=C2)CN(C)C)C3,9CD4CA089B9F246A_0A12007B98C649CE_6041_DP,7.5514374,00000000000000000000000000000000000000000000000000000000000000000000000000100000001001100001010000101100110000010001001001100100110101010110001011011101010110101111010,UAQBYDLQQWPSEF-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCCCN(C)C2)Cl)C3CC3,710AA2E42DBE766D_C8933AC08ED0E207_7022_UN,7.84612,00000000000000000001001000000000000000000000000000000000000000100000000000010000101001110011010000001001000110010001101001100000110001110110001010011111010110101111010,GBXHSJKWBBBNSR-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CC23CCOC3)F)CC4,703067F656B82995_E217FDAD2B76FA05_6041_UN,6.920785,00000000000000000001001000000000000000000010000000000000010000000010000000010001101101110011010010001000010111011001101011100000110011110110001010011011010111101111110,WZTZDNMPZPTULD-UHFFFAOYSA-N
NCCCC(OC1=CC=C(C=C1)C2NCCNC2)C3=CC=C(C=C3)F,5A40C8218D8DF434_69D98DAD735FEECC_6035_UN,8.407221,00000000000000000000000000000000000000000010000000000010000000100000000000000001001010110011000000101000100100010100001011000111110110100110001101010001110111100111110,QHUMOKBYAIIHIU-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C(N=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,268DC7DF4396FE12_7832F094FBA1BF55_6041_UN,8.567604,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,LGVWNJZPVCSQGI-ZHRRBRCNSA-N
FC2=C1CCCC1=CC(=C2)NCC4=C(CN(C)C3CCCCC3)C=CC=C4,9DF04C6CB27CCD87_1724E88ABE1E1C90_6041_UN,7.670825,00000000000000000000000000000000000000000010000000000000000000000000000000000000001001110001010010001100010110010001101000100100110001110010001011011011010110101111010,OJCJNZUJUUZORL-UHFFFAOYSA-N
C[N]1N=C(N=C1NC2=C(C=C(C=C2)C3CCOCC3)F)C4CCOCC4,FEE06F92FA6A9D96_160E766E2C1BC0DD_6041_UN,7.689223,00000000000000000000000001000000000000100010000000001000010000100100000000010101100100110000011010100000001101000000001011101100110011110110001011011011010011111111110,PXOVYZKTHXWJTC-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)N[C@H]4[C@H](C3=CC=N[N]3C)OCC4,1378AFD04515D308_CEC975324A7539DA_6041_UN,7.9043484,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111000100110101010000001011101100010011110100001010011011110011101111110,SFGDAAOSSVTMCM-NVXWUHKLSA-N
CC1=CC2=C(C=C1)C(=CN2CC3(CC3)C4=C(C=CC=C4)Br)C5CCNCC5,802D8F21846F76BE_F789418FEA545147_6034_UN,8.395656,00000000000000000000001000000000000000000000001000000000000000100110000000010000001101110001000010101100110100011000001011100100110000100110001011011011010110101111010,LUDJYIJIYBROSL-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3NCCC3)C[C@H]4[C@@H](CNC4)C5=CC=C(C=C5)Cl,065E8FBCBDF27076_E765F7B6B1B9BF7C_6034_UN,8.073268,00000000000000000000000000000000000000100000000000000000000000100100000000010101101101110011000010001101110100010000001011100100110100100110001011011011010110101111010,LLMQMAYMVOUFMC-CTCAENTCSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3C4(C3)CCOCC4,C4A946FF696AF923_82995576041BCE15_6041_UN,7.0092964,00000000000000000000001000000000000000100000000000001000010000100110000000010101101101100011011010101000010011001000001011101100110011010110001011011111010111101111110,OXQVQNHROPSMAA-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2C(N(C)CC2)C3=CC=CC=C3)F)CC4,6C7A4A25CC79C95E_E0797EE750C509AE_6041_UN,8.184094,00000000000000000001000000000000000000000010000000000000000000100000000000010001101101110011010010001000000110010001101011100100110001110110001011011111010110101111010,OYXSDBLIMAUNIA-UHFFFAOYSA-N
FC2=C1N(C=CC1=CC=C2Cl)C[C@H]3[C@@H](CNC3)C4CCOCC4,4FEE896060679020_F1CC41069EDC3E98_6034_UN,9.223643,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011000010101101010101000000001011100100110010100110001011011011010111100111110,WNNAAQXOSGAXOJ-GJZGRUSLSA-N
N(C1=CC2=C(C=C1)COCC2)[S](C4=CC(=C3[NH]C=CC3=C4)C)(=O)=O,503C15097250AF08_7BBFBB8919534D7A_6029_UN,8.827797,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100101001001010100110011001001000011011001100111111011110001011111001010011111111110,IYFVDXJHZNSVIO-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3(C)CCCS3,E387239140516931_36F31F5F548D5CE0_6041_UN,8.056804,00000000000000000000000000000000000010100010000000000000000000000110000000000100011100011011000010101100010110001001101011000100110001110110011011010111010110101111010,ORJYUGFSDIKNCP-UHFFFAOYSA-N
O([C@@H]2CC[C@@H]3CN(CC1=CC=CC=C1)C[C@H]23)CC4OCC(C)(C)C4,6E96B3DA3484C476_8AAC886EE94963B7_6039_UN,8.555196,00000000000000000000000000000000000000000000000000000000010000000010000010110000000101100000000011001100010011001001001011100011110010000110000100011100110101111111110,HVUVGTZZGKARJB-ZZQCPNMFSA-N
CC1=C(N=C(N1C[C@H]2[C@@H](CNC2)F)C3CCCN3)C4=CC=CC=C4,5FC2EEADD7DA205C_F48ED245F8FE9C70_6034_UN,8.917498,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010001000100100010000101011100100110100100110001010011011010110101111010,PUPSYTLVWGFMND-RTKIROINSA-N
CN(CC1CCNC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=CC(=C(C=C4)F)F,674CB33FF5431FB2_6C149A39643C9EBE_6041_DP,8.338883,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000100110010001001011100100110101110110001011011011010110101111010,VKXCXKQDPIJIQF-CRLJJSMGSA-N
ClC1=CC2=C(C=C1)N(C(=N2)C3CCCCN3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,DB7F3E1A975B75DA_6DB23E9532A7DEA2_6034_UN,8.786823,00000000000000000000001000000000000000100000000000000000000000100100000000010101101101010011010010101101110100010000001011100100110001100110001011011011010110101111010,PMJZPPNYLBHFMJ-INCJQKBWSA-N
FC1=CC=C(C=C1)CC2=NC6=C(C(=N2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5)C(=CS6)C7=CC=C(C=C7)F,7E6755EA3DCBC271_5DC241AF2AEED9DF_6041_UN,8.308424,00000000000000000000001000000000000010100010000100000000000000100110000000100100111100011011000010101100010100011001101011000100110001110100001011010101010110101111010,JGOGQKCSBLOHLT-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)[N](C=C2)CC45OC3(CCNCC3)C(C4)(N)C5,A9C5AC880D7C9EC0_7D0D599F65819D31_6034_DP,8.522904,00000000000100000000000000000000000000000000001000000000010000000110000000010000001111110011000111101100110100011000001011100100110111100110001001011001110111100111110,ONNAPXNSTUZELF-UHFFFAOYSA-N
FC1=CC2=C(C=C1)[N](C=C2)CC45OC3(CCNCC3)C(C4)(N)C5,605D029AC9B9CEBA_12B5A77A701C5769_6034_DP,8.522901,00000000000100000000000000000000000000000010000000000000010000000110000000010000001111110011000111101100110100011000001011100100110111100110001001011001110111100111110,XNDYCLAIIQHBJM-UHFFFAOYSA-N
ClC1=CC2=C(C=C1)[N](C=C2)CC45OC3(CCNCC3)C(C4)(N)C5,F1AB16DD2E7E2BE9_C40CCF4599487DCF_6034_DP,8.522901,00000000000100000000000000000000000000000000000000000000010000000110000000010000001111110011000111101101110100011000001011100100110111100110001001011001110111100111110,HXBHRTCXLDMVJX-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NC2=CC=CC(=C2)CC3CCCN(C)C3)C=CO4,CC28E366653E6660_F6FB6EF8539BB862_6041_UN,7.3841825,00000000000000000000000000000000000000000010000000000000010000000000000000010000000101110001010011101100010110010001101011100100110001110110001001011001110110101111110,JDPYGUCCXFXBPM-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCCC2CCCCC2C)Cl)C3CC3,4F9BDCFD9472B1EA_8963F3ED2A280FD5_7022_UN,8.020029,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010001000000001001100110010001101000000000110001110000000011010111010110101111010,NQWBQSAGBCCRPM-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2C3CNCC23)F)CC4,31018414200367A1_50EAF766445B2DE6_6041_DP,7.8562803,00000000000000000001001000000000000000000010000000000000000000000000000000010001101101110001010010101000010110010001101011100000110101110110001011011011010110101111010,TXAVFUAIKYMPIT-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC4CCN(CC2=CC=CC=C2)C3(CCC3)C4)Cl)C5CC5,D0859F2019B04D4E_3D029CF4470E97C7_7022_UN,8.228918,00000000000100000000001000000000000000000000000000000000000000100010000000010000100001110011000000101001110110011000001001100100110001110110001011011011010110101111010,XMAUMVMOKXEVPM-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC4[C@@H]3C[C@@H](C3(C)C)CC4)C5=CCNCC5,2629F9026BB68161_06F41370A586FD69_6034_UN,8.052506,00000000000100000000000000000000000000000010000000100000000000100110000000111000001101110001000010111100110110011000101011100100110000100110001001011101010110101111010,PGXITZSVXIAQBH-WURXZWLQSA-N
FC1=CC(=CC(=C1)N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C4(CC4)C#N,BD69960A2510B525_B5BCB2FB9FDFBE72_6041_DP,7.3068843,00000000000000000000001000000000000000000110000000000010000000100010000000000001001000110011000000101000100100011000001001000100110101110110001001010011010010100111010,LWUSJCMUUCVJAL-WOJBJXKFSA-N
CC1=C(C3=C(N1CC2(F)CCCOC2)C=CC=C3)C4=CCNCC4,4884AAF3DF5C2607_28A2DCE72C911E8A_6034_UN,8.649559,00000000000000000000000000000000000000000010000000100000010000100110000000011000001101110001000011111100110111011000101011100100110010100110001011011011010111101111110,POOPUXZVEKSMES-UHFFFAOYSA-N
CC(=O)CC1=C(C(=CC=C1)F)NCC2C3CCC(C2)C=C3,1811F4142D8CEE5C_8B6D91BE79BA844B_6041_UN,7.899432,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011000000011000010100000001001000000000110011110000000011010011111110101111110,PHKPAMBYLORIRG-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC3CCC2(CC2)C3)Cl)C4CC4,BAC558B760D2CE59_1B593B19FE5037F4_7022_UN,7.5800195,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010011000010001001010110001000001000000000110001110000000010010011010110101111010,YTHJXAVOFJRSHL-UHFFFAOYSA-N
FC3(F)CC(C=C[C@@H]1CCCO[C@H]1C2=NC=C[N]2C)(C3)C4=CC=CC=C4,48C64EB0F914F62C_0249A24AD5E62DCC_7019_UN,8.172759,00000000000100000000000000000000000000100010000000000000010000100110000000010101000101010000010110110000000101001000001011100100100010100100001011011010110011101111110,IIKABUXTGDZZFJ-FUHWJXTLSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3CCCC(O3)C4CC4,C31101424E6EDB71_31A9260032C54916_6041_UN,7.6606574,00000000000000000000001000000000000000100000000000001000010000100100000000010101101101000011011110101000000010000000001011101100110011010100001011011111110111101111110,MNURDLQDAJSDJM-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4=C(C=CC=C4)C5=C(C=CC=C5F)F,C815CA5113F3276A_E48C131176C10DA0_6041_DP,8.088577,00000000000000000001000001000000000000100010000000000000000000100100000000000100100101010011010010100000111100010000101011100100110101110100001011011011000010101111010,IXXYNQDMTXOJRM-BJWYYQGGSA-N
FC2=C1C=C(N=CC1=CC=C2)NC4C[C@H]3CCC[C@H](N3C)C4,33358B5E75E0F6CD_2AFEE89E9B2836FD_6041_UN,8.142283,00000000000000000000000000000000000000100010000000000000000000000100000000010100100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,OANMKKATGOQYLT-GOOCMWNKSA-N
N1CCC(CC1)C2=NC=C(S2)NC3=CC(=C(C=C3)N4CCCCCCC4)F,29E8251A4BF8D560_57DC015514A92C70_6041_DP,7.73567,00000000000000000000000000000000000010000010000100000000000000100100000000010001111101111001000010101100100100010000001011100100110101110110001011011011010010100111010,KJMYAPHTPBGLBV-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CCNC23CCC3,BE8F01276358A2B8_D9DC28872F8E8CF3_6041_DP,7.702215,00000000000100000000100000000010000000000000000000000100000000000110000000100001101100100011010010101000110000011000001011000000110101010110011010011111010110101111010,LWJBYOCCZBKXOE-UHFFFAOYSA-N
CN1CCN(CC1)C2=NC(=CS2)C3=CC=C(C=C3)N[C@H]4C6=C(OC5(C4)CCCC5)C=CC(=C6)F,455D85A929E667DA_FCA9685E0F96BF29_6041_UN,7.9091487,00000000000000000000000000000000000010000010000100000000010000100110000000010101010101111001010011101100111100011101101011100100110011110110001011011001110011101111110,IEAAHFJIFLDELJ-HSZRJFAPSA-N
FC1=C(C=C(C=C1)NC2C3CC2CN(C)C3)C4OCCO4,D736B2EA5C48B144_37AF8433A6F35283_6041_UN,7.216772,00000000000100000000000000000000000000000010000000000000010000100000000010010000100101110010010010101000010111000001001011110000100011110110001011011011010011111111110,QOJINHFOKHJPHY-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4=C(C=C(C=C4)F)C5=CC=C(C=C5)F,C1318A9769710D0C_D9B3009F9BA18E57_6041_DP,8.220545,00000000000000000001000000000000000000100010000000000000000000100100000000000101100101010011010010100000110100010000101011100100110101110100001011011011000010101111010,SKGYEOVUNUYWSM-ACDBMABISA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCCC(C)C2)F)CC3,A634EC59C9C11463_2563CCB1B1ED715F_6041_UN,7.7411404,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010000001000000110010001101011100000110001110110001011011111010110101111010,DLYUCQJSQJFZCX-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)N[C@@H]4C6=C(OC5(C4)CCC5)C=CC(=C6)F,41BF6302E7D29BA9_1CD4991CE22D4190_6041_DP,8.313541,00000000000100000001000000000000000000100010000000000000010000000110000000000101100101010011010011100100110100011100101011100100110111110100001011011001100011101111110,YSNWZBPEGATGOH-DMUMMCEESA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3COC2(CCNCC2)C3)F)CC4,4DDADB417F045512_A7C0375F28460FB5_6041_DP,7.2237167,00000000000000000001000000000000000000000010000000000000010000000010000000010001101101110001010111101000110111011001101011100000110111110110001011011011110111101111110,XOPBFYKEYKPGHT-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3C(CCN3)C4CC4,D5A68666AC3BB24E_44081C1F94580FA5_6041_DP,8.296394,00000000000000000000001000000000000000000010000000000010000000100100000000000001001100010011000010101100110110010000001011000100110101110110001011010011010110101111010,AXZWDQXSYGEWTI-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2(C)CCCCC2)F,C6D4FDD934786ECC_D6B85DC91C351568_6041_UN,7.7475157,00000000000000000000000000000000000000000010000000000000000000000010000000100000001001110011010000001000000110001001101000100000110001110010011011011111010110101111010,HKFHOBBVFHMKRB-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)CC#N,15F52E020E4412F1_61BA380E30131112_6041_DP,7.7923026,00000000000000000000000000000000000000000110000000000100000000100100000000010101101101110011010010001000000110010000000011100100110101110110001010001011010110101111010,RNSWXSQHWJYGJY-GXTWGEPZSA-N
BrC1=CC2=C(N=C1)N(C=C2C3CCC3)CC(CC)C4=CC5=C(C=C4)CCCC5,9BC682919959A6CF_633AED687716D26A_6034_UN,7.9269543,00000000000100000000000000000000000000100000001000000000000000100100000000010100000101010000000010101100010100000010101011100100110000100100001011011000010110101111010,QEGDEKPYWXYCEQ-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NC34COC(C)(CC3)C4,0B04285AF0B08EEE_4DFD03FB215B0F78_7022_UN,6.7929173,00000000000000000000000000000000000000000000000000000000010000000010000000000000000100010011000111100101110111011001101000000100110011110100000011010011110011101111110,CWGGVNDKXHJWBT-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Br)NC34COC(C)(CC3)C4,4B1F04FAB883AC54_1D1D4BCDCAD06B0E_7022_UN,6.7929034,00000000000000000000000000000000000000000000001000000000010000000010000000000000000100010011000111100100110111011001101000000100110011110100000011010011110011101111110,QGBCVIZCVOGYPQ-UHFFFAOYSA-N
CC2=C1SC(=NC1=CC=C2F)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,D7681A1FD8DD34B6_6F30147E10A8D3F2_6041_UN,8.346295,00000000000000000000001000000000000010000010000100000000000000000110000000100100011100011011000010001100011100001001101011000100110001110100011011010111010110101111010,OCRCSTVGLRYBGT-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC3CC4(CCC3)CCCC4,2E1DA7C600B7F86D_4E20CCA2B8197714_6041_UN,8.376222,00000000000000000000000000000000000000000010000000000000000000000110000000000000100000010011000010100100110100011000001001000100110001110100001011010011000010101111010,LNIYOLXZHYCSEO-UHFFFAOYSA-N
CN(CC1CNC1)CC2=NC=C(N=C2)NC3CC(OCC3)C4=CC=C(C=C4)F,B693CBA66AC7468B_6D9C7B2204719B40_6041_DP,7.926212,00000000100100000000000000000000000000100010000000000000010000100100000000000101101001110010010001101000100111010001001011100100110111110110001001011001110111101111110,KGKIYTJZPOVVCC-UHFFFAOYSA-N
SC1=C(C(=CC=C1)C#N)NC(C2CNC2)C3=CC=C(C=C3)F,366661366AEB3BA2_F266A3B17108E7CE_6041_DP,7.5315776,00000000100100000000000000000000000000000110000000000110000100001000000000000000111000111010000000001000000100000000000001000100000101110110001011000011010010100111010,ARLZJWFZOTWODG-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC3=NC=C(CC2CCOCC2)S3)F,B5C95339E9F7D0EB_ECF81828FA141BFA_7022_UN,8.001859,00000000000000000000000000000000000010000010000100000000010000000100000000100100010101111001010010101000001101000001001011100100110011110110001011011111010111101111110,QORJFWPZKAJFKQ-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3=C(C=C(C=C3)F)C4CC4,8701251237BBE2B0_159A871A3C242ABB_6041_UN,8.489013,00000000000000000000001000000000000000000010000000001000000000100100000000010001100100010001011010000000000100000000001011101100000001110100001010011011000010101111010,UFXGHHHKVLWAPR-UHFFFAOYSA-N
ClC1=C(C=CC(=C1)NCC2=NC=CN2C[C@@H]3CNC[C@H]3C4=CN=C[N]4C)Br,4D6CC563E881DC2B_CB017F705BCF8DC4_6034_UN,8.530794,00000000000000000000000000000000000000100000001000000000000000100100000000010101101101110011010010001001000110010000000011100100110101110110001010001011010110101111010,AUZCRORRMWSTPX-DZGCQCFKSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC4CCCN(CC3CC3)C4,FB4DCE79953340ED_34494D6F2131E074_6041_UN,7.964443,00000000000000000000001000000000000000000010000000001000000000000100000000010000101101110011011010101100010100010000001011101100110001110110001001011001010110101111010,ISRIZEOAQCAXOW-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(C3=C[N](C)C4=C3C=C(C=C4)F)=O,8BEE6FE75B889304_09DA8483B93A1BB9_6038_UN,7.900366,00000000000000000000000000000000000000000010000000000000000000000100000000010000101101010010110011001100010100100000011001100100110000100100001001011001011110101111110,GBZNVLIBYKNJHB-UHFFFAOYSA-N
C[N]1C=CC2=C1N=CC(=C2)NCC(N3CCOCC3)C4=C(C=CC=C4)F,5C4065227085ADC3_A0ACC7121A29CD5E_6041_UN,7.5957355,00000000000000000000000000000000000000100010000000000000010000000100000000010101001101110001010110101100010101010000001011100100110011110110001011011011010111101111110,GRLCNBWRTAYHAU-UHFFFAOYSA-N
C1(=CC2=C(N=C1)[NH]C=C2C3CCC3)NC4CCCC5=C4C=C(C)[N]5C,F6DF9D004FD42861_8537150F6F9DFEFA_6041_UN,8.252248,00000000000100000000000000000000000000100000000000000000000000100100000000010101100101000011010010100100110010010000101011100100100101010100001011011111000010101111010,DQBIVROJQYPRRK-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NCCC4CCN(C3CCN(C)CC3)CC4,BA752CE6E4CC0143_6817E9073D154937_6041_UN,7.0382357,00000000000000000000000000000000000000000010000000000000010000100000000010010000101101110001010010101000100101010001101011110000110011110110001011011011010111111111110,IILQTELMFNGICE-UHFFFAOYSA-N
C1CCC(NC1)C3=CC2=C(C=CC=C2)N3CC4(CCNC4)C5=CC(=CC=C5)F,B0256D31CDC37130_B99F02D5B3D01864_6034_UN,8.745629,00000000000000000000000000000000000000000010000000000000000000100110000000010001101101110011000010101100110100011000001011100100110100100110001011011011010110100111010,NWJJLUKYLJMASP-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CC3CCC2N(C)C3)Cl)C4CC4,5BE15537C73234C8_A4752A1435847222_7022_UN,7.711436,00000000000000000000001000000000000000000000000000000000000000100000000000010000101001110011010000101001010110010001101001100000110001110110001011011111010110101111010,MGMQDNUFHNJUCY-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC#N)NC(C2CNC2)C3=CC=C(C=C3)F,23B351308A416BC2_02A4D9F05A0EB069_6041_DP,7.1556005,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110011000000001000000100010000000001000100000101110110001011000011010110101111010,LEWMQEJZYRXFBE-UHFFFAOYSA-N
N4CCC1=C(C=C(C(N1C[C@H]2[C@@H](CNC2)C3=CC(=CC=C3)F)=O)C#N)C4,A50110C136DFE0FF_6FE9105A6530722D_6034_DP,8.229682,00000000000000000000000000000000000000000110000000000000000000100100000000010000101101110011100011101100110100110100011011100101110100100110001111011011011110100111110,VALKLGNZTAQLKZ-WMZOPIPTSA-N
FC1=CC4=C(C(=C1)NC3CCC2(CCN(C)CC2)CC3)OC=C4,AC116D3444BEF884_C3046D94212D5251_6041_UN,7.849084,00000000000000000000000000000000000000000010000000000000010000000010000000010000000101110010010110101100110100011001101011100100110001110110001001011001110010101111110,XDQWHFZECFHREN-UHFFFAOYSA-N
CC1=C(C=CC(=C1)NCC2N(C)CC3(CC2)CC3)C#C,0E78F3FA2F7116FC_89F79D914F8CF5D2_6041_UN,8.010588,00000000000000000100001000000000000000000000000000000000000000000010000000010001001001100011010000101000010010011001101001100000110001010110001011011111010110101111010,CGRXFILTNBVMLR-UHFFFAOYSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NCC34CC(C)(C3)C4)C5,700FAF1960ACBE44_4DDE1D8B3A6BEF6E_6041_UN,7.6677628,00000000000100000000000000000000000000000000000000000000000000000110000000010000101101100011010010101100110010011001101011100100110101010110001011011101010110101111010,QXVZQAZODDVUIQ-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3CC4(CCC3)CCCC4,797E13369E664829_2A582866F9F58718_6041_UN,7.9318695,00000000000000000000000000000000000000000010000000001000000000000110000000010000100100010011011010000100110100011000001011101100110001110100001001011001000010101111010,MLKQKMWTWLJGKI-UHFFFAOYSA-N
N1C[C@@H](CO1)[N]2C=C(C=N2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,2DA3C7017C230C27_E034BAF12D0CC8E5_6041_DP,8.934687,00000000000000000000000010000000000000000010000000001000010000100100010100010001101101110011011111001010100111010001101011101100011111110110001010011011010011101111110,IASHSWUXRPBGMC-XKQJLSEDSA-N
C1(=C(C=C(C(=C1)F)C#N)F)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,F37DBF243D691BE9_1CFA3B3C87AC2F85_7022_UN,7.641492,00000000000000000000001000000000000000000110000000000000000000000010000000100000001000010011000000001100010100001001101000000100110001110000001011010111010110101111010,LTCCQOSMSAEOJE-UHFFFAOYSA-N
C2(=CC1=C(C(=CC=C1)F)O2)NC[C@@H]3CNC[C@H]3C4=CN=C[N]4C,821273CD579856CB_9BB3C5E0802BECBB_7022_DP,7.4864354,00000000000000000000000000000000000000000010000000000100010000100100000000010101101101110011110010001100010110100000010011100100110101110110001010001011110110101111110,YZWNGANWMGCXHO-QWHCGFSZSA-N
FC1=CC2=C(C=C1)C=CC(=N2)NC(CC)C3CCCCCC3,85F53105EC5A3E46_99BF004EBE69B014_6041_UN,7.6836014,00000000000000000001000000000000000000100010000000000000000000000100000000000100000000010011000000100100110110010010001001000100110001110100001001010001000110101111010,RXBKQNYSMYGGOJ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC3CN(CC2=CC=CC=C2)C4(C3)CCOCC4)Cl)C5CC5,14EB80B139DA9032_D1978E7AA5CDD245_7022_UN,8.295311,00000000000000000000001000000000000000000000000000000000010000100010000000010001100101110001000011101001110111011000001011100100110011110110001011011011010111101111110,UJXGJKIYQXLTHX-UHFFFAOYSA-N
C[N]1C=CC2=C1N=CC(=C2)NCC3(CCOCC3)C4=CC(=CC=C4)F,268548D4BBD94425_90C27D85B1BA4D7D_6041_UN,7.281561,00000000000000000000000000000000000000100010000000000000010000100110000000010101001101110011010010101100010101001000001011100100110011110110001001011001010111101111110,XDZCKQWZMNPLOV-UHFFFAOYSA-N
FC1=CC2=C(C=C1)[NH]C=C2NCC3CCCN(C)C3C4=CC=CS4,B5F954D83AA1B3D3_C6899524F4403459_6041_UN,8.595881,00000000000000000000000000000000000010000010000000000110000000100100000000010001111101111011010010101100010110010001101011100100110101110110001001011011010110101111010,BHVFUFNJJRYXFT-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CC3(C2)CCOC3,D8D4F9696AE5A35F_328D37A7DFB5276F_6041_UN,7.268987,00000000000100000000100000000010000000000000000000000000010000000110000000100001001100100010010010101000010001001000001011000000110011010110011010011111010111101111110,YBDRCXQIXOPUKI-UHFFFAOYSA-N
N(CC2=NC1=C(C=CC=C1F)O2)C(C34CC(C)(C3)OC45CCC5)=O,8B90D1957E245F7C_5EC51567DB1489F2_6038_UN,8.077857,00000000000100000000000000000000000000000010000000000000010000000110000000000001001100010111100111001100010110111001011011000100110010100100001000110001111111111111110,NPPYWPKXBWDYLU-UHFFFAOYSA-N
N1CCC4(CC1)OC5(COC2=CC=C(C=C2)C3=CC=C(C=C3)Br)CC4(N)C5,E532BAA24F9FA3DD_BD34C098C980B508_6035_DP,8.195814,00000000000100000000000000000000000000000000001000000000010000100010000010000000001110110011000111101000110101011100001011000111110111100110001101010001110111110111110,MWFOHQYALPKICS-UHFFFAOYSA-N
C(C1CC2CC1C3CC23)=CC4=C([N](N=C4C)CC5=C(C=CC=C5)Cl)C,3C8DCAB8E2392ECD_7CFFD890E3FA8A68_7019_UN,8.568979,00000000000000000001001000000000000000000000000000001000000000000100000000010000100100010000001010011001010110010000100011101100110000100100001011001110010110101111010,JASCBFSHPISLKU-UHFFFAOYSA-N
CC(NC(=O)CC1CC2CCC1O2)CC3=C[NH]C4=C3C=CC(=C4)F,2081515E28A0527A_4518C8DD2DF04BD0_6038_UN,7.6453066,00000000000000000000000000000000000000000010000000000000010000000100000000000000000100010011100010000100110110110001011011000100110110100100001001010001101111111111110,BOHSYJPDZGGMHU-UHFFFAOYSA-N
ON=C1CCCC2=C1C4=C(N2CC3C(C)(CNC3)C)C=CC(=C4)Cl,376B00BEA6298837_28690B09563E6B72_6034_UN,7.8269806,00000000000000000000000010000000000000000000000000000000000000000110010100110010101101110011001010001111010110011001101111101100110101100111001011011111010110101111110,DMHRNQCCORUBLA-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC(C2CCNCC2)F,E0A2E09C953C1FD5_D20C9ED1E7DA9B81_6041_DP,8.315836,00000000000000000000000000000000000000000110000000000000000000000000000000000000001000110001000000101000100110010000001001000000110101110110001011010011010110101111010,YAUIJLFOWAPRHL-UHFFFAOYSA-N
CN3CCC(CNC(=O)CC1CC2CC1C=C2)C3C4=CC(=C(C=C4)Cl)F,B13FB3A4B6E70D56_3AA87F754CA01A1E_6038_UN,8.154362,00000000000000000000000000000000000000000010000000000000000000100000000000010000101101110011110010011001110110110001111001100000110010100110001011011011011110101111110,QDBFCEUFLXEAMI-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=CC=CC(=C2C)C3=NN=C4CCCCC[N]34,7BA84C21DDC9F3BF_45867342386CC7F6_6041_UN,8.057124,00000000000000000001100000000010000000100000000000001000000000100100000000100101100101100000011010101100010000011000001011101100110001010100011011011111010010101111010,AGEOASCNPOWGGE-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=NC=C2)NC3CCN(C)C34CCCNC4,44CE591542AE4DDC_EF673CC4A4A5B9CE_6041_DP,8.289063,00000000000000000000000000000000000000100010000000000100000000000110000000010101101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,FCDGXGACXNPDFI-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2(CC2)C3COCCC3)F)CC4,AD9AAC6971F4CA57_2C77C4107E789970_6041_UN,7.5315704,00000000000000000001001000000000000000000010000000000000010000100010000000010001100001110011010001101000100111011001101011100000110011110110001011011011010111101111110,JCZMQYSHKXVMEO-UHFFFAOYSA-N
CC1=C(C3=C(N1CC2(CC)COC(CI)C2)C=CC=C3)C4CCNCC4,CDCBD275B8FDE003_94E48289207282CF_6034_UN,8.564845,00000000000000000000000000010000000000000000000000000000010000100110000000010000001101100001000011101100110011011010101011100100110010100110001011011111110111101111110,UEMAXFRRHJEMAH-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CCCCNC2)F,77C7E64C7A79A7B8_D4BC1EA435376408_6041_DP,7.69952,00000000000000000001000000000000000000000010000000000100000000000000000000100000101001110011010000001000100100010001001001100000110101110110001010011111010110101111010,JOJRHUNYMKGEAN-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@@H]2CCO[C@H]2C3=CC=C(C=C3)Cl)Cl)C4CC4,9EB715D38755188F_3058820F92578CBA_7022_UN,8.797408,00000000000000000000001000000000000000000000000000000000010000100000000000000000000100010011000111000001100111010000001000000100000011110100000011010011110011101111110,LOQDMQPDPPPAQA-QUCCMNQESA-N
C[N]1N=C(C=C1NC3(CC2=C(C=CC=C2F)F)CCCC3)C4CCCC4,317973052DB3B41E_7B6210C265D68CD0_6041_UN,8.091062,00000000000000000000000000000000000000100010000000001000000000100110000000010101100100010011011010000000100100011000001011101100110001110100001010011011000110101111010,BQJSOENHQXAPTB-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=C(C(=NC=C2)Cl)F)C3,6B95E1836693A0C6_CB0D6D07053043A9_6035_UN,8.10276,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010011101001010100000101001001100011110000100100001111011110110111101111110,BSGCAJKBDJTHGW-BBGACYKPSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OC2=C(C(=NC=C2)Br)F)C3,DBA0CA2CB1B84C9A_CDD63A6067C1801C_6035_UN,8.102733,00000000000000000000000000000000000000000010001000000000000000000100000000100000000001110000010011101000010100000101001001100011110000100100001111011110110111101111110,KUQBURRXLLYMPI-BBGACYKPSA-N
CC1=C(C2=C(C=C1)C=C[NH]2)NCC4OC3(CCC(C)CC3)CC4,619D7CB44B43F8B0_BFF8E92E20A4E027_6041_UN,7.8516273,00000000000000000000000000000000000000000000000000000010010000000110000000000001001100000011000110001100010010001001101011000100110111010100001011010111110111101111110,JLNVXZXSAIJJIS-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC[C@H]2[C@@H](C2)C3CCOCC3)F)CC4,C5F7E5A04935A5A5_E05DE017B80DA053_6041_UN,7.3264537,00000000000000000001001000000000000000000010000000000000010000100000000000010001101001110011010000101000000111010001101011100000110011110110001011011011010111101111110,WGODUTCJXDSDJP-FPOVZHCZSA-N
N1CCCC2=C1C=C(C(=C2)NC4CC3CCC(N3C)C4)F,725B7AA48B4A1747_82DC6D135C23D045_6041_DP,7.3750415,00000000000000000001000000000000000000000010000000000000000000000000000000010000101101010011010010101100110110010000101011100000110101110100001011011011010010101111010,LWDALBWJEWBHDS-UHFFFAOYSA-N
FC1=NC2=C(C=C1)C=C(C=C2)NCC3CCCC(CC)CC3,9FFC80A34FFFBFAC_0465BAA308D8A8DB_6041_UN,8.1892805,00000000000000000001000000000000000000000010000000000000000000000100000000000000001000010011000000101100010110000010101001000100110001110100001001010001010110101111010,GWXSDCDSZMKQJX-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCCCN2)F)CC3,3B4FBE6D467A006C_F1BCA3258E7A16C4_6041_DP,7.6518974,00000000000000000001000000000000000000000010000000000010000000000000000000010001101001110011010000101000100110010001101011100000110101110110001011011011010110101111010,AJGLISPDBAYBCC-UHFFFAOYSA-N
CC[C@@H]3CCN[C@H](COC1=CC(=C(C=C1)N2CCCCC2)Cl)C3,277B6A1E2824FE7F_D0166CDD07ACCC2A_6035_UN,8.439215,00000000000000000000000000000000000000000000000000000000000000100000000000010000001001110001000100101001100111010110101011100011110001110110001111011011110111101111110,IQZOFCCTVCYDOI-CVEARBPZSA-N
N(CC1C2CCC(C1)C=C2)C(C3=C(C)OC(=N3)C4=CC(=C(C=C4)Cl)Cl)=O,0D3C3582E83EF40E_4F220241F4467720_6038_UN,8.36689,00000000000000000000000000000000000000000000000000000000010000100100000000000001001100010111100111011001010100100000011011000100110000100100001011010011111110111111110,QPJYHVOXUYFPAP-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(=O)C3=C[NH]C4=C3C=C(C=C4)F,C674BFA50C544DA1_BF4712ACDE619127_6038_UN,7.6632695,00000000000000000000000000000000000000000010000000000100010000000100000000000000101100010001100011001100110100110000011011000100110110100100001001010001111111110111110,CTUJLJXYTQFTSU-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(C4=CC(=N[N]4C)C5=CC=C(C=C5)F)=O,0A35320B246E428D_88B9156F88FED7A1_6038_UN,8.590418,00000000000000000001001000000000000000000010000000001000000000100100000000010001101100010011111111001000010100100000010011101100110000100100001011001011011110101111110,CRJKJDNYXLNYMA-UHFFFAOYSA-N
N1C2CCCC(C1)C2CNC(=O)CC3=C[NH]C4=C3C=CC(=C4)F,6AEA50A758A02751_9C606FAB56D178D8_6038_DP,7.862414,00000000000000000001000000000000000000000010000000000100000000000100000000000000101100010011100010001100110100110000011011000100110110100110001001010001011110100111110,KFEDJDRWPYZQDB-UHFFFAOYSA-N
FC2=C1C=C[NH]C1=CC=C2NCC3CCCCN(C)C3,ABC05A363C2DF8C5_94DFC05A79D9124E_6041_UN,7.8838496,00000000000000000001000000000000000000000010000000000000000000000100000000010000101101110011010010001100010110010001101011100100110101110110001010011011010110101111010,KMJBZPSWIQMZLT-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(CCC)CCCN3)C4=CCNCC4,2D481B5CFA116CE2_27FE9DB15139CB26_6034_UN,8.605609,00000000000000000000000000000000000000000010000000100000000000100110000000011001001101110011000010111100110110011011001011100100110100100110001001011001010110101111010,PXRTUEMUIGVOGZ-UHFFFAOYSA-N
C1(=CN=C(O1)C2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,D2124B0D9DAA8EBE_45FADC0BC4F8AAB6_6041_UN,7.9265103,00000000000000000000000000000000000000000010000000000000010000100100000000010001100101110011110110101000100111110001111011100100110011110110001001011011010011111111110,ZWGMSUVNRZOCOT-AEFFLSMTSA-N
FC2=C1C=CN=C(C1=CC=C2)NCC3CCCN(C)C3C4=CC=CS4,6A0A40C19DE93D0B_4D7FAA396C37996F_6041_UN,8.474478,00000000000000000000000000000000000010100010000000000000000000100100000000010100111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,RWMNCOLXLIAYTI-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3CCC34CNC4,47A6CF1AC694918B_DF15CCD039CE1245_6041_DP,7.4546127,00000000100100000000000000000000000000100000000000001000000000100110000000010101101101100011011010001000010010001000001011101100110101010110001010011111010110101111010,KIIDQUGTDQWMTG-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC4=C(C=CC(=C4F)C)F,E58F6AADA36376BA_F75C2979A801A823_6041_DP,8.649663,00000000000000000001000000000000000000100010000000000000000000000100000000000101100101010011010010100000110100010000101011100100110101110100001011011111000010101111010,ILDVZBUASQWUEE-BTTYYORXSA-N
C[N]1C=CN=C1C(NC(=O)CC2CC3CC2C4CC34)C5=CC(=CC=C5)F,165C5B0E0F69AC51_FDDC651DD8CE238D_6038_UN,8.283528,00000000000000000001001000000000000000100010000000000000000000000100000000010101000101010001110010000000110100110000010011100100110010100100001011001011001110101111110,UATQJUXZMBBRMX-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC3CN(C)C4(C3)CCOCC4,2EE434FF54205AD6_3BDEBBF54192D8B6_6041_UN,7.27532,00000000000000000000000000000000000000100010000000000000010000000110000000010101100101110001010011101100110111011001101011100100110011110110011011011111010011101111110,AJDJRGZDYBWSGO-UHFFFAOYSA-N
NCCCC(OC1=CC(=CC=C1)C2CNCCO2)C3=CC=C(C=C3)F,A4C7CEABE1B560C5_79847DFF17C02472_6035_UN,8.286271,00000000000000000000000000000000000000000010000000000000010000100000000000000000001010110011000100101000100101010100001011000111110110100110001101010001110101110111110,QRWVJGDLVUMEGC-UHFFFAOYSA-N
C1(=CC(=C(Cl)S1)Cl)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,309F12FA34FD5607_DF471CFEFB7B5FF5_7022_UN,8.382913,00000000000000000000001000000000000010000000000100000000000000000010000000100000011100011011000010001101010100001001101000000100110001110100000011010111010110101111010,BIWQIIKYNQGIJM-UHFFFAOYSA-N
CC2=CC1=C(C=CC(=C1)Cl)N2CC3CCCN3CC4CCCN4,E3CA8B5ABC695A8F_2144EEABD0D06FBF_6034_UN,8.124186,00000000000000000000000000000000000000000000000000000000000000000100000000010001001101110011000010001101110100010000101011100100110000100110001010011011010110101111010,LYLCJTMLKHMWNC-UHFFFAOYSA-N
CC2=CC1=C(C=CC(=C1)F)N2CC3CCCN3CC4CCCN4,0FA15A032A374B97_B0D942E18601D4D3_6034_UN,8.12418,00000000000000000000000000000000000000000010000000000000000000000100000000010001001101110011000010001100110100010000101011100100110000100110001010011011010110101111010,RRPODRSOCRQQKW-UHFFFAOYSA-N
CC2=CC1=C(C=CC(=C1)Br)N2CC3CCCN3CC4CCCN4,435E537714F5A5D4_7B10EFCB1EB0C6CF_6034_UN,8.12417,00000000000000000000000000000000000000000000001000000000000000000100000000010001001101110011000010001100110100010000101011100100110000100110001010011011010110101111010,DMTLDOANVTWKMQ-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NC2CCN(C)C23CCCNC3)C=C,A0C0F9DB9BA1B94D_D671D9C899FDFEFD_6041_DP,7.8235283,00000000000000000000000000000000001000000010000000000100000000000010000000010001101101110011010010111000110110011001101011100000110101110110001011011011010010101111010,AXGSGKINQYQQKQ-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NC4CC(C3=NC=C[N]3C)OCC4,D84181C5AB24786D_24ABD1D13A59AD91_6041_UN,8.058906,00000000000000000000001000000000000000100010000000000000010000100100000000010101000101010011010111100000100111010000001011100100110011110100001011011011110011101111110,HHCJOGNECAKCNZ-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC3=CC2=C(CCNC2)C=C3,EE024AA2FB897C27_CA772240612B61DA_7022_DP,7.678342,00000000000000000000100000000010000000000000000000000000000000000000000000100000001000100001010000101100110000011000001001000100110101010110011011011101010010101111010,QZYAACQFWIZRHD-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NCC2C(CCN2)C3CC3)F)C#N,6A54E875C85DB58E_E42CC3D2FFABFB7F_6041_DP,8.222175,00000000000000000000001000000000000000000110000000000010000000100000000000000001001100010011000010001000100100010000001001000000110101110110001010010011010110101111010,UKOLTLXCVNRFRV-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCCC2C3(C2)CCOCC3)F)CC4,67A8743195D59320_DA3C8AB20026AF64_6041_UN,7.1620793,00000000000000000001001000000000000000000010000000000000010000000010000000010001101001110001010000101000110111011001101011100000110011110110001011011011010111101111110,SALICVCPMTYWCK-UHFFFAOYSA-N
N1CC2CCC1CN2C3=CC=C(C=C3)N[C@H]4[C@H](CCNC4)C5=CC=C(C=C5)F,D7F0C3154B1CA02D_615B351A5C8CD416_6041_DP,7.5151935,00000000000000000000000000000000000000000010000000000010000000100000000000010001001001110011000000101000110100010000001011100100110101110110001001011011010010100111010,XISFLBHEYFXXAJ-XMJKJUTBSA-N
CC5(C)CCC1=C(C4=C(N1C[C@H]3N[C@H]2CCO[C@H]2C3)C=CC(=C4)Br)C5,7CD90B8E985274F7_BFB879DB7E80B88B_6034_UN,8.248176,00000000000000000000000000000000000000000000001000000000010000000110000000110001000101010011000111001100110101011001101011100100110010100110001011011101110111101111110,CYCSHQMCUMRMQD-VHFSOBRXSA-N
CN6CCC1=C(C2=C([NH]1)C=CC(=C2)NC3=CC5=C(C=C3)OC4(CCCC4)O5)C6,71E224070AF30E04_0D37405F626985E1_6041_UN,8.320648,00000000000000000000000000000000000000000000000000000000010000000100000010010000100101100011010011101100110000011101101011110100110111010110001011011001110011111111110,MMDPCDDAUVHUGE-UHFFFAOYSA-N
N1CC5(C1)CCN(CC2=NC=C(N=C2)NC3(CC[Si](C)(C)CC3)C4=CC=CC=C4)CC5,FC8607CCC9024AA6_B283F632FCE7DF52_6041_DP,8.024931,00000000100100000000100000000010000000100000000000000000000000100110000000110101101001100011010000101000110000011001101011100100110101010110001001011101010110101111010,VXBQYNVSQBRBBP-UHFFFAOYSA-N
CC1=C(C=CC=C1Br)N[C@@H]3C[C@@H](N2CCOCC2)C34CCC4,C2FEE2C5915AD1B3_8BF4BAA2D4AB04D2_7022_UN,8.4125595,00000000000100000000000000000000000000000000001000000000010000100010000000010000100001110011000100101000110101011000001011100000110011110110001011011011010011101111110,SWKRLTHEKKJRFS-IAGOWNOFSA-N
CC1=C(C=CC=C1Cl)N[C@@H]3C[C@@H](N2CCOCC2)C34CCC4,53D883658D203044_57F7E8BE7DE590E0_7022_UN,8.412557,00000000000100000000000000000000000000000000000000000000010000100010000000010000100001110011000100101001110101011000001011100000110011110110001011011011010011101111110,BZUYLAGPPPJZHZ-IAGOWNOFSA-N
CC1=C(C=CC=C1F)N[C@@H]3C[C@@H](N2CCOCC2)C34CCC4,B8FA1A624D3371F1_865CE3156B396EC2_6041_UN,8.412543,00000000000100000000000000000000000000000010000000000000010000100010000000010000100001110011000100101000110101011000001011100000110011110110001011011011010011101111110,YMFIJCZHRYAWMN-IAGOWNOFSA-N
C(=CC1=CC(=CC(=C1)F)F)NCC2(CCN(C)CC2)N3CCCCC3,BF38746BBF9CE8F0_A333F804439DF726_7022_UN,8.437004,00000000000000000000000000000000000000000010010000000000000000100010000000010001101001110011010000111000000100011001101011100000110001100110001001011001010110101111010,OENUOMYXTXVHOO-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2CC2)NCC3N(C)CC4(CC3)CC4,BFEBA28AD4069847_B23377D2FF78EF89_6041_UN,7.651562,00000000000000000000001000000000000000000010000000000000000000100010000000010001001001110011010000101000010110011001101001100000110001110110001011011011010110101111010,LDMPAYAMDQBYMS-UHFFFAOYSA-N
CC2=C1OC(=CC1=CC(=C2)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F)C#N,0938568CB521F540_2E8E56B4037C3600_6041_DP,7.6080713,00000000000000000000000000000000000000000110000000000010010000100000000000000001001100110011000110101100110100010000001011000100110101110110001011010011110010101111110,VYZVOQYBNYYIAS-YLJYHZDGSA-N
FC1=C(C2=C(C=C1)C=NC=C2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4,CBF17E77E63CE3DB_27E1A6C753A2EA63_6041_UN,8.80321,00000000000000000000000000000000000000000010000000000000000000100100000000010000101001110011010000101100010110010001101011100100110001110110001011011011010110101111010,CQTLCQAJUMQWEQ-AVRDEDQJSA-N
NCC(OC2=CC1=C(CCN(C)C1)C=C2F)C3CCOCC3,051ABAEF4A084E01_64B4CDEBDAD48295_6035_UN,7.8254433,00000000000000000000000000000000000000000010000000000000010000000000000000010000001011110001010100101100010101010101101011100011110010100110001111011011110101111111110,BQPPQIUOJQPDCI-UHFFFAOYSA-N
CN4CCC1=C(C3=C(N1C[C@@H]2[C@H](C)CCCN2)C=CC(=C3)Cl)C4,ADE5899E8B65EBCF_EA1737DBCFCA23DB_6034_UN,7.529494,00000000000000000000000000000000000000000000000000000000000000000100000000010001101101110011010010101101110110010001101011100100110000100110001011011111010110101111010,SWARDXRECMDUEQ-CXAGYDPISA-N
CN(CC1CCNCC1)C2=NC(=NC=C2)N[C@H]3[C@@H](C3)C4=CC(=C(C=C4)F)F,B2E063F70D50B5DB_FB292CCEF9F139DB_6041_DP,8.400475,00000000000000000000001001000000000000100010000000000000000000100100000000000100101001110011010000101000101110010001001011100100110101110110001011011011010110101111010,BHCMOLKZUZINSL-MAUKXSAKSA-N
CC2=NC1=C(C=CC=C1F)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,BD4B4F9FBCCF5BC7_D0873CB0971DB44E_6034_UN,8.030527,00000000000100000000000000000000000000100010000000000000000000000110000000110101000101010000000010001100010110001000101011100100110000100100011011011110010110101111010,HXZQZTJJUFRYLS-TTZKSVMKSA-N
C(C2COC1(CCCCC1)O2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,3CDBB13698F31B5A_45829401BF7A8133_7019_UN,7.901516,00000000000000000000000000000000000000000010000000000000010000000000000010000000000101010000010010010000010111011000101010110000110011110100000011011010110011111111110,YOZVORMIATXEBH-UHFFFAOYSA-N
C1CC(CCN1)C2=CN(C3=C2C=CC=N3)CC(CC)NCC4=C(C=CC=C4)Br,97800DBD176C5B6F_ACF94282DFB7A580_6034_UN,8.294535,00000000000000000000000000000000000000100000001000000000000000100100000000010101001101110001000010101100110110010010101011100100110100100110001011011011010110101111010,BCMMFMRZHZSYAS-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CCC2NCCCCC2)C=CC(=C3)C)C4,588CCF55479F27F5_13A36390F6B70900_6034_UN,8.432355,00000000000000000001000000000000000000000000000000000000000000000100000000010000101101000011000010001100110010010010101011100100110000000110001011011101010110101111010,QOEMKECDVBDXNZ-UHFFFAOYSA-N
CN(C)CC1=CC(=CC=C1)NC3=C2OCCCC2=CC(=C3)F,83F891CE55CC112F_8D19FF7939196F51_7022_UN,7.0978365,00000000000000000000000000000000000000000010000000000000010000000000000000100000000001110001010100101100010101000101001000100100100011110110001011011101110111101111110,ILFQDFMNYFPWKG-UHFFFAOYSA-N
CC1=CC(=C(C=C1)F)NCC2(CCCOC2)N3CCOCC3,B1CD26DB1FB05E0E_CF37A96AF4D6C4F7_6041_UN,7.897764,00000000000000000000000000000000000000000010000000000000010000100010000000010001001001110011000101101000000101011000001011100000110011110110001011011011010111111111110,JGVTWXYJUKBWIW-UHFFFAOYSA-N
N(CC1C2CCC(C1)CC2)C(=O)CC3=C(C=C(C=C3)F)F,82CB7F8B8B54CCF1_7574FEE7B3DBC03D_6038_UN,7.1848817,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000001000110100110000011000000000110010100000000011010011011110100111110,DTTQJBQLARPMCG-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=NC(=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,48D8AADE56813957_24AB0455F5346FAE_6041_UN,8.392542,00000000000000000000001000000000000000100010000000001000000000100100000000010101101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,URPZOMGLGRBTFX-ZHRRBRCNSA-N
C[N]1C=C(C2=C1C=CC=N2)NC(C3CCOCC3)C4=CC=C(C=C4)F,D816A73B0DA699E2_78830FF8D0B7BE30_6041_UN,7.906307,00000000000000000000000000000000000000000010000000000000010000000100000000010001100101110011010010100100010101000000001011100100110011110110001001011001010011101111110,UVESWICQLOXKTA-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CCCCC23CCCC3)Cl)C4CC4,12D21729979D9E50_51AEF1F05108840C_7022_UN,7.4019628,00000000000000000000001000000000000000000000000000000000000000100010000000000000000000010011000010000001110110011000001000000000110001110000000011010011000010101111010,AEALPXQRPHWFEO-UHFFFAOYSA-N
CC1=C(C=C(C=C1)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F)CC#N,704FD76CC308982E_18E7589C3D1D8DD1_6041_DP,7.7016325,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000101001000100110101110110001011010011010110101111010,VIOKLVYLRRWJKC-WOJBJXKFSA-N
FC1=C(C=CC2=C1CCC2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4,7D5EA2CA0A2AC854_80DA9D6BE58C4AE1_6041_UN,8.104695,00000000000000000000000000000000000000000010000000000000000000100000000000010000101001110011010010101100010110010001101001100100110001110110001011011011010110101111010,BOOXLMXZAZVUEC-AVRDEDQJSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC4CC(C3=NC=C[N]3C)OCC4,3A7BA3769322FB12_FF23FF4A9898910F_6041_UN,8.226475,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010010010111100100110111010000001011100100110011110100001011011111110011101111110,DFNQMVXPBWWWEB-UHFFFAOYSA-N
N1C4CCC1C(C=CC2=C(CC)OC3=C2C=CC=C3)C4,98F76EFE302CC463_6298CE1A346A2129_7019_DP,9.186091,00000000000000000000000000000000000000000000000000000000010000000000000000000000000100000010000010010100110000010010001011000100110010000100000011010011100110101111110,LZSXPUQWSIUBOI-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NCC2=CC=CC3=C2CCCN3,38CB92B18F1B6399_92F8C213C01A9222_7022_DP,7.7845697,00000000000000000000100000000010000000000000000000000000000000000000000000100000001000100011010000101100110000011000001001000100110101010110011011011101010110101111010,FPSNTLBCAWBBIT-UHFFFAOYSA-N
C1(=C(C=CC=C1F)F)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,6AF2CAFF765C98AE_9889783E18E7F685_7022_DP,8.724847,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001011010110101111010,WRWGPSNPIQRJLE-WDEREUQCSA-N
C1(=C(C=CC=C1F)Br)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,A7F4FD27C3493E96_508C6C5EA35D7B00_7022_DP,8.72484,00000000000000000000000000000000000000000010001000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001011010110101111010,SEGKZAFDEUZFBY-WDEREUQCSA-N
C1(=C(C=CC=C1Cl)Cl)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,C1F0E335487445B5_73DFAA2EFA48747E_7022_DP,8.724835,00000000000000000000000000000000000000000000000000000100000000100100000000010101101101110011010010001001000110000000000011100100110101110110001010001011010110101111010,FIMKWOMTAFJZNU-WDEREUQCSA-N
C1(=C(C=CC=C1F)Cl)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,34CCA3D9A7376A7D_C1FBD3EDD16233E3_7022_DP,8.724827,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101110011010010001001000110000000000011100100110101110110001010001011010110101111010,ZBIHZOJPUYZOOG-WDEREUQCSA-N
CC3(C)CCCC(C=CC2=CC1=C(C=CC(=C1)Cl)[NH]2)C3,77EA944D66F32DCD_1F3508AFA3211C8D_7019_UN,8.251074,00000000000000000000000000000000000000000000000000000000000000000110000000100000000100010000000010010101010110001001101001000100110000100100000001010101000010001111010,MFMNGGLDFQRMSC-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(C)CCCCCC3,56DF93D5CB3E58D1_6AA8C22C32CE6121_6041_UN,7.3145576,00000000000000000001000000000000000000100000000000000000000000100110000000010100101101100011010010101000000010011001101011100000110001010110001000011111010110101111010,KWQNNSXECRVKEL-KRWDZBQOSA-N
FC1=CC2=C(C=C1)C(=CN2CCCNCC(C)(C)C)C3=CCNCC3,A709C4FE1332318F_95460B8949BF6AA8_6034_UN,8.4441805,00000000000000000000000000000000000000000010000000100000000000100110000000111000101101110011000010111100110110011001001011100100110100100110011001011101010110101111010,LYHUZQMHEASQQJ-UHFFFAOYSA-N
FC1=CC(=C(C(=C1)F)F)NC(COC)C2CCCOC2,5D42956EE4FE73F4_C73BA39FCADC9E8F_6041_UN,7.9006195,00000000000000000000000000000000000000000010000000000000010000000000000000000000000000110011010101100000100101010001001000000010110011110110000011010011010111111111110,WLWNYZCTFXJJFA-UHFFFAOYSA-N
FC1=CC(=C(C(=C1)F)NC[C@H]2CNCC(O2)(C)C)C#N,03C15C9020D2A33B_6ED64E051832B8B8_6041_DP,8.277602,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110001011000111110111101111110,RVFPQICBNCMMBA-LLVKDONJSA-N
NC1=C[N](C2=C1C=C(C=C2)Br)C[C@@H]3C[C@H]3C4CCNC4,7977977DDDF57CD2_8D4E7CB7EDB6F94F_6034_DP,8.62094,00000000000000000000001000000000000000000000001000000000000000100100000000010001101111110011000010001100110100010000001011100100110101110110001000011011010110100111010,LXQJBFQLJDIESX-KUNJKIHDSA-N
CCC4CCC1=C(C3=C(N1CC2CCN2CC)C=CC(=C3)C)C4,ACD6B942ADC752A8_266299AA719067C1_6034_UN,8.325226,00000000100100000000000000000000000000000000000000000000000000000100000000010001000101100000000010001100010010010010101011100100110000000110011011011110010110101111010,CJGWXYYPZXGALF-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC=C2NCC3CCN(C(CC)C)C3,CAD89409040C0D8B_22FCE78A4867C76B_6041_UN,8.567278,00000000000000000000000000000000000000000010000000000100000000000100000000010000101101110011000010001100010110010011101011100100110101110110001010011111010110101111010,UAYCZOFLIKXGCA-UHFFFAOYSA-N
O(C(=O)CN1C2CC(C1)C=C2)CCNC3=CC(=C(C=C3)F)F,46E988CD76D7ED56_B4D30D686C014312_6031_UN,7.588161,00000000000000000000000000000000000000000010000000000000000000000000000000010000001101110000000110111000110101010000001001110010110011110110001011011011011111110111110,NHZBELCYTSOGQG-UHFFFAOYSA-N
CC3CC(C=CC1=C([N](N=C1C)CC2=C(C=CC=C2Cl)Cl)C)CNC3,A2A54473BC213DA2_4725AA66C3A17110_7019_DP,8.608625,00000000000000000000000000000000000000000000000000001000000000000100000000010000101100110010001010111001000110010001100011101100100000100110011011001111010110101111010,GQJKSNFXLRNACK-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CC2C(C)(CNC2)C)C=CC(=C3)Cl)C4,99BADFC86240D4C5_DDED2D063B093BD7_6034_UN,8.048659,00000000000000000000000000000000000000000000000000000000000000000110000000110000101101110011000010001101110110011011101011100100110101100110011011011111010110101111010,HIYCRLAPGQNCAX-UHFFFAOYSA-N
ClC2=C1[N](C=CC1=CC=C2)CC45OC3(CCNCC3)C(C4)(N)C5,895C96EBC230D943_DBD6AC4CA4E6AF92_6034_DP,8.460932,00000000000100000000000000000000000000000000000000000000010000000110000000010000001111110011000111101101110100011000001011100100110111100110001001011001110111100111110,SKKDQJLBALAGJM-UHFFFAOYSA-N
BrC2=C1[N](C=CC1=CC=C2)CC45OC3(CCNCC3)C(C4)(N)C5,ED0525B0B0E1CFA8_A2D04181EFFF68C8_6034_DP,8.460923,00000000000100000000000000000000000000000000001000000000010000000110000000010000001111110011000111101100110100011000001011100100110111100110001001011001110111100111110,JKEXKKNFAIIFBO-UHFFFAOYSA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=N3)CC(CC)NCC4=C(C=CC=C4)Br,2618A60FC70DB7F5_794E970A98AA09A8_6034_UN,8.441121,00000000000000000000000000000000000000100000001000000000000000100100000000010101001101110011000010101100110110010010101011100100110100100110001011011011010110101111010,ZJPBEXNCVNYNAT-UHFFFAOYSA-N
O(C1CCCC2=C1N=CC=C2)CC3=CC4=C(C=C3)NC(=O)O4,CF5A47DBA709F910_F458F0EAB3D36610_6039_UN,9.324061,00000000000000000000000100000000000000000000000000000000010000000100000000000000000100000000000110100100011001100100011011010111110010000100001111110001111111010111110,YTULJIJGAJWOOT-UHFFFAOYSA-N
C[N]2C=C1C=C(C=CC1=N2)NCC3(CCOCC3)C4=CC(=CC=C4)F,827F88CA014E47FE_CA618E0D4776C528_6041_UN,7.1996484,00000000000000000000000000000000000000000010000000001000010000100110000000010000101100110011011010101100010101001000001011101100110011110110001001011001010111101111110,XYLOVRBXAAFDQV-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CC=N2)NCC3CCCN(C)C3C4=CC=CS4,F4CEE313FAF9094D_89802FE4117587E2_6041_UN,8.424474,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,MTZXFRUNBDOGBR-UHFFFAOYSA-N
BrC1=CC=C(C=C1)C2=NC=CN2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,1F8F655236D97755_72937AD19C31BF40_6034_UN,8.307204,00000000000000000000001000000000000000100000001000000000000000100100000000010101100101010000010010101000000100010000001011100100110001100110001011011010010110101111010,FCWOWZFNTYTBSP-UTKZUKDTSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3C4(CNC3)CCC4)Cl,8BB6616237166391_513634818A963AB1_6034_UN,7.2048717,00000000000100000000000000000000000010000000000100000000000000000110000000010110111101111011000010001001011100001000001111100100110101110110001010011011010110101111010,YMFCZEXATJZWBG-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,E79A90B857946D01_67A56FE97053D3EF_6041_UN,7.888789,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,FEWHNFKENQNWMA-ZHRRBRCNSA-N
N1CC4CCC1C(CNC(=O)C[N]2C=CC3=C2C=CC(=C3)F)C4,B943F02661C57894_8E75BF4D824C0809_6038_DP,7.8470206,00000000000000000000000000000000000000000010000000000100000000000100000000010001101101010011100110101100110100110000011011100100110110100110001001011001011110100111110,PFWYLZBDZVHJMO-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(=O)C4=C3C=C[NH]C3=C(C=C4)F,AB22B823DEE99ECB_D616EE216328F7D2_6038_UN,7.7076254,00000000000000000000000000000000000000000010000000000000010000000100000000000000001100010001100010001100110100110000011011000100110110100100001001010001111111110111110,XILUTADEGXOZFN-UHFFFAOYSA-N
ClC1=CC2=C(C=C1)C(=C[NH]2)[S](=O)(=O)N3C5=C(C4(C3)CCOCC4)C=CC=C5,D6A765AF15BF0038_B992C7D42E879256_6026_UN,8.635894,00000000000000000000000000000000110000000000000000010001011111001111000001010000110100111000001011101111011101001000011011101100111010111110001011111001010011110111110,OTYLWGSDNUAOIF-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2CCO[C@H]2C=C)Cl)C3CC3,877EF0A3C3608217_CB1CF0853B5ED45A_7022_UN,8.442169,00000000000000000000001000000000001000000000000000000000010000100000000000000000001100010011000011011001000111000000001000000000110011110110000010010011110111101111110,SRIWDJPZCAQHQR-GUYCJALGSA-N
C1CC(NC1)C3=NC2=C(C=CC=C2)N3CC4CC4(C)C5=NC=C(C=C5)F,76AF00F0285D19A1_0A56FD5170A54CCA_6034_UN,8.712101,00000000000000000000001000000000000000100010000000000000000000100110000000010101001101010011000010101100110110011001101011100100110000100110001011011011010110101111010,WINFCFRQPVLNPN-UHFFFAOYSA-N
CCCC(NC(=O)C1CC2CCC1O2)C3=CC(=C(C=C3)Cl)Cl,73E21C4EE413F2E4_B7B60DF9430B4618_6038_UN,8.081736,00000000000000000000000000000000000000000000000000000000010000000000000000000000000100010111100011000001110100110011011000000000110010100100000011010011101111111111110,LEYONJYGYSKDSH-UHFFFAOYSA-N
C(C1(CC1)C2CCCO2)=CC3=C[N](C)N=C3C4=C(C=C(C=C4)F)F,D14617C58AEE635C_EF690E7C05280DC4_7019_UN,8.220935,00000000000000000000001000000000000000000010000000001000010000100110000000010000100100010000011010010000000101001000001011101100110010100100001010011010110011101111110,AWMPFCFGNOVQFO-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)N[C@H]3[C@@H](OCC3)C4=C[N](N=C4)CC5CC5)C,88745FDECCA5D32F_8A774CAF968405ED_6041_UN,8.65695,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011001111101100110101010000001011101100010011110110001011011111110111101111110,XGQCNTQZSKYMPS-KNQAVFIVSA-N
CC1=C(C=C(C(=C1)NCCC2CC3=C(CC2)C=CC=C3)Cl)C4CC4,514DF798AEE01ABF_762B734875557B1A_7022_UN,7.7848463,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010001000000001101110110010000001000000100110001110000000011010011010110101111010,CISHRCCQMZEVPX-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NCC34N(C)CC(C3)C4,B141751C54DFBA29_0CE7A83410AEA3AD_6041_UN,6.8770194,00000000000100000000000000000000000000000010000000000000010000100010000010010001001101110011010010001000010111011001101011110000110011110110001010011011010111111111110,OZEUVVZEWSDUKE-UHFFFAOYSA-N
CC1=CC=C(C=C1)C2=NC(=C(Cl)N2C[C@H]3NCC4(C3)CC4)C#N,F2A338B08C23D9E2_1C2EA68E048755C9_6034_UN,7.197759,00000000000000000000001000000000000000100100000000000000000000100110000000010101101101010011000010001001110100011000000011100100110000100110001010011011010110101111010,ZOQBQOCTCWOGDB-AWEZNQCLSA-N
C1(=CC(=CC=C1)CC2CNCC2)C3=C(C=C(C(=C3)F)C#N)F,9FE17B4274ADAF67_1761114C8D15DC10_6005_UN,7.9439893,00000000000000000000000000000000000000000110000000000000000000100000000000000000001100110011000010001000100100010000001001000100110000100110001011010011010100100111010,KFHGDRIYLSLQOE-UHFFFAOYSA-N
FC1(CC1)C2=CC=C(C=C2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,70644EE1F2CEB6CE_E8E8B4F906B24EF4_6041_UN,8.092927,00000000000000000000001000000000000000000010000000001000010000100110000000010000101101110001011110101000000111011001101011101100110011110110001001011111110111101111110,LYHVNXJIOIMIBN-ROUUACIJSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCCC3CSCCN3,2F63308853A00467_FD1EC60944AB8320_6041_DP,7.6633663,00000000000000000000000000000000000010100000000000000100000000000100000000000100101000101011000000101100110010010000001011000100110101010110011011010111010110101111010,VQDRBTNZJLUDOJ-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NCC4CCC5=C4C(=CC(=C5)F)F,0A0F822D114A304F_72A3AD5B65C1A406_6041_DP,8.01647,00000000000000000000001000000000000000100010000000000000000000000100000000000101101101110011010010101100010110000000001011100100110101110110001011011001010110101111010,UADZXFBZGKBBON-URRZBSOSSA-N
CC1=CC(=C(C=C1)C)[C@@H]2CCCC[C@H]2OCC3OCCC34CNC4,18B7F05E74D0E10C_4E5C5347E4305710_6039_DP,8.426802,00000000100100000000000000000000000000000000000000000000010000100010000010000000001100100011000011001000010011001000001011000011110010000110000111010111110101111111110,ZVQHOHZOJIEOPR-XRRBNZLQSA-N
FC2=C1OC=CC1=C(C=C2)NCC4(N3CCN(C)CC3)CCCCCC4,0D70E5B1A93C3261_285E382170E31DC5_6041_UN,7.6575737,00000000000000000001000000000000000000000010000000000000010000100010000000010001001101110011010011101100010100011001101011100100110001110110001001011001110110101111110,BSQDESKPRQSQNL-UHFFFAOYSA-N
O=[N](=O)C1=CC2=C(C=C1)C=C(C=N2)NCC3C4=C(CC3)C=C(C=C4)F,2F4CC8034B98011F_152EEB0D8615A0A3_6041_UN,8.454055,00000000000000000000000010000000000000000010000001000000100000010100001100000001101000010011001010101110010100000000001101101100111001110100001011011001010110110111110,MSYVREHOFUVGBM-UHFFFAOYSA-N
FC2=C1C=CC=NC1=C(C=C2)NC3CN(C)C4(C3)CCCC4,05005334562704D3_C524E2D55A66EFFD_6041_UN,7.961318,00000000000000000000000000000000000000000010000000000000000000000110000000010001100101110001010010101100110110011001101011100100110001110100001001011001010010101111010,KSWARWAKBQCFNW-UHFFFAOYSA-N
CC1=NC(=C(C(=C1)NC(CCC2=CC=CC=C2)C35CC4CC(CC(C3)C4)C5)F)C,E143A86A65D33F0F_630BDEB8057D9AFD_6041_UN,8.058275,00000000000000000000000000000000000000000010000000000000000000000110000000000000100000010010000000100100110100011000001001000100110001110100001011010111000110101111010,XSPYVLDHNGIYIA-UHFFFAOYSA-N
CCC(C)C1=NC(=CC=N1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,B1CF2C1F68FBFE30_22BAE1137104783F_6041_DP,8.174159,00000000000000000000000000000000000000100010000000000100000000100100000000000100101000110011000000101000100100010011001011000100110101110110001001010111010110101111010,VFSBGLTURHGTLN-RNYWFIABSA-N
C1(=C(C=CC=C1)C2CCO2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,F74926015261789F_ED2EDBBF5D4E9002_6041_UN,8.025064,00000000100100000000000000000000000000000010000000000000010000100000000000010001100101110011010011001000100111010001101011100100000011110110001011011011110011101111110,YRMMEKHOILYTFW-ITIDOPETSA-N
CC2=C1N(C3=C(C(C1=CC=C2)=O)CCCC3)C[C@H]4[C@@H](CNC4)C5=CC=C(C=C5)Cl,779CE40AA7F57C91_CABB6B768AF22457_6034_UN,7.9966106,00000000000000000000000000000000000000000000000000000000000000100100000000010000101101110011000011101101010110010100001011100101110000100110001111011011111110101111110,WMUFQTKABXHSBP-AVRDEDQJSA-N
FC1=CC2=C(N=C1)N(C=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,6EFF95128724D0CA_C0E3F24FE2B45762_6034_UN,8.349505,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,URJFRUVZCUDHLK-BEFAXECRSA-N
BrC1=CC2=C(N=C1)N(C=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,FF0D373565711CAA_9F5BBD6763BBD076_6034_UN,8.34947,00000000000000000000001000000000000000100000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,MWCSSMVPHKREAD-BEFAXECRSA-N
ClC1=CC2=C(N=C1)N(C=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,BA307AFF549DAAE2_327B910CE6220421_6034_UN,8.349466,00000000000000000000001000000000000000100000000000000000000000100100000000010101100101010000010010101101010100010000001011100100110001100110001011011010010110101111010,AXHPXYXLYBAIAS-BEFAXECRSA-N
CN(C)CC1=C(C=CC(=C1)NCC2(C)CCCCCC2)F,951A931A37E6D5F8_524A2674259AA9AE_6041_UN,7.7694354,00000000000000000001000000000000000000000010000000000000000000000010000000100000001001110011010000001000000110001001101000100000110001110010011010011111010110101111010,KBRMWOQFFQSKAE-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCC3=C(C=C(C=C3)F)F,3C61AD47A89E033D_DF1E0182BD25C150_6038_UN,7.6362386,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,ZZNYCXSLTMXCOE-UHFFFAOYSA-N
FC1=C(C=C(C=C1)CC=C)NCCC2CCN(C)CC2,AA94A9A7B888F5CB_0ED8AE50E1F6D326_6041_UN,8.372181,00000000000000000000000000000000001000000010000000000000000000000000000000010000001001110001010000111000100100010001101001100000110001110110001011011011010110101111010,PSBQMLLXAJVJJE-UHFFFAOYSA-N
CC1=C(C(C4=C(N1CC2(CNCC2)C3=NC=CC=C3)C(=CC=C4F)F)=O)C,4BEE8176E0314598_36A6FD1888B902D9_6034_UN,8.873222,00000000000000000000000000000000000000000010000000000000000000100110000000010000101101110011000011101100110110011100101011100101110000100110001111011111111110101111110,YLPYOTOEIIMEPR-UHFFFAOYSA-N
CN5CCCN(CC1=C(C=C(C=C1)NC3CC2(CCNCC2)OC4=C3C=CC=C4)F)CC5,199928F4A8E5FD96_3ACA05532930C784_6041_DP,8.048175,00000000000000000001000000000000000000000010000000000000010000000010000000010001101001110001010001101100110110011101101011100100110111110110001011011011110111101111110,JROKONKLDGVQIS-UHFFFAOYSA-N
N1CC2CCCC1C2C=CC3=C[N](C)C4=C3C=CC(=C4)Cl,B4C9BDF74AC46C73_9F4EABB548A23488_7019_DP,8.065288,00000000000000000001000000000000000000000000000000000000000000000100000000010000001101010011010010011101110100010000001011100100110000100100001001011001010010101111010,QTHQDYVLHDUQAQ-UHFFFAOYSA-N
FC1=CC(=CC(=C1)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,691D560419CC17F3_B79FB0BE95BFA913_6041_UN,8.21517,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,VWHMBOIWSATNLP-YJYMSZOUSA-N
BrC1=CC2=C(C=C1)N(C=C2C3CC3)CC4(CCC)CCCN4,87B737CDA053BFF8_916DB6D963EDC83F_6034_UN,7.958293,00000000000000000000001000000000000000000000001000000000000000100110000000010001001101010011000010001100110110011011001011100100110000100110001000011001010110101111010,AXCCBLKTFPEOTR-UHFFFAOYSA-N
C1CC(CCN1)C3=CC2=C(C=CC=C2)N3CC4=CC(=C(C=C4)N5CCCCC5)F,AB24BCF5B24E77B1_411BA14110C4AAF1_6034_UN,8.263463,00000000000000000000000000000000000000000010000000000000000000100100000000010000001101110001000010101100110100010000001011100100110001110110001011011011010110100111010,KNMWTHLAILDLRY-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)CCC2)NC4CC(C3=CC=N[N]3C)OCC4,F74CFC634967227A_F2E05938BDFB1E64_6041_UN,7.7118897,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111100100110111010000001011101100110011110100001011011011110011101111110,SUHFECGRZVHFPZ-UHFFFAOYSA-N
FC1=CC(=C(C(=C1)F)NCC2CNCC(O2)(C)C)C#N,2753E0623A26F7C1_4C7263AD7B748FFB_6041_DP,8.047813,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110001011000111110111101111110,RVFPQICBNCMMBA-UHFFFAOYSA-N
N(C1C2CCC(C1)CC2)C(=O)CCC3=CC(=C(C=C3)Br)Cl,DA88B1E50CD64082_74CF06A82A80650E_6038_UN,7.517332,00000000000000000000000000000000000000000000001000000000000000000000000000000000000000010011100000000001110100110000011000000000110011100000000011010011001110100111110,BXBDOXSCYLOJGL-UHFFFAOYSA-N
N(C1C2CCC(C1)CC2)C(=O)CCC3=CC(=C(C=C3)Cl)Cl,9FC5FC80ABE4E8A9_0E969BBDE9732C46_6038_UN,7.517318,00000000000000000000000000000000000000000000000000000000000000000000000000000000000000010011100000000001110100110000011000000000110011100000000011010011001110100111110,RAGDIZLZVURKNQ-UHFFFAOYSA-N
N(C1C2CCC(C1)CC2)C(=O)CCC3=CC(=C(C=C3)Cl)F,0B096AAF3ABB46DC_1FCB20347C19671D_6038_UN,7.5173063,00000000000000000000000000000000000000000010000000000000000000000000000000000000000000010011100000000001110100110000011000000000110011100000000011010011001110100111110,XNDRFAKLDAQCPE-UHFFFAOYSA-N
CN(C)C1=CC(=C(C=C1)C)NCC2(CNC2)C3=NC=C(C=C3)F,602AF1F91C4D789D_EC194BC4D698BDD6_6041_DP,7.66431,00000000100100000000000000000000000000000010000000000100000000100110000000100000101001110010010000101000000110001000000011100100100101110110011011001111010110101111010,NQQJLWDTWQXXDH-UHFFFAOYSA-N
N1C4CCC1C(C=CC2=C[N](C)N=C2C3=CC=C(C=C3)F)C4,5DC5181374C704C4_8C15CC20006EC563_7019_DP,8.229316,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010010011010010000110100010000001011101100110000100100001011011011000010101111010,LUWHJKVODPUJDO-UHFFFAOYSA-N
CC1=CC(=NC(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)CC#N,35E48E83C196C776_91A0F9CEC4417D29_6041_DP,7.3131933,00000000000000000000000000000000000000100110000000000100000000100100000000000100101000110011000000101000100110010000001011000100110101110110001001010011010110101111010,HBWPCTGBYVBWBS-QFBILLFUSA-N
CCNC5CCC1=C(C4=C([N]1C[C@@H]2C[C@H]2C3CCNC3)C=CC(=C4)Cl)C5,BCA7589BEC6DC0C3_936370816F1D7D83_6034_DP,7.736975,00000000000000000000001000000000000000000000000000000000000000100100000000010000001101110011000010001101110110010010001011100100110101100110001011011011010110101111010,UVEGSUOPQNYNQN-LSCKAKRGSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC4(CCC4)C5=C(C=CC=C5F)F,CCF714BD560D70A8_A9F777B0CD24CBB8_6041_DP,8.231823,00000000000100000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010010101111010,GLHXEBQXAPKWIO-ZHZUQJFRSA-N
FC1=CC2=C(C=C1)C(=CN2C[C@H]3[C@@H](CCNC3)C4=CC=C(C=C4)F)C5CCNCC5,3E1CA67EC85FBB11_3CDA8EE955F05462_6034_UN,9.088813,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010101100110100010000001011100100110100100110001001011011010110100111010,WWYFLLRCRULTPR-UGKGYDQZSA-N
CCOC(OCC)C2=NC1=C(N=CC(=C1)Br)N2CC4(CC3=CC=CC=C3)CCNC4,56E8C1BF45B1BF59_D3AF5534C9FDEEDE_6034_UN,8.492422,00000000000000000000000000000000000000100000001000000000000000000110000000010101101101110011000110101100110101011010001011110110110000100110001011011111010111111111110,QMDAIKCTJCSVHU-UHFFFAOYSA-N
CC1=C(C=C(C=C1)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)C#N,75217632027688A2_576D302417454FD6_6041_DP,8.044277,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010101111010,RLCHDZGJSCNUKN-VQIMIIECSA-N
O(C3CCN(CC1=CC=CC=C1)C2(CCC2)C3)CC4CNC(CO4)(C)C,487B24B0C2BF4E54_2FD4BA45CE4C73F7_6039_DP,8.009181,00000000000100000000000000000000000000000000000000000000010000000010000010110000001001100011000101101000110001011001101011100011110010000110001101011101110111111111110,PASJNEVMLNVXTM-UHFFFAOYSA-N
C1(=C(C=CC2=C1OCO2)F)NCC3CCNC(C3)(C)C,01FC2AFEFA34859D_16B01CB380936C9C_7022_DP,7.9185424,00000000000000000000000000001000000000000010000000000000010000000010000010100000001100010011000111101100110111011101101011010000110101110110001011010111110111111111110,UCAGQTNJIHYHKR-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NCC3C(C3)C4CCCC4)C,4A2F81E602095A9F_2D86CF18E2E8F049_6041_UN,8.261403,00000000000000000000001000000000000000000010000000000000000000100100000000000000101000010011000010101100010110000000001001000100110001110100001011010111010110101111010,CUWVTTDFJFDOBZ-UHFFFAOYSA-N
CN3CCC1=C(C=CC=C1NCC2(CCCNC2)C)C3,80A6B14638DFA74E_5661DF872FB152D6_6041_DP,7.4733367,00000000000000000000000000000000000000000000000000000100000000000010000000010000101001100011010000101100110010011001101011100000110101010110001011011101010110101111010,QSQVIHVKVKZBPF-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CC3=COC4=C3C=CC(=C4F)F,71D472F8F0030F88_FFDB6A7BF3EB5F31_6038_UN,8.153276,00000000000000000000000000000000000000000010000000000000010000000000000000000000001100010011100010001100110100110000011000000100110010100100000011010011111110110111110,BQRPSAZVRBONJR-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CC3=COC4=C3C=CC(=C4Cl)Cl,3DA3CD08FD41152A_B9FCD80A01831C79_6038_UN,8.15327,00000000000000000000000000000000000000000000000000000000010000000000000000000000001100010011100010001101110100110000011000000100110010100100000011010011111110110111110,DBSMESSDYBNWQM-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@H]2CC4(CN([C@@H]2C)CC3=CC=CC=C3)CCC4)Cl)C5CC5,F4E19232F6F023A6_08F32E1AD887D1C8_7022_UN,8.274074,00000000000100000000001000000000000000000000000000000000000000100010000000010001000001110001000000101001110110011000101001100100110001110110001011011111010110101111010,BBBVDMRQMNDZIF-CLOONOSVSA-N
CC1=CC=C(C=C1)C2=NC(=C(Cl)N2C[C@H]3[C@@H](CNC3)C4CCOCC4)C#N,9215A9CD015E6236_8C4C39624C6F3A13_6034_UN,7.862084,00000000000000000000000000000000000000100100000000000000010000100100000000010101101101110011000010101001000101000000001011100100110010100110001011011011010111101111110,FWLPDSVWLZTMHZ-ROUUACIJSA-N
C[N]1C=C(C2=C1C=CC=N2)NCC3=C(C=CC(=C3)C4OCCO4)F,9B0ADD1D53AC3BC4_557591173FC3F2B5_6041_UN,7.5495768,00000000000000000000000000000000000000000010000000000000010000100100000010010001101101010000010010101100010101000000001011110100000011110110001011011011010111111111110,CVTQIRGFXDEZLN-UHFFFAOYSA-N
C1(=CC2=C(C=C1)OCCC2)NC3=C[N](C[Si](C)(C)C)N=C3,0A52F893ECD2E81A_D5FD4D9C61F676FF_6041_UN,7.251342,00000000000000000000100000001010000000000000000000001000010000000100000000110001100100100001011010101100010001011101001011101100100011010110011011011101110111101111110,DSUXUSQBMXWWSB-UHFFFAOYSA-N
C(CC23CC1CC(CC(C1)C2)C3)=CC4=C[N](C)N=C4C5=CC=C(C=C5)F,8EAE033A939AB287_769A3DB3CFCAB05E_7019_UN,7.8180695,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010000011010010100010100001000000011101100100000100100001011001010000110101111010,LAWKHCGZKYUKHB-UHFFFAOYSA-N
FC2=C(C=C1C(=C[N](C1=C2)CC3C(CCNC3)(C)C)CC#N)F,F79FB75204F3259B_77C2F5E80DD6B64B_6034_DP,8.563211,00000000000000000000000000000000000000000110000000000000000000000110000000110000101101110011000010101100110100011001101011100100110000100110001011011111010110101111010,WPSMOPNBYCZTKQ-UHFFFAOYSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NC3(C)CCC4(CC3)OCCO4)C5,D74EFBED1A98F268_7F6A3E68E93D6A1E_6041_UN,7.288988,00000000000000000000000000000000000000000000000000000000010000000110000010010000100101100011010010101100110001011001101011110100110111010110001011011101110011111111110,INTRBPTWLDTUPP-UHFFFAOYSA-N
CC1=C(C=NC=C1N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)C#N,F4B6E71156415B7E_D73C3DA966DCD531_6041_DP,7.834498,00000000000000000000000000000000000000000110000000000010000000100100000000000001101000110011000000101000100100010000001011000100110101110110001011010011010010101111010,DDXLGVGGCIKZLT-RDTXWAMCSA-N
FC(CBr)C1=CC=C(C=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,E16639C17E96673A_8CDCD11ABD287833_6041_UN,8.696608,00000000000000000000001000000000000000000010001000000000000000100100000000010101101101000011010010101000000100010000001011100100110001110110001011011011010110101111010,NQDQCAYDTLJNOM-SZBOGAFOSA-N
NCC1=CC2=C(C=C1)C(=O)C=CN2CC3CCNC4=C3C=CC(=C4)F,DAA26A9AC3199AA1_C3E42BF12E2C5D93_6034_UN,8.593696,00000000000000000000000000000000000000000010000000000000000000000100000000010000001011010001000001101100110100010100001011100101010100110110001111011001111110100111110,OWSDKENYYIZAPF-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2=CC4=C(C=C2)OC3(CCCCC3)O4)F,B49F9C94C51C3779_194B26C9AFCEFFE5_7022_UN,7.6649055,00000000000000000000000000000000000000000010000000000000010000000000000010100000000101110001010011001100010100001101001010110100110011110100001011011111110111111111110,BWEAPJBQNZYVAE-UHFFFAOYSA-N
CC(C)C1=C(C=C(C=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)F,1C547F8E7398A747_173AF837E675A5D1_6041_UN,8.396557,00000000000000000000001000000000000000000010000000000000000000100100000000110101101101010011010010101000000100010000001011100100110001110110011011011111010110101111010,FRTKGKLVGAALDL-ZHRRBRCNSA-N
CC1=C(C(=CC(=C1)N[C@@H]2CNC[C@H]2C3=CC=CC=C3)F)C#N,2BBCB12A17AB7E61_E2A8EAE3D702CC56_6041_DP,7.773654,00000000000000000000000000000000000000000110000000000110000000100000000000000001101100110011000010001000100100010000000001000100010101110110001011000011010010101111010,HDEFGCBCPHCHPT-FUHWJXTLSA-N
FC1=CC4=C(C(=C1)NC3=C(CN(C)C2CCCCC2)C=CC=C3)OC=C4,40FCBEE8FCAF967C_138C5A0A52B20356_6041_UN,8.329331,00000000000000000000000000000000000000000010000000000000010000000000000000000000100101110010010110001100010110010001101000100100110001110100001011011011110110101111110,SJCFEXPXBBGLIB-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NC4CCC3(COC(C)(C3)C)CC4,C51CA9CA3CC148BA_62B4D85DA6CC7EE2_7022_UN,8.533009,00000000000000000000000000000000000000000010000000001000010000000110000000110000100100010010001010001000110111011001101011101100110011110110001011011111110111101111110,XSCIARAQSYUVSO-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CCOC2(CCC2)C3)F)CC4,650211069433FF2E_CD4EDA421E68D08A_6041_UN,7.033505,00000000000100000001000000000000000000000010000000000000010000000010000000010001100001110011010001101000110111011001101011100000110011110110001011011011110111101111110,AQAODPHJHSMPEN-UHFFFAOYSA-N
N(C1C2CCC(CC1)CO2)C(=O)C[N]3C=CC4=C3C=C(C=C4)F,69B3388F4CB85730_785805DEBB14305E_6038_UN,7.7651615,00000000000000000001000000000000000000000010000000000000010000000100000000010001000101010011100110101100110101110000011011100100110011100110001001011001111111110111110,VQYXIVHKIWARME-UHFFFAOYSA-N
CC1=C(C(=CC=C1)Cl)NCC3(C2CCNCC2)CCOCC3,F9AF8EBB38BD16F7_A7A7896644A174E9_7022_DP,8.449504,00000000000000000000000000000000000000000000000000000000010000100010000000000000001000110011000000101001100111011000001011000000110111110110001011010011010111101111110,ILGSIKPPMRHFOC-UHFFFAOYSA-N
CC1=C(C(=CC=C1)F)NCC3(C2CCNCC2)CCOCC3,C5CD29F846D51F78_837BDEF2588C1975_7022_DP,8.449491,00000000000000000000000000000000000000000010000000000000010000100010000000000000001000110011000000101000100111011000001011000000110111110110001011010011010111101111110,ATNKLVMUUMFJCO-UHFFFAOYSA-N
CC1=C(N=C(N=C1)NCC2C(C)(C)C3CCC2C3)C4=C(C=CC=C4)F,2374012205F398DA_B87E682817173877_6041_UN,8.209925,00000000000000000000000001000000000000000010000000000000000000100110000000100100101000010001000010101000011110001000101011000100110001110100011011010111010110101111010,PUSDFKPZDJJTGO-UHFFFAOYSA-N
N1CC(C1)C2=NC=C(C=N2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,F3182030D1BBF6C2_BBF7D8B312DFD24E_6041_DP,8.644513,00000000100100000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100000101110110001001011011010010101111010,ZGQMCWJZVNZYOK-SJORKVTESA-N
ClC1=CC3=C(C=C1)C(=O)C2=C(CCCC2)N3C[C@H]5N[C@H]4CCC[C@H]4C5,17E623CF6416C7A4_F4B64559ABD10A86_6034_UN,8.695833,00000000000000000000000000000000000000000000000000000000000000000100000000010001000101010011000011101101110100010100001011100101110000100100001111011001111110100111110,XFIBGUUAMMBFJO-YEWWUXTCSA-N
CC1=C(C=C(C(=C1)NC2C4(CC3=C2C=CC=C3)CCOCC4)Cl)C5CC5,26B48864224B159E_3CA8CCBDAF8C1746_7022_UN,7.6951723,00000000000000000000001000000000000000000000000000000000010000100010000000000000000000110011000010100101010111001000001000000100110011110110000011010011010011101111110,BQLOHWIETHWGDF-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4=CC(=C(C(=C4)F)N5CCOCC5)F,EDAAEE64C239A594_0E5B2C993F16909E_6041_DP,8.160996,00000000000000000001000000000000000000100010000000000000010000100100000000010101100101110011010110101000110101010000101011100100110111110110001011011011010011101111110,JWOREZDLNHZRLU-SCAQPMJSSA-N
FC2=C(C=C1C(=CN(C1=C2)C[C@@H]3CNCC[C@H]3C4=CC=CC=C4)CC#N)F,823C1526DD8F1507_E130F1AC2D22ECBE_6034_UN,7.950561,00000000000000000000000000000000000000000110000000000000000000100100000000010000101101110011000010101100110100010000001011100100110000100110001011011011010110100111010,SYJMXSYSBNXZMV-ROUUACIJSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4=CC=C(C(=C4C)F)F,393F16E311610012_E9A9FD8532D5A72C_6041_DP,8.509603,00000000000000000001000001000000000000100010000000000000000000000100000000000100100101010011010010100000111100010000101011100100110101110100001011011111000010101111010,GADZCAXDHFQCCJ-BTTYYORXSA-N
N(CCC1CC2CCC1C2)C(=O)CC3=C(C=CC=C3F)F,4980E23E51373D08_7AA2BC6AC7139B3A_6038_UN,7.364434,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010001100010001000110100110000011000000000110010100000000011010011011110100111110,GMSRXZWRSZEXKZ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=NNC(C=C2)=O)NCC3(C)C4CCC(C3)O4,3043725350DCF6E4_6624C9BE8AFC7F10_6041_UN,8.237151,00000000000000000000000000000000000000000010000000001000010000100110010000000000001100010011101111101000010110101101111011001101110111110100001111010011111111111111110,RMRWQKTYLAPQRN-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)NC2=CC(=C(C=C2F)F)C)[C@H]3C[C@@H]4CC[C@H](C3)N4,3396FC3BD5D340FA_7FB5E3ECEDC92235_6041_DP,8.381619,00000000000000000001000000000000000000100010000000001000000000000100000000000101100101110011011010101000110100010001101011101100110101110100001011011111010110101111010,IHTJLHULKKQEOB-MIFYACCESA-N
FC1=C(C=C(C=C1)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4)C5OCCO5,376204DC3972D020_5083C0C786452426_6041_UN,7.868842,00000000000000000000001000000000000000000010000000000000010000100010000010100000001100010011000010001100010101001001101010010100110011110110000011010111010111111111110,KABMEXRGWFOXJW-UHFFFAOYSA-N
C(C2CCC1CC1C2)=CC3=C(C)[NH]C4=C3C=C(C=C4)F,31878FF1424D82D0_4641E8EF0AD129FD_7019_UN,9.342642,00000000000000000001001000000000000000000010000000000000000000000100000000000000000100010000000010010100010100000000001001000100110000100100000011010011000010001111010,YBRLNCYAZLVSNM-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCCC2CCCCC2)Cl)C3CC3,F77AF997D3254E2A_D79FC802A4C15B1D_7022_UN,7.492008,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010001000000001001100110010000001000000000110001110000000011010011010110101111010,SLBYQXRIOUOCLU-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2C[C@@H]3CCCN3CC4CC4,9025A75FD2D18D22_8D052AA3F1FAF8E4_6034_UN,8.258816,00000000000000000000001000000000000000000000001000000000000000000100000000010001000101110000000010001100010100010000101011100100110000100110001010011110010110101111010,AXMJQSLGVQSCQQ-KRWDZBQOSA-N
NC2=NC1=C(C=C(C=N1)Br)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,96842A2518531132_4AAF3B2630C8B134_6034_UN,8.3561325,00000000000100000000000001000000000000100000001000000000000000000110000000110101100111010010000010101100011110001000101011100100110001110100001011011111010110101111010,QJZBNFPCQCLFNP-CIZBPJNJSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC4OC3(CCC(C)(CC3)C)CC4,2434F3FF782B50A0_96A6C137ACE6B5D6_6041_UN,7.708767,00000000000000000000000001000000000000000010000000000000010000000110000000110101001101010011010110001100011110001001101011100100110011110100011011011111110111101111110,XDLVFIUNBRXEAX-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)C4=C(C=CC(=C4F)C)F,0A410950F1AC6AFC_0AD215D3D0CCBAD4_6004_DP,8.518122,00000000000000000001000000000000000000100010000000000000000000100100000000000101100101010011010010100000110100010000101011100100110001110100001011011111000010101111010,MMEFXGNKBHOZQG-BTTYYORXSA-N
FC2=C1OC=CC1=C(C=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,5F6B2121C2EE5FA0_2C17F0AE4B943415_6041_UN,8.401529,00000000000000000000000000000000000000000010000000000000010000000000000000000000100101110010010011001100010110010001101000100100110001110100001011011011110110101111110,LJNSSIXZHBWEID-UHFFFAOYSA-N
N4C[C@@H]1COC[C@]1(C=CC2=C(C)[N](C(=C2)C)C3=CC=C(C=C3)F)C4,0E4F5E7039E5D0CF_6DE1C2A02F76621A_7019_DP,8.558907,00000000000000000000000000000000000000000010000000000000010000100110000000010000001101110011000011011100010101001000000011100100110001110110001010001111010011101111110,RZMPYJYLIAGQBO-XLIONFOSSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[C@@H]3CCCO[C@H]3C4=C[N](C)N=C4,AA48C0088A4C65AA_22FEB3EA9874ABD5_6041_UN,7.890507,00000000000000000000000000000000000000000010000000001000010000100100000000010001101100010011011011101100010111000000001011101100110011110110001011011111110111101111110,LBFJSCRXCIEEOH-MGPUTAFESA-N
FC1=C(C(=CC=C1)NCC2(C)CCC3(CC2)CC3)C4CC4,28E908D5AD8BDC13_253F8B9F158B0735_6041_UN,7.7038093,00000000000000000000001000000000000000000010000000000000000000100010000000000000001000010011000000001000010100001001101000000000110001110000000011010011010110101111010,LTYONQGYEPJFND-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,F42F8C1057E5D43E_2E9F0B977AA05B72_6038_UN,7.938107,00000000000000000000000000000000000000000010000000000000010000100000000000010000101101110111110011101000010111110001111011100000110010100110001011011011111111111111110,CLNXDYXJIKIPCV-VURVLWSRSA-N
CN1C2CCC(C1)CC2CNC(=O)[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)Cl)F,8B71E78B36E2A24B_4D0AEAB57F45A2F7_6038_UN,7.9381056,00000000000000000000000000000000000000000010000000000000010000100000000000010000101101110111110011101001010111110001111011100000110010100110001011011011111111111111110,LASPIYHSMWJJAD-VURVLWSRSA-N
CC1=C(C=C(C(=C1)N[C@@H]2CCN(C)[C@H]2C3=CC=CC=C3)Cl)C4CC4,6F3B97169F3615DB_3D26A9A46C7050EC_7022_UN,8.609549,00000000000000000000001000000000000000000000000000000000000000100000000000010001100101110011010010001001100110010001101001100100000001110100001011011111010010101111010,HTGKWTJQSPCKEJ-CTNGQTDRSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CC4(C3)CCOC4,7BA3DFFDC53445A9_3B6BAB38D9358BC8_6041_UN,7.071197,00000000000100000000000000000000000000100000000000000000010000000110000000000100001100100010000010101100010011001000001011000100110011010110011011010111010111101111110,FQZZLJBEKVIXFM-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4=C(C=CC=C4)C5=C(C=CC=C5F)F,3E2629751EA173D6_FCA97E9959A34A3B_6041_DP,8.157692,00000000000000000001000000000000000000100010000000000000000000100100000000000101100101010011010010100000110100010000101011100100110101110100001011011011000010101111010,GTLZGVHTWVQFHA-BJWYYQGGSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCOCC3)C4=CC=C(C=C4)F,56DFBE6FB753C760_C7D74011B55F9729_6041_UN,7.5160255,00000000000000000000000000000000000000000010000000001000010000100110000000010000101100110011011010101100010101001000001011101100110011110110001001011001010111101111110,JCPGAYYIEFBOAN-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2C3(C2)CCOCC3,04959E12938CDFDE_365D90E300CCB630_6041_UN,7.4202833,00000000000000000000101000000010000000000000000000000000010000000110000000100001001000100011010000101000010001001000001011000000110011010110011011011111010111101111110,ALGPTUVXUMKWNQ-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C3=C2CCCCCC3)CC5[C@@H]4C[C@@H](C4(C)C)CC5,0CFD3165AD083D6D_072FB6BD49268F64_6034_UN,7.604741,00000000000100000000000000000000000000000000001000000000000000000110000000110000000101010000000010001100010110011000101001100100110000100100000011011100010110101111010,NVCGSJRIZASNLW-WURXZWLQSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC4OC3(CCC(C)(CC3)C)CC4,3EF385CBD26F4740_62CD2E3AAA2EFA1B_6041_UN,7.7389345,00000000000000000000000000000000000000000010000000000000010000000110000000100000101100010011000110101100010100001001101011000100110011110100011011010111110111101111110,CHUNZSSYKPAUES-UHFFFAOYSA-N
C1(=CC=C(C=C1)C(F)F)NC2CCN(C)C23CCCNC3,3E9669A0E555319F_A058953C67422B64_7022_DP,7.7943707,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101100011010010101000110110011001101011100000110101110110001001011001010010101111010,NFWJZMIUTNJXPT-UHFFFAOYSA-N
NCC1=CC2=C(C=C1)C(=O)C=CN2CC3CCC4=C3C=CC=C4,AED2A31798315FB1_5A9DEABC3E0392F1_6034_UN,9.21375,00000000000000000000000000000000000000000000000000000000000000000100000000010000001011000000000011101100010000000100001001100101110000000110001111011001111110100111110,ZQNIEYHZTWHJHS-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCN(CC2)C3CCOCC3)F)CC4,080A821131EC2EC9_54E54E20ACBF160E_6041_UN,7.4756227,00000000000000000001000000000000000000000010000000000000010000100000000000010001100001110010010001101000100111010001101011100000110011110110001011011011010111101111110,NUPMOQOGTVJQGW-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2=CN(C(=N2)C3CCCN3)C[C@]45CNC[C@H]4CN(C)CC5,E6C3025C5156C225_6499C5143013A399_6034_UN,8.259366,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101110011010010101100110110011001101011100100110100100110001011011011010110101111010,LISNRRCZWDQEKK-RLPNNEDTSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2C3(CCNC2)CCC3)F)CC4,7A73563F02260B2B_F8035B3C2D3C79EA_6041_DP,7.3958745,00000000000100000001000000000000000000000010000000000010000000000010000000010001101001110011010000101000110110011001101011100000110101110110001011011011010110101111010,BAXJEGMNBUCSSW-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2CCC=CC2,501D6AF89E014B33_5A8D261845696794_6041_UN,8.355775,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100011010000111000000000001000001001000000110001010100011011011111010110101111010,KGFMVOLYLQLSSG-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC3CCCCC3CC4CCCC4,460AD635DE44D4C0_02B426272CA8FFBB_6041_UN,8.257942,00000000000000000000000000000000000000000010000000000000000000000100000000000000100000010011000010100100110100010000001001000100110001110100001011010011000110101111010,PVFJKFXBTINGDC-UHFFFAOYSA-N
CN(C1CC1)C3=C2C=CC=CC2=NC(=N3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,9991A6B2DF9C4B9F_234DB61ED8684E18_6041_UN,8.62361,00000000000000000000001001000000000000100010000000000000000000100100000000010101100101110011010010101100111110010001101011100100000001110100001011011111010010101111010,ILGSFEVKQLOXCX-RTWAWAEBSA-N
N1CC2CCC1CN2C3=CC=C(C=C3)N[C@H]4[C@H](CCNC4)C5=CC(=CC=C5)F,202F6A791B275442_98EA610769B35BD4_6041_DP,7.520877,00000000000000000000000000000000000000000010000000000010000000100000000000010001001001110011000000101000110100010000001011100100110101110110001001011011010010100111010,PEYXHPFXOOSBLA-XMJKJUTBSA-N
FC1=C(C=CC2=C1CCC2)NCC3=C(C=N[N]3C)C4CC4,E7B4393C8A9A7212_A696456A1249A187_6041_UN,7.9437566,00000000000000000000001000000000000000000010000000001000000000100100000000010001101100010001011010001100010100010000101011101100110001110100001010011011010110101111010,MKMHFYILYTXAMC-UHFFFAOYSA-N
C1(=CC(=CS1)Br)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,B4EDE21E3F412769_D78217CA3DF40C42_7022_UN,7.8662343,00000000000000000000001000000000000010000000001100001000000000100100000000010001111101011011011010101000000100010000001011101100110001110110001010011011010110101111010,SBYIDIUVVDPNLG-PXAZEXFGSA-N
C[Si](C)(C)C1=C(C=CC=C1)NCC2C3(CCNC2)CCC3,1316D7B9C1D8347F_1B644CA45541ED01_6041_DP,7.468865,00000000000100000000100000000010000000000000000000000100000000000010000000100000101000100011010000101000110000011000001001000000110101010110011011011111010110101111010,NKSLPGKECYWZLG-UHFFFAOYSA-N
N(C1C2CCC(CC1)O2)C(=O)C[N]3C=CC4=C3C=C(C=C4)F,0AF221C8C58361CA_2C7DA1AA6597035E_6038_UN,7.7839317,00000000000000000001000000000000000000000010000000000000010000000100000000010001000101010011100110101100110100110000011011100100110011100100001001011001111111110111110,UAAJWZZLXMSTTH-UHFFFAOYSA-N
C1(=CC(=CS1)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,A00F7E4E9B461EE3_F8F8633F0A3A36D3_7022_UN,7.8662186,00000000000000000000001000000000000010000010000100001000000000100100000000010001111101011011011010101000000100010000001011101100110001110110001010011011010110101111010,NXWBVRPWHZCZRW-PXAZEXFGSA-N
FC1=CC=C(C=C1)C2=NOC(=O)N2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,0BB61CEDC2640AB8_30FEA551A1F91F62_6034_UN,8.494347,00000000000100000000000100000000000000100010000000000000010000100110000100110101000101010000001111001010011110111100111011111101110000100100001111011110011110111111110,NKNPOEJVKBOWCT-JGGQBBKZSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)N[C@@H]4C6=C(OC5(C4)CCC5)C=CC(=C6)F,5710D351AA88B6F0_BAE74E912E3BADCB_6041_DP,8.541182,00000000000100000000001000000000000000100010000000000000010000000110000000000101101101110001010011101100110110011100001011100100110111110110001011011001110011101111110,CYOPRUFTUNRSLM-VDXVPGQCSA-N
N(C2C1C3CC4C1CC5C2C3C45)C(C7=C(CC)N=C6C=C(C=CC6=C7)F)=O,05AED41A9A9050C8_EB52E8E08229CE74_6038_UN,8.583818,00000000000100000001000000000000000000000010000000000000000000000100000000000000100000010001100011100100010100110010010001000100110001100100001011000011001110101111110,APSUYCKELPMRFR-UHFFFAOYSA-N
CN5CCC1=C(C4=C([N]1CC2CCC3(CN2)CCCC3)C=CC(=C4)Cl)C5,5E11F2AB36428E42_27C561F9C554EC36_6034_DP,7.0759,00000000000000000000000000000000000000000000000000000000000000000110000000010001101101110011010010101101110100011001101011100100110000100110001011011001010110101111010,QYVACGRDDWQBBR-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)CCC2)NC(CC)C3CCCCO3,4E44DBF662681647_22A7B97A7BBB7F10_6041_UN,7.6406612,00000000000000000000000000000000000000000010000000000000010000000000000000000000000000010011000110100100110111010010001000000000110011110100000011010011110111101111110,WHPKUDZBFMJPLG-UHFFFAOYSA-N
ClC1=CC2=C(C=C1)N(C(=N2)C3CCCN3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,308BE1888C325AF4_8967DB1781219D52_6034_UN,8.889789,00000000000000000000001000000000000000100000000000000000000000100100000000010101101101010011010010101101110100010000001011100100110001100110001011011011010110101111010,XZISOSQWNZNGCA-IEOYFEGYSA-N
CC1=C(C=C(C(=C1)NCC2(C)CCCCCCC2)Cl)C3CC3,75571D704BAEC021_FEDD75363915CE57_7022_UN,7.3055835,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010011000000001101000110001001101000000000110001110000000010010111010110101111010,GVSOJRGEPSXLAG-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)C3=NC2=C(C=CC=C2)N3CC4CNCCC45CCN(C)CC5,C4B195D02C733B94_8C5B47708644D207_6034_UN,7.872713,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101110011010010101100110100011001101011100100110000100110001011011111010110101111010,LYBYADCYYAGQPM-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3CCCCC3N4CCOCC4,83324FDE888B76B8_32F511D5FC7B9D7D_6041_UN,8.158113,00000000000000000000000000000000000000000010000000001000010000100100000000010001100101110011011110101100110101010000001011101100110011110110001001011011010011101111110,WZZGBQRBJWAUDX-UHFFFAOYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC4=CC(=C(C=C4)N5CCCC5)F,B3E722F3395B42AF_5B43CEBA2ED49B5A_6041_DP,7.424588,00000000000000000000000000000000000000100010000000000000000000100100000000010101100101110011000010101000110100010000001011100100010101110110001011011011010010100111010,DOFLGTOVCRBQSZ-KSMMKXTCSA-N
CC1=C(C=C(C(=C1)NCC2C(CCC2)C3CC3)Cl)C4CC4,E8993E05F91BFBDA_AEB9FA3F98DF116B_7022_UN,7.448814,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010011000010001001000110000000001000000000110001110000000010010011010110101111010,OBPIVMNQDLWBOM-UHFFFAOYSA-N
CC1=C(N=C(N1CC23CC(F)(C2)CNC3)C4CCCN4)C5=CC=CC=C5,4970EC97D403FAD4_8CDEAE7EA36B568F_6034_UN,8.075288,00000000000100000000000000000000000000100010000000000000000000100110000000010101101101110011000010101000110100011000101011100100110100100110001011011011010110101111010,FDGBHCQODVBEJM-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CC(C)(C)NC3)Cl,E1573FEC956E185E_5E4538BF6AC131A9_6034_UN,8.36981,00000000000000000000000000000000000010000000000100000000000000000110000000110110111101011011000010001001101110011001100111100100110101110110011010001111010110101111010,OQFOYRNBOHVOEF-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3(C)C(OCC3)C4CC4,6D0269C4861CFDCD_24BB94BDC94A9418_6041_UN,8.195763,00000000000000000000001000000000000000000010000000000000010000100110000000000001001100010011000011101100010111001001101011000100110011110110001011010111110111101111110,GMAYESXZVGCWOO-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NCC3(C)CCOC2(CCC2)C3)C4CC4,82F84650B635AE4B_53E24C0DBB24FFBE_6041_UN,7.549095,00000000000100000000001000000000000000000010000000000000010000100010000000000000001000010011000000101000010111001001101000000000110011110110000011010011110111101111110,DVQHQLOMRAXYKV-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC4(CC3=CC(=CC=C3)Br)CC4)C5=CCNCC5,02D322E47DDA201E_A55CBE3A8A7543D2_6034_UN,8.288509,00000000000000000000001000000000000000000000001000100000000000100110000000011000001101110001000010111100110100011000001011100100110000100110001001011001010110101111010,BDZNPXBWZZCIJU-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2OC3(CC2)CCOCC3)F)CC4,CA9CA99302BD2712_477F995C6792D1AB_6041_UN,6.8220806,00000000000000000001000000000000000000000010000000000000010000000010000000010001101101110111010110101000010111011001101011100000110011110110001011011011110111111111110,PNATUVZBAICUJP-UHFFFAOYSA-N
CC(C)(C#N)C1=C(C=C(C=C1)NCC3CC2(CNC2)C3)F,C711764F8D0C96CD_6D4C5119E461DB8D_6041_DP,7.8756046,00000000100100000000000000000000000000000110000000000000000000000010000000100000001000110010000000001000010100001000000001000000100101110110001010000111010110101111010,GMBSQALKZHAKCU-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC3CCC2(CCCCO2)CC3)F,B4A77020FF2BA217_CACC2C4F8400D035_7022_UN,7.7429466,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110011010000101000110101011001001000100000110011110110001011011111110111101111110,RURWVTSTCRIZIB-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CCNCC2=CC(=CS2)Br)C=CC(=C3)C)C4,8BA98B5AC05386FE_EBCB6BCB6E3BE89F_6034_UN,8.235875,00000000000000000000000000000000000010000000001000000000000000000100000000010001011101111000000010001100110110010010101011100100110000100110001011011101010110101111010,BSXJDBYEWQEVQJ-UHFFFAOYSA-N
CC1=C(C3=C(C=C1)N=C2CCCCC2=C3NC(CCC)C4=CC=CS4)F,69FCEBCB53ABA036_20ED22C1D2C694AF_6041_UN,7.677373,00000000000000000000000000000000000010000010000000000000000000000100000000000000110100011011000010100100110100010011001011000100110001110100001011010111000110101111010,DTHVADJJEYIPCK-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2CCCC3(CC2)OCCO3)F,9446F1BDFCD3C94A_33FD59CE490A8B63_7022_UN,7.62045,00000000000000000001000000000000000000000010000000000000010000000000000010100000000101110011010010001000110101011001001010110000110011110110001010011111110111111111110,LSQDYOIFXQMUKJ-UHFFFAOYSA-N
OC(CF)C1=CC(=CC=C1)NCC2N(C)CC3(CC2)CCC3,900CAF0C990942DA_A982E106669578CA_6041_UN,8.064321,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001100011010000101000110010011001101001100000110111110111001001011011110111101111110,BAOBMNYBNSOXMP-UHFFFAOYSA-N
CC1=C(N=C(N1CC2(F)CCOC2)C3CCCN3)C4=CC=CC=C4,E645EDC3BEFCB70A_9673741D231B9110_6034_UN,8.243711,00000000000000000000000000000000000000100010000000000000010000100110000000010101001101110011000011001000100101011000101011100100110010100110001010011011010111101111110,ADSHITJWJTWYBR-UHFFFAOYSA-N
C2(=C1OC=CC1=CC(=C2)F)NC3=CC(=N[N]3C)C4CCCCC4,9175E684F79D03E0_2DC064D0A93BA59E_7022_UN,8.353151,00000000000000000000000000000000000000100010000000001000010000100100000000010101100100010000011110000100010100000000001011101100110001110100001011011011100010101111110,KDYSTCAJRLXPLE-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(C3=C(C)C4=C([NH]3)C=C(C=C4F)F)=O,CD1D6A934EBE4B00_3AF066D4168D19A1_6038_UN,8.109568,00000000000000000000000000000000000000000010000000000010000000000100000000000001001100010011100110001100010100100000011001000100110100100100001011010011011110101111110,FHFFJDYABNPJEA-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NCC3=C(C=N[N]3C)C4CC4,3F8DE1BB3E5FB8B8_97EE652CFF9A86A2_6041_UN,7.742955,00000000000000000000001000000000000000000010000000001000010000100100000010010001101100010000011010001000000101010000101011111100100011110110001010011011010111111111110,GZXCTIYNCMIVJE-UHFFFAOYSA-N
CN1CC(CCC1)C=CC3=CC=C(C2=C(F)C=CC=N2)O3,F87BF2E594E66693_624141A4F5F44696_7019_UN,8.389986,00000000000000000000000000000000000000000010000000000000010000100100000000010000000101110000010110111000000110010001101011100100110000100110001011011010110010101111110,XLVJONMMNATUHR-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@H]3C[C@@H](C)NCC3)Cl,5B39FE0620F83C22_138D78EB51C712A4_6034_DP,7.833222,00000000000000000000000000000000000010000000000100000000000000000100000000010110011101011011000010101001101110010001101111100100110101110110001011011111010110101111010,TUOZSMKNCFROMK-UKRRQHHQSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CCCC2)C3CC3)F)CC4,5378100AD0543BE0_24D40806684CBE8B_6041_UN,8.174625,00000000000000000001001000000000000000000010000000000000000000100010000000010001101001110011010010001000000110011001101011100000110001110110001010011011010110101111010,SFKGARYFWVYTMO-UHFFFAOYSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)C[C@H]4[C@@H](CCNC4)C5=CC=C(C=C5)F,F71D547B18360158_B4909AD7B9606AC1_6034_UN,8.667794,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011000110101100110101010000001011100100110110100110001001011011010111100111110,OWLZUVNAPIDTBX-SLNZLALYSA-N
N3CC[C@@H]([C@H](CNC(C=C2CC1CCC(N1C)C2)=O)C3)C4=CC=C(C=C4)F,0368F4FD4C0D173E_806CBD4151DB8085_6038_DP,8.246574,00000000000000000001000000000000000000000010000000100100000000100000000000011000101101110011110010111000110110110000111011100000110100100110001001011011011110101111110,HIMUCSDQHVTUND-VWEINGBSSA-N
CC(NC(=O)C1CC2CCC1O2)CC3=C[NH]C4=C3C=C(C(=C4)F)F,086E13D420D1D219_50B8F99FC1CCE8F4_6038_UN,7.7862864,00000000000000000000000000000000000000000010000000000000010000000100000000000000000100010111100011000100110100110001011011000100110110100100001011010011101111111111110,HUGHXOXLECULDX-UHFFFAOYSA-N
C(C1CC2CC1C3CC23)=CC4=C[N](C)N=C4C5=CC(=CC=C5)F,4C4EB65CE0D86207_3CE4F376868D6563_7019_UN,8.230313,00000000000000000001001000000000000000000010000000001000000000100100000000010000100100010000011010010000010100000000000011101100110000100100001011001010000010101111010,QGWSCOMKVPUWDB-UHFFFAOYSA-N
CC2=C(C=C1N=C(C(=CC1=C2)C)N[C@@H]4CCN(C3CC3)[C@H]4C5=CC(=C(C=C5)F)F)C,B974FE2496C277E0_32C032A646AADAEA_6041_UN,9.080238,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101010011000010101100110100010000001011100100110001110100011011011111010010101111010,MRRLSDYGXZNMGB-VWNXMTODSA-N
N1C4CCC1C(C=CC2=C[N](C)N=C2C3=CC(=CC=C3)F)C4,ADD7AABAC2231368_32009EF5C32C354A_7019_DP,8.185218,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010010011010010000110100010000001011101100110000100100001011011011000010101111010,DDQNKVGCRCDSIN-UHFFFAOYSA-N
CN3CCCC(CCOCC2COC1=CSC=C1O2)C3,650CA194E07B729C_717C33893BDE3219_6039_UN,8.073546,00000000000000000000000000000000000010000000000000000000010000000000000010010000000101101100010010101100010011010101101011100010110010000110000011111000110101111111110,UVTNWCMBPFKYJC-UHFFFAOYSA-N
CCCC(NC(=O)C1CC2CC1C3CC23)C4=CC(=C(C=C4)Cl)Cl,89E820AD3DDADA90_C1790C680116DA06_6038_UN,8.424641,00000000000000000001001000000000000000000000000000000000000000000000000000000000000000010011100010000001110100110011011000000000110000100000000011010011001110101111110,WFMSQIXREIJTLB-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)N[C@H]3[C@@H](C3)C4CCCCC4,A72D1F3192A65C6C_3BA1CFA92D8C0EF7_6041_UN,7.938731,00000000000000000000001000000000000000100010000000000000000000100100000000000100000000010011000000100100110100010000001001000100110001110100001011010111000010101111010,YVWIGWFRBQADBO-MAUKXSAKSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[C@@H]3CN[C@@H]4CCCC[C@H]34,8CA9BA6A9D88D5AA_238021F0D9199AEF_6041_DP,8.623274,00000000000000000000000000000000000000000010000000000100000000000100000000000001101100010011000010101100110110010000001011000100110101110110001011010011010110101111010,OKOFJOQTNHEIEC-ZMSDIMECSA-N
COC1=C(C=CC=C1)NC24CC3CC(C2)CC(C3(F)F)C4,31A8F6865DE4C378_6D5FC347F3A740BA_7022_UN,7.9492826,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010001010100000100110100011100000000000011100001110000000111000011100011101111110,ZJPBRIGKSQMMJM-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@H]3C[C@H]2CC[C@H](N2)C3)F)[N]4C=CC=C4,D4A30830B8BCDDB0_0192B8CF5F27CC21_6041_DP,8.124344,00000000000000000001000000000000000000000010000000000100000000100100000000010000100101010011000010100000110100010000001011100100110101110100001011011011000010101111010,MYVDMMIRPBATFR-FICVDOATSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)N[C@H]4[C@H]3CCCCCC[C@H]3C4,CF3A463C730328BE_DC6B426E4ED82884_6041_UN,7.808533,00000000000100000000000000000000000000100010000000000000000000000100000000000100000000010011000000100100110100010000001001000100110001110100001011010111000010101111010,FLSDIUFKKAXWLG-TXPKVOOTSA-N
O(CC2CCOC1(CCOCC1)C2)C[C@@H]3CNCC(O3)(C)C,678D3CDECCFAF241_361B5E7EA517B1C4_6039_DP,7.0731406,00000000000000000000000000000000000000000000000000000000010000000010000010100000001000100110000101101000010011001001001011000010110010000110100001110101110101111101110,UIDKZHPVOQDVEE-LOACHALJSA-N
CN(C)CC1=C(C=CC(=C1)NC3C2(CNC2)SCC3)F,C4EBE0481FA734CA_083A93804B6D1C40_7022_DP,7.360428,00000000100100000000000000000000000010000010000000000100000000000010000000100000111101111011010010001000110100011001001011100000110101110110001010011111010110101111010,UUVCXSLBKUQGTI-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CCC2NCCCCC2)C=CC(=C3)Br)C4,1BB7D1D1D6DAC8BC_514FD8694431688B_6034_UN,7.7752514,00000000000000000001000000000000000000000000001000000000000000000110000000110000101101010011000010001100110100011001101011100100110000100110001011011101010110101111010,RCEYCGZRMUTTMD-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC2(CCCC2)C3CCCO3)C=CC(=C4)Cl)C5,69E0E63A10D7A2A5_45093ADBF4C0C3BF_6034_UN,7.4090004,00000000000000000000000000000000000000000000000000000000010000100110000000010000100101110000010011101101010101011001101011100100110010100110001011011000110111101111110,CIXJLCMTINWENG-UHFFFAOYSA-N
CCC2OC1=C(C=C(C=C1C2=O)NC3C4CC(C3)C(C4)F)F,C78CAEDB1F513FB5_0CD9BDE493AE55D9_6041_UN,8.559,00000000000000000000000000000000000000000010000000000000010000000000000010000000000100010111000010000100110100010110000000000001110011110100000111000011101111111111110,OPWYJBKIZSPVGZ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C3(CC2)OCCC3)Cl)C4CC4,201EC86358A7F9F0_762FAF349EE372FE_7022_UN,7.5251603,00000000000100000000001000000000000000000000000000000000010000100010000000000000001100010011000011001001010111001000001000000000110011110110000010010011110111101111110,OEZOXVDRWRNMQT-UHFFFAOYSA-N
O(CC2(CC1CO1)CCOCC2)CCC3N(C)CCCC3,40861F03F4070B25_EF5C12B1530588A9_6039_UN,6.8883266,00000000000000001000001000000000000000000000000000000000010000000010000000010000000001100000010001101000000011011001101011100010110010000110000001111010110111111101110,RSENDKFSBKQNHV-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3C[C@H](C)O[C@@H](C3)C)C4=CCNCC4,E2FF5C3BF2B38AE4_F5A08C0F318902EE_6034_UN,8.83386,00000000000000000000000000000000000000000010000000100000010000100100000000011000001101110001000010111100110110010001001011100100110010100110001001011101110111101111110,JBENTTSTZKPYEK-XYPWUTKMSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC34CC(C)(CC3)CO4,27CD29318F133323_7741A1994300A5AA_6041_UN,7.560502,00000000000000000000000000000000000000000010000000000000010000000110000000000000101100010011000110101100010111001001101011000100110011110110001011010111110111101111110,AFSGPKFUVWUQMD-UHFFFAOYSA-N
N1CCC2(C1)NCCC3=C2[N](C=N3)CC5=CC(=C(N4CCN(C)CC4)C=C5)F,0D2ECAF662303D3A_552C4978E261A532_6034_DP,8.007447,00000000000000000000000000000000000000000010000000000110000000100110000000010101101101110011010010101100110100011001101011100100110101110110001011011011010110101111010,WFQKTEOXLDBZIN-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CCC3)C4=C(C=CC=N4)F,1F786D8F58C057CF_002899C53D5B7404_6041_UN,7.888125,00000000000100000000001000000000000000000010000000001000000000100110000000010001101100010011011010101000000100001000001011101100110001110100001010011011010110101111010,FKWWMNMYRSWXJR-UHFFFAOYSA-N
CN(C)C6CCN(C1=C(C4=C(N=C1C2=C[NH]C3=C2C=CC=C3)C=C(C=C4)Cl)C5COCC5)CC6,52EC7C8A8C7F4B6E_9607E22BFF1FFACF_2201_UN,8.437563,00000000000000000000000000000000000000000000000000000000010000100100000000110001100101110000010010101101010111010000101011100100110011110110001011011111010011101111110,KCKXNTNIKMXWCI-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2C(CC)CCCC2)F)CC3,B30B5085763DFDD5_1D3A3D55B377BA65_6041_UN,7.6841397,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010000001000000110010011101011100000110001110110001011011111010110101111010,OCKKMGLNSSXMFZ-UHFFFAOYSA-N
COCC[N]1C=CC2=C1C=C(C=C2)NCC3(CCCCC3)C4=CC5=C(C=C4)OCO5,2B0752A3936201F1_C2018936257A749F_6041_UN,7.637214,00000000000000000000000000001000000000000000000000000000010000100110000010010000101101100011010110001100010001011101101011110110110011010110001011111001110111111111110,PFOKATMUOFKIAC-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC34COC(C)(C3)CCC4,3E94B8F64F6F15AD_802A8BBC6785A9AF_6041_UN,7.8214173,00000000000000000001000000000000000000000010000000000000010000000110000000000000101100010011000011101100010111001001101011000100110011110110001011010111110111101111110,SFEVNGRXPQHTMQ-UHFFFAOYSA-N
CC6(C)CCC1=C(C5=C(N1C[C@]24CCC[C@H]2CN(CC3=CC=CC=C3)C4)C(=CC(=C5)F)F)C6,2DE81F66BC83366A_A9074F19180B43FD_6034_UN,8.016472,00000000000000000000000000000000000000000010000000000000000000000110000000110000100101110000000010001100010100011001101011100100110000100110001011011100010110101111010,HSNBHBWDIXMGCQ-KCWXNJEJSA-N
BrC2=C1N(C=CC(C1=CC=C2)=O)C[C@H]3[C@@H](CNC3)C4CCOCC4,24E8A5F3D27F4048_A0EA917C8DB8EFEE_6034_UN,8.590027,00000000000000000000000000000000000000000000001000000000010000100100000000010000101101110011000011101100010101000100001011100101110010100110001101011011111111110111110,APIBKJSWPQYETQ-HOCLYGCPSA-N
CN(C1CCCNCC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,65A69EAA54EBD91A_CE1215C3930E1610_6041_DP,8.415875,00000000000000000001001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010000101011100100110101110110001011011011010010101111010,ORRRCAWNVRCGJQ-DTLKIFBZSA-N
N1C2CCCC(C1)C2CNC(=O)C4=CC3=C(C=CC(=C3)F)OC4,5ABE38BD20B3A99D_ECDA2BFCB1BF20E7_6038_DP,7.710544,00000000000000000001000000000000000000000010000000100100010000000000000000001000101100010111100011111100110101110100011011000000110100100110001011010001111111110111110,ZPCXMSSXIPVFOL-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC23CCNC2CCCC3,9935CC9C69DDAA84_B5D501AEA040DD43_6041_DP,7.7455735,00000000000000000000100000000010000000000000000000000100000000000110000000100001101100100011010010101100110000011000001011000000110101010110011011011111010110101111010,LSKSGJSNUZGNFZ-UHFFFAOYSA-N
C(CN1CCOCC1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,A4F93AAAC668DD6B_DA18F9D4B5554AD4_7019_UN,8.193746,00000000000000000000000000000000000000000010000000000000010000000000000000010000000001110000010110111000000111010000101011100000110011110110001011011010010111101111110,JUGUPFBCOAALLY-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=CC3=C(N=C2)C=CC(=C3)Cl)C4,BD2907B939C803C2_66E4A3A438CB61FC_6035_UN,8.092932,00000000000000000000000000000000000000000000000000000000000000000100000000100000000001110000010111101101010100000101001001100111110000100100001101011110110111101111110,SJVRLBBPIPRNJJ-UJMSNXRHSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NC2=CC=C(C=C2)CC3=NN=C4CCCCC[N]34,BBA6CEED88A6798B_49068D6821688082_6041_UN,8.293806,00000000000000000001100000000010000010100000000000001000000000000100000000100101110101101000011010001100010000011000001011101100110001010100011010011111010110101111010,ZGYIWWCJEFJFOY-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=CC3=C(N=C2)C=CC(=C3)Br)C4,C51BF97A7FB71158_3FDFF0AFE82FE564_6035_UN,8.09292,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000010111101100010100000101001001100111110000100100001101011110110111101111110,OWNANJBTJAGDDV-UJMSNXRHSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=CC3=C(N=C2)C=CC(=C3)F)C4,B5B8372EA0ECE070_42AEA87FE1507510_6035_UN,8.092914,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010111101100010100000101001001100111110000100100001101011110110111101111110,VFOBGIBNHVUSAP-UJMSNXRHSA-N
FC1=C(C=C(C(=C1)C#N)F)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F,FAAD78E359A5FB7A_2E6648068D04835D_6041_DP,8.208137,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010100111010,MHGRGHQYAUOYFR-RDTXWAMCSA-N
CC1=C(C=C(C(=C1)NC[C@H]2[C@@]3(C2)C4=C(CCC3)C=CC=C4)Cl)C5CC5,867EA0E8E5442A13_EA7A2236698400E2_7022_UN,7.6888933,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010011000000001101010110001000001000000100110001110000000011010011010110101111010,QXBPONNVWRWYPG-FDDCHVKYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)N[C@H]4C6=C(OC5(C4)CCC5)C=CC(=C6)F,2C4BBCB246D8241E_DE77F464762D65AD_6041_DP,8.2344675,00000000000100000001000001000000000000100010000000000000010000000110000000000100100101010011010011100100111100011100101011100100110111110100001011011001100011101111110,RDKWTIYYRCVWFZ-AJYBTWMASA-N
C(CN1CC2CCC(C1)O2)=CC3=C[N](N=C3C)C4=C(C=CC=C4)F,91A72824E8CC3C9C_A5A1D51D5D45AB0F_7019_UN,8.246813,00000000000000000001000000000000000000000010000000001000010000100100000000010000100101110000001110111000010100000000001011101100110011110110001011011010110111101111110,VYZJTDWUXSDOOU-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NCC4(CCCC4)C5=C(C(=CC=C5)F)F,640F788373BFFD63_876F66EE5E7FE0C5_6041_DP,8.005481,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000010110001000001011100100110101110110001011011011010110101111010,ZYWFWIUOKLXBHK-YLQYIJTPSA-N
C2(=C1C=N[N](C1=CC=C2)C3CCCCO3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,3E76FDA49F6736A3_2011796520C34B7C_6041_UN,8.074072,00000000000000000000000000000000000000000010000000001000010000100100000000010001100101110011111110101100110111110001111011101100110011110110001001011011010011101111110,ABMWXBJYECFZSB-FQXDTITESA-N
FC1=C(C2=C(C=C1)C=CO2)N[CH]4C[C]3(C[C](C)(C3)C)C4,B29190CD70DD719B_59E7B93E899DAEE3_6041_UN,8.286741,00000000000100000000000000000000000000000010000000000000010000000010000000100000000100010001000110000100110110011001000000000100100001110100000010000111100010101111110,OAIRYYIXQZHVGD-UHFFFAOYSA-N
N1CC4CCC1C(CNC(=O)C3=CC2=C(C=CC(=C2)F)OC3)C4,2751752BDB386E71_F2D1C4F720ECB36A_6038_DP,7.894581,00000000000000000000000000000000000000000010000000100100010000000000000000001000101000010111100001111100110101110100011011000000110100100110001011010001111111110111110,HGIAOEWXNBCJGL-UHFFFAOYSA-N
O[C@@H](CCl)C1=CC=C(C=C1)NCC2N(C)CC3(CC2)CCC3,85C94C287B558572_58D154763640DA5A_6041_UN,8.23172,00000000000100000000000000000000000000000000000000000000000000000010000000010001001001100011010000101001110010011001101001100000110111110111001001011011110111101111110,ACJANYXWWKNYAN-DJNXLDHESA-N
CC5(C)CCC1=C(C4=C(N1CCC2CCCC3CC23)C(=CC(=C4)F)F)C5,5871864E5E495BA1_0B7AF49DD96849D5_6034_UN,8.14029,00000000000000000001001000000000000000000010000000000000000000000110000000110000000101010000000010001100010100011001101001100100110000100100000011011100010110101111010,PINHNLXKJDRCAR-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC[CH]3C[C]4(C3)C[CH2]C4,5DD629D883A797AA_914128B8E5016BFA_6041_UN,7.9240985,00000000000100000000000000000000000000000010000000001000000000000110000000010000101100010010011010001100010100001000001011101100110001110100001000011001010110101111010,NFHDDVNMIZATAX-UHFFFAOYSA-N
COC2=C1C=CC(=NC1=C(C=C2)F)NCC34CC(C(C)C)(C3)CO4,BFC88027C3B9B49F_FCFC9C8E1B2B088F_6041_UN,7.427927,00000000000100000000000000000000000000100010000000000000010000000110000000100100001100010011010111101100010101001100100011000111110011110110011101000101110111111111110,MWDZOHFCELKYIJ-UHFFFAOYSA-N
C2(=C1OCCOC1=CC(=C2)C#N)NC4=C3C=CC=NC3=C(C=C4)[N](=O)=O,83424AAF25D97903_909006AE7B14D435_6041_UN,7.6722193,00000000000000000000000010000000000000000100000001000000110000010100001110000001100000000001001101100110010001000100001111101100001011010110101011111001110011110111110,XMTVIXBSYUCPEH-UHFFFAOYSA-N
CC1=CC(=CC(=C1)F)NCC2CC3(C2)C4CCC(C3)C4,7BE0B2846C79D793_7626E5ABC98CCACB_6041_UN,7.5482454,00000000000100000000000000000000000000000010000000000000000000000010000000000000001000010010000010001000010100001000001000000000110001110000000001010001010110101111010,VJQXZWPWYZHLPJ-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,8D9C2DD351D2CEF5_53C80482EF65D0C5_6041_UN,7.725983,00000000000000000000000000000000000000000010000000000000000000000000000000000000100001110011010010001100010110010001101000100100110001110000001011011011010110101111010,WLTGRJJYRRILQB-UHFFFAOYSA-N
N1CCC4(CC1)OC5(COC2=C(C=CC=C2)CNC3=CC(=C(C=C3)F)Cl)CC4(N)C5,5B43314A47DBE0D8_F84C243F4F2AEB55_6035_DP,8.129232,00000000000100000000000000000000000000000010000000000000010000000010000010000000001110110011000111101001110101011100001011000111110111110110001111010011110111110111110,TWMYCXGPURBCCG-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)SC=C2)NCC3(C)CCC4(CC3)CC4,4AB23E0BDC14242A_B92122238E5EB34D_6041_UN,7.9466743,00000000000000000000001000000000000010000010000000000000000000000010000000000000011100011011000010001100010100001001101000000100110001110100000011010011010110101111010,LXWOYGCEGBVZOL-UHFFFAOYSA-N
C1(=NC3=C(C(=C1)N2CCOCC2)SC=C3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,C7A013B21A87BABA_75268EA358861AA2_6041_UN,8.818568,00000000000000000000000000000000000010100010000000000000010000100100000000010101110101111011010110101100110111010001101011100100110011110110001011011011010011101111110,DIEOAPNPONEFKP-UTKZUKDTSA-N
CC1=CC=C(C=C1)C2=NC(=C(Cl)[N]2C[C@@H]3C[C@H]3C4CCNC4)C#N,1E83CB2C481FE173_DC57779B481A399D_6034_DP,7.778908,00000000000000000000001000000000000000100100000000000000000000100100000000010101101101110011000010001001100100010000001011100100110000100110001010011011010110101111010,QPRBAMCTFHVPNR-YVZMLIKISA-N
N(CC1CC2CCC(C1)O2)C(C3=C(CC)[N](N=C3)C4=CC=C(C=C4)F)=O,BEDBB2CA72C7CF8E_16A16ABFAE6B9023_6038_UN,8.226526,00000000000000000001000000000000000000000010000000001000010000100100000000010000101100010011101011101000010100110010011011101100110011110100001011011011111111111111110,RDRQZXHGBNGLPM-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCCN3CC4CCCCC4,9B63067178B91924_953470CFBD922448_6041_UN,7.484645,00000000000000000000000000000000000000100010000000000000000000000100000000010101001101110011000010101100010110010000001011100100110001110110001011011111010110101111010,HIWHSSFMCOLCMT-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC34CCC(C)(CC3)OC4,7571BF93DB92765D_F8BE5DA47899A29B_7022_UN,7.8461604,00000000000000000000000000000000000000000010000000001000010000000110000000010000101100010011001011101000010101011001101011101100110011110110001011011011110111101111110,FLVWXUCHPSSSLM-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=CC=C2NC[C@H]3[C@@H](C3)C4CCOCC4)C,E15867FD2C8DE033_CD7CB7DA8825EE65_6041_UN,7.57294,00000000000000000000001000000000000000000000000000000100010000100100000000000000101100100011000010101100010001000000001011000100110111010110001011010111010111101111110,NOTJQKIMNUGLQT-HOTGVXAUSA-N
ClC2=C1C(=CN(C1=NC=C2)CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4)CC5=CC=CC=C5,84210CDC998BDB60_D5F02DFD9D2EB384_6034_UN,7.9193354,00000000000100000000000000000000000000100000000000000000000000000110000000110100000101010000000010101101010110011000101011100100110000100100001001011100010110101111010,CPZGWPJCUVGHES-CEWLAPEOSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=CC=C(C=C2)C3=NN=C4CCCC[N]34,52EAE8048BF9136C_20B99E3BF4D0A8DF_6041_UN,8.258416,00000000000000000000100000000010000000100000000000001000000000100100000000100101100101100000011010101100010000011000001011101100110001010100011011011111010010101111010,RBGYHVBLYXLJAB-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3(C)CNCC3)Cl,8CAF94AFA3F05AC0_C334098B8B2A265C_6034_UN,8.012101,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101111011000010001001101110011001101111100100110101110110001010011111010110101111010,DVROAIKGPKAARM-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC5COC4=C(C=C(C=C4F)F)C5,5192C6F046DC9710_FC0C043B307D2E9C_6041_DP,8.418993,00000000000000000001000000000000000000100010000000000000010000000100000000000101100101010011010110100100110101010100101011100100110101110100001011011001110011101111110,GZWBRNZPYXZOFY-VSDYLMMWSA-N
BrC1=CC(=CN=C1)C2=NC=CN2CC4[C@@H]3C[C@@H](C3(C)C)CC4,D3918CBF5A0E0D4C_E1B0B1B4661F0B36_6034_UN,8.347811,00000000000100000000000000000000000000100000001000000000000000100110000000110101100101010000000010101000010110001000101011100100110000100100001011011110010110101111010,SNQZBOVNKQFYRH-DBQWNMKUSA-N
FC1=CC2=C(C=C1)C=CC(=N2)NCC3N(C)CC4(CC3)CCC4,2D46FC1AE040531A_427E63637A779BCC_6041_UN,7.9664135,00000000000100000000000000000000000000100010000000000000000000000110000000010101001001110011010000101100010110011001101011100100110001110110001001011011010110101111010,BXSZSMJEMINYSD-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC3CCCN(CC2CC2)C3)F)[N]4C=CC=C4,C07FBEBA5E1A4688_0B1DBF1AB066595A_6041_UN,8.069906,00000000000000000000001000000000000000000010000000000000000000100100000000010000101101110011000010101000000100010000001011100100110001110110001011011011010110101111010,FYGCMQRQRQDYNK-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=CC(=CC=C2)C4=C[N]3CCCCC3=N4,DD986FEF775D828B_79064AE24B7F3365_6041_UN,7.9880104,00000000000000000000100000000010000000100000000000000000000000100100000000100101000101100000010010101100010000011000001011100100110001010100011011011111010010101111010,MATQXQPBZWVIDH-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC3CCCC2(CNC2)O3)F,E15EBA565A14EED7_896D3687B9BB35CC_7022_DP,7.558419,00000000100100000000000000000000000000000010000000000000010000000010000000100000001001110011010100101000010100001001001011100000110111110110001011011111110111101111110,XAQSPBGQLLGLCZ-UHFFFAOYSA-N
O(C(=O)C1=CC2=C(C=C1)C3CCC2O3)CC4=C(C=NC=C4F)F,4B1FB9E226C2CAA8_52D75729E257F676_6031_UN,8.390477,00000000000000000000000000000000000000000010000000000000010000000100000000000000000100010000000010100100010101000000001011010110000010100100000011110010111101010111110,AADKWXMHQGLYAJ-UHFFFAOYSA-N
CC1=C(C4=C(N1CC3CCCN(CC2=CC=C(C=C2)I)C3)C=CC=C4)C5=CCNCC5,5C5DC75BD5C9EB07_FB80FF28DAA540F7_6034_UN,8.628873,00000000000000000000000000010000000000000000000000100000000000100100000000011000101101110001000010111100110110010000101011100100110000100110001011011011010110101111010,CZLHTZAXVSSJQP-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4(CCCC4)C5=C(C=C(C=C5)F)F,65F2B5B7DD07A223_0677FACE4DA0462E_6041_DP,8.202178,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010010101111010,NDPHCJUGGAYVIX-DBIVSCPCSA-N
CC1=C(C=C(C(=C1)NCC2CC3=C(CCC2)C=CC=C3)Cl)C4CC4,3BA30FFFB3B1A61F_374337B66B021092_7022_UN,7.6390724,00000000000000000001001000000000000000000000000000000000000000100000000000000000001000010011000000001101010110000000001000000100110001110000000011010011010110101111010,OXGCWEZQGVAMJX-UHFFFAOYSA-N
C2(=CC1=C(C=C(C=C1)F)O2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,D20998DD6D7643D6_E9588C5620FDF21D_7022_UN,8.5613785,00000000000000000000001000000000000000000010000000000000010000100100000000010101101101010011110010101100010100110000011011100100110001110110001011011011110110101111110,BMTVFQMSLYTIEM-VFNWGFHPSA-N
C2(=CC1=C(C=C(C=C1)Cl)O2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,D6872F42D9A9B132_FAF4FD94928B8C7C_7022_UN,8.561363,00000000000000000000001000000000000000000000000000000000010000100100000000010101101101010011110010101101010100110000011011100100110001110110001011011011110110101111110,ZUUQNJWFFIYBPM-VFNWGFHPSA-N
C2(=C1C=C[NH]C1=NC(=N2)C3CC3)NCCC4=CC=C([Si](C)(C)C)C=C4,C1527B1D382662BE_539DFAF36B312691_6041_UN,7.5543284,00000000000000000000101000000010000000100000000000000100000000100100000000100100101100100000010010101100110000011000001011000100000101010100011001011101010110101111010,HDYXGKWPFVFFBK-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)N=CC=C2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,AAB0E2C1422C5957_13D3A13083CF3407_7022_UN,8.00284,00000000000000000000000000000000000000000000000000000000000000100100000000010000101001110011010000101101010110010001101011100100110001110110001011011111010110101111010,LZFBXOXIYMMTES-UHFFFAOYSA-N
CC1=NC4=C(C(=C1)NC3C[C@H]2CCC[C@H](N2C)C3)C=C(F)C=C4,E33F20789560A0A2_28B72812C1F4A6EA_6041_UN,8.0348835,00000000000000000000000000000000000000000010000000000000000000000100000000010000100001010001010000100100110110010000101011100100110001110100001001011101000010101111010,VFOAVTWYARHHOJ-MQVJKMGUSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(C)CCC4(CC3)CC4,8591D642AD64A869_0E298CB83E743694_6041_UN,7.414862,00000000000000000000001000000000000000100000000000000000000000100110000000010100101101100011010010101000010010011001101011100000110001010110001011011111010110101111010,BUHUGZSXEGHWPC-KRWDZBQOSA-N
FC2=C(C=C1OC=CC1=C2)NCC3CCCC(CC)CC3,B4C9AC9F367B42ED_FF42472E043A4FD5_6041_UN,8.149054,00000000000000000001000000000000000000000010000000000000010000000000000000000000001100010011000011001100010110000010101000000100110001110100000010010011110110101111110,GXOVTFOTQZTDSO-UHFFFAOYSA-N
O(C2C1CCOC1C23CCCC3)C4=C(C=C(C(CC)(C)C)C=C4)Cl,4E5F50B313D2F091_EBC659E18C5E1A9F_6035_UN,7.675536,00000000000100000001000000000000000000000000000000000000010000000010000000100000000100010100000010000001010101001111001000000011110010100100010110010110110101011011110,OUHDQKHFLBLQLS-UHFFFAOYSA-N
CC[C@@H](OC1=CC(=C(C=C1)CN2CCCC2)Cl)C3CCOC3,816853712376F775_DEF3AE7C03C22305_6035_UN,7.9727526,00000000000000000000000000000000000000000000000000000000010000000000000000010000000101110100000010001001000111010110001011100011110010100110000110011010110101111111110,VDEZDOGJSXXBOV-KPMSDPLLSA-N
CC2=C1N=CC=C(C1=C(C=C2)NCC[C@@H]3CC[C@H]4C[C@@H]3C4(C)C)F,BE04CFF9AD986C0D_44489ACCB969F9DF_6041_UN,8.008005,00000000000100000000000000000000000000000010000000000000000000000110000000100000101000010001000000101100110110011000101001000100110001110100011001010101010110101111010,HFWHZJXPPBVFFD-JYJNAYRXSA-N
FC1=C(C2=C(C=C1)SC=C2)NCC3CCCCN(C)C3,5656F18E680D85D0_EAE57D0B3694B233_6041_UN,8.233083,00000000000000000001000000000000000010000010000000000000000000000000000000010000111101111011010010001100010110010001101011100100110001110110001010011011010110101111010,IKQYODHIECCVNU-UHFFFAOYSA-N
C1(=CC(=CC=C1)C(F)F)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,D5E0908275DFD933_C7C9079B06B98F5F_7022_DP,7.935866,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101100011010010001000000110000000000011100100110101110110001010001011010110101111010,CBNUSQZJOLZMGN-GXTWGEPZSA-N
C([C@]12C[C@H]1COC23CCC3)=CC4=C[N](N=C4C)C5=CC(=CC=C5)F,5007616A16A9C8D2_2CC6F0CE0E1EE9A9_7019_UN,8.268401,00000000000100000000001000000000000000000010000000001000010000100110000000010000100100010000001010110000010101001000001011101100110011110100001011011010110011101111110,SACBXEGKGLUONQ-LPHOPBHVSA-N
ClCC2=NC1=C(C=CC(=C1)Br)N2C[C@H]3[C@H](CC(C)(C)C)CNC3,8B750D21910CE6EA_9184C91AFABB0B92_6034_UN,8.477295,00000000000000000000000000000000000000100000001000000000000000000110000000110101101101110011000010001101010110011001000011100100110000100110011010001111010110101111010,SWVLPTLYPOVJLS-OLZOCXBDSA-N
ClCC2=NC1=C(C=CC(=C1)Cl)N2C[C@H]3[C@H](CC(C)(C)C)CNC3,DE4A38542EC4831A_6E96C0D55767C5BF_6034_UN,8.477301,00000000000000000000000000000000000000100000000000000000000000000110000000110101101101110011000010001101010110011001000011100100110000100110011010001111010110101111010,AKYISPRKYBNTLF-OLZOCXBDSA-N
CC1=C(C=C(C(=C1)NC23COC(C)(CC2)C3)Cl)C4CC4,6FE3765233218179_74056E1530CBE9A2_7022_UN,7.0114737,00000000000000000000001000000000000000000000000000000000010000100010000000000000000100010011000111100001110111011001101000000000110011110100000011010111110011101111110,JQAFYEGDORTUCH-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[NH]C3=C2CCCC3)NCC4(CN(C)C)CCCC4,2689FF268B71DD1F_DF5C701B69F8B457_6041_UN,7.0989833,00000000000000000000000000000000000000000000000000000000000000000110000000100000101101100011010010001100110010011001001001100100110101010110001011011101010110101111010,ABCQJTOBBYFTCE-UHFFFAOYSA-N
C1(=CC(=C(C=C1)Cl)Cl)NCC2N(C)CC3(CC2)CCC3,E4F2C884AD0D21BF_FAF4255EB14B4DDE_7022_UN,8.230619,00000000000100000000000000000000000000000000000000000000000000000010000000010001001001110011010000101001010110011001101001100000110001110110001011011011010110101111010,LZKPBOLGZCHUMC-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC3CCCC(CC)CC3,A612E791947BB148_7105D082935B2707_6041_UN,8.115507,00000000000000000001000000000000000000000010000000000000000000000100000000000000101000010011000000101100010110000010101001000100110001110100001011010111010110101111010,OOJREVARVBGWRS-UHFFFAOYSA-N
C1(=CC(=C(C=C1)F)F)NCC2N(C)CC3(CC2)CCC3,8D0ED898481C6FDE_D77009624F1B304A_7022_UN,8.230606,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011011010110101111010,QFHUNXUMFAMDMW-UHFFFAOYSA-N
C1(=CC(=C(C=C1)F)Cl)NCC2N(C)CC3(CC2)CCC3,CFABC8B154B7E286_D2DA4E3641B29367_7022_UN,8.230587,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010000101001010110011001101001100000110001110110001011011011010110101111010,AZCUOGPSZOEAOF-UHFFFAOYSA-N
C1(=CC(=C(C=C1)Cl)F)NCC2N(C)CC3(CC2)CCC3,9329889E11669755_8591EF61FF1BE4B4_7022_UN,8.230587,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010000101001010110011001101001100000110001110110001011011011010110101111010,YBSPHBMIHCGCEP-UHFFFAOYSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC3=C4C(=CC=C3)CNCC4,F5268DDE1258E218_AF89B6F2434B8625_6035_UN,8.138878,00000000000000000000001000000000000000000010000000000000000000100010000000000000001010110011000001101100110101011100001001000111110100100110001111010011110101100111110,YQUCGTMCPAKWKB-UHFFFAOYSA-N
C(C1(CCC1)C2CCCCO2)=CC3=C([N](C)C4=C3C=CC=C4)Cl,118002A5F09CBBA0_663DCD0C38BED871_7019_UN,8.373214,00000000000100000000000000000000000000000000000000000000010000100110000000010000000101010000010010110101010101001000001011100100110010100100000011011010110011101111110,QMBLXKIXGBEHJH-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CC4(C3)CCOCC4,4BF94B163E1FDB22_5C4B336120B03DF6_6041_UN,7.625535,00000000000100000000000000000000000000000010000000001000010000000110000000010000101100110010011010101100010101001000001011101100110011110110001001011001010111101111110,XKWQVBBBRIZANT-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)N[C@H]3[C@@H](OCC3)C4=CC=N[N]4CC5CC5,027511E994423B7B_B5303E760FE493E9_6041_UN,8.343677,00000000000000000000001000000000000000000010000000001000010000100100000000010001100100010011001111101100110101010000001011101100010011110110001011011011110111101111110,RFCNRLBEBWHQJU-DYESRHJHSA-N
CCN1C(CC2=C1C=C(C=C2)F)C3=NC=CN3CC4CN(CC(C)(C)O4)CC5=CC=CC=C5,1BAB5AF2A32CE332_CE988FAB5308A545_6034_UN,8.63236,00000000000000000000000000000000000000100010000000000000010000100110000000110101100101110000000110101100010110011011000011100100110010110110011011001110110111101111110,IFCSMFXDLPRLNC-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C(C)(C)C3=C(C(=CC=C3)Cl)F)=O,122BC7D32A760A5D_5CAEF6E91B108B2D_6038_UN,8.138413,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010001100010001001110110111000011000000000110010100100000011010111111111111111110,OKHFOBIMAJROOV-UHFFFAOYSA-N
CN(C)CC(OC2=CC=C(CC1CCCNC1)C=C2)C3=CC(=C(C(=C3)F)F)F,801FAF30D1ECF119_DC272BBBAA1B598B_6035_DP,8.100147,00000000000000000000000000000000000000000010000000000000000000000000000000100000001001110011010100101000100100010101001001100111110010100110001111011111110101101111110,JJVCKJQYBAXZPP-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3=CC=C(C=C3)C46CC5CC(CC(C4)C5)C6,C38E60BE74485CE2_796887B9D1ED8237_6041_UN,8.058997,00000000000000000000000001000000000000000010000000000000000000100110000000010101000101010000010010000100011100001000000011100100100001110100001011001011000010101111010,LNNHIQVYJOLORI-UHFFFAOYSA-N
N1C4CCC1C(CNC(=O)CC2=C[NH]C3=C2C=CC(=C3)F)C4,3F8388FED03C22B9_7EF72961FA2BAC4D_6038_DP,7.8714795,00000000000000000000000000000000000000000010000000000100000000000100000000000000101100010011100010001100110100110000011011000100110110100100001001010001011110100111110,GZEBEKRLWMLTFR-UHFFFAOYSA-N
BrC1=CC2=C(N=C1)[N](C=C2CC3=CC=CC=C3)C[C@@H]4CNCC(O4)(C)C,6048944A184B877A_765964E36F35FA3B_6034_DP,8.017464,00000000000000000000000000000000000000100000001000000000010000000110000000110100101101110010000110101100010110001001000011100100100010100110001001001101110111101111110,CAISQFWNTOXOLE-SFHVURJKSA-N
C(C1CCCC12CCOCC2)=CC3=C[N](C)N=C3C4=C(C=CC=C4)Cl,C3B589AB093D16BE_FF1945DF0F44D352_7019_UN,7.604663,00000000000000000000000000000000000000000000000000001000010000100110000000010000100100110000011010110001010101001000001011101100110010100110001011011010010011101111110,ZMPCUKRVUCMJKW-UHFFFAOYSA-N
BrC2=C1N(C=CC1=CC=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,5CFC09992E2D622B_7CF3D61AC9A58AF4_6034_UN,8.44297,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,ROIJPAIIYKPTCH-IERDGZPVSA-N
ClC2=C1N(C=CC1=CC=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,060D284AFC27E1D2_05F53BD782BC4DAE_6034_UN,8.442958,00000000000000000000001000000000000000000000000000000000000000100100000000010101100101010000010010101101010100010000001011100100110001100110001011011010010110101111010,AREIWXMAZZBVNV-IERDGZPVSA-N
C[N]1C=C(C(=N1)C2CC2)NC4(CC3=C(C)C=C(C=C3)F)CC4,3B1B6D3B12B69E25_6B7FAF0A6EF56BEA_6041_UN,7.955818,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000101011101100010001110100001010011111000110101111010,XKVNVSJTSOFKKT-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=NC=C2)NCC3CCCCN(C)C3,CBDB62E0150384B3_1687ACF16951FCB2_6041_UN,8.553857,00000000000000000001000000000000000000000010000000000000000000000100000000010000101001110011010000101100010110010001101011100100110001110110001011011011010110101111010,VJKAWPLTAPTQGT-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC2=CC=N[N]2CC3CCCCC3,DD335E2B903762E1_FAF51335713AA598_7022_UN,7.491866,00000000000000000000100000000010000000100000000000001000000000000100000000110101100100100010011010001000000000011000001011101100110001010100011011011111010110101111010,KYEBZJXROHVXNR-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C4=C(C3=CC=CC(=C3[NH]4)CC)F)=O,15D9EACA16688D9B_5120C26BA43BB2AC_6038_UN,8.056095,00000000000000000000000000000000000000000010000000000010010000000100000000000001001100010011100110001100110100110010011011000100110110100100001011010011111111111111110,UJFQESNXWPEWMT-UHFFFAOYSA-N
CC(C)(C)C2=CC1=C(C=CC(=C1)F)[N]2CCC3SCCNC3,81B5FDA600999996_716D62DDF881AB37_6034_DP,7.908078,00000000000000000000000000000000000010000010000000000000000000000110000000110000011101111011000010101100110110011000001011100100110000100110011011011111010110101111010,AXBBCCJMCYUYDL-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=CC=C2)NCC4(C)CCOC3(CCC3)C4,E6EC5276E0354538_89D42C50FE5123EC_6041_UN,7.739842,00000000000100000000000000000000000000000000000000000110010000000110000000000001101100000011000010101100010011001001101011000100110111010110001011010111110111101111110,VUSVPCKXVWYQKT-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CCC3(CC2)CC3)F,0F44BA15CB64B3A3_24414B848A272DC3_7022_UN,7.443872,00000000000000000000001000000000000000000010000000000000000000000010000000100000001001110011010000001000010100001001001000100000110001110010001011011111010110101111010,IUWOTNWIIKGQHM-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=NC=C(C=C1)NCC3=C2CCCCC2=CC=N3,9533D4FD7F96C84C_5853CA3CD14E4249_6041_UN,8.106218,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100001010000101100010000011000001011000100110001010100011011011101010110101111010,UANJYZPTHQXIFE-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=C(C=C2)NCC3CCN(C)C3C4=CC(=C(C=C4)Cl)F,DC750977067AE3AB_B3D943104A3C89D3_7022_UN,8.171728,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101101010110010001101011100100110001110110001011011111010110101111010,VBEFSLGKEDJYGA-UHFFFAOYSA-N
C(C1=CC=CC2=NON=C12)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,371F971EE6DB6242_8634DC4CDE2BC600_7019_UN,8.368929,00000000000000000000000000000000000000000010000000000000010000000100000100000101000101010000011011010110010110010000101011101100011001110100001011011010000010101111110,TWDMPLRHHGTLBI-UHFFFAOYSA-N
NCC(OC1=C(C=C2C(=C1)CNCC2)F)CCC3CC3,11373A1DF5B5FB0D_E227EB5794601990_6035_UN,8.406206,00000000000000000000001000000000000000000010000000000000000000000000000000000000001010110011000100101100110100010100001001000011110110100110001111010011110101100111110,GEXLXSRNYNTRGO-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(C)C=CCCC3,B2783BD27A30FC7C_AE0E487338A8E732_6041_UN,8.067364,00000000000000000000000000000000000000100000000000000000000000000110000000000100001000000011000000111100010010001001101001000100110001010100011011010111010110101111010,QWNRMWWMZWMYSJ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CSCCN3CC4=CC=CC=C4,71784DF09A88853A_079061E41D435511_6041_UN,8.290951,00000000000000000000000000000000000010100010000000000000000000000100000000010101001001111011000000101100010110010000001011100100110001110110001011011111010110101111010,REEFGDBVPORENP-UHFFFAOYSA-N
CC(C)(C#N)C1=C(C(=CC=C1)NCC2CCC23CNC3)F,659CB6295415F783_A6F4A7654E610DC8_6041_DP,7.8746047,00000000100100000000000000000000000000000110000000000000000000000010000000100000001000110011000000001000010100001000001001000000110101110110001010010111010110101111010,HLYVQDGYZRZLAW-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCCC2C(C)(CCCO2)C)F)CC3,76CB8212BB8274D0_AE3E499C62823FAF_6041_UN,7.71432,00000000000000000001000000000000000000000010000000000000010000000010000000110001101001110000010001101000100111011001101011100000110011110110011011011111110111101111110,RUDMGCCSEMGXGM-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2=CON=C2C3CCNCC3)F)CC4,56DE80FB3C04A017_217F5314701D96D1_6041_DP,7.918192,00000000000000000001000000000000000000000010000000000000010000100100000100010001101101110001011111101010100110010001101011101100110101110110001011011011010110101111110,VZJYJYLPZDBYLB-UHFFFAOYSA-N
N3CCCC(CC=CC1=C(Cl)[N](C(=N1)N(C)C)C2=CC=C(C=C2)F)C3,C40F0E05523A7503_84CBDF4788794308_7019_DP,7.5425515,00000000000000000000000001000000000000000010000000000000000000100100000000110101001101110011010010111001101100010000001011100100110001110110001011011111010110101111010,DCEMYENJVUPTBU-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(C4=C(C3=CN=C[N]3C)C=C(C=C4)F)=O,E227DB6DAC634DF6_070CAABC8A8F3A6D_6038_UN,8.0909195,00000000000000000001000000000000000000000010000000000000010000100100000000010101001101010010110010101000010100100000011011100100110010100100001011011011111111111111110,JIEVCZGPUDSJHN-UHFFFAOYSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)NC(CC)C4CC4C)F,753DF17A7EDB242A_F60D8A32D13C2FD3_6041_UN,7.9456253,00000000000000000000001000000000000000000010000000000000000000000100000000000000100000010011000000100100110110010011101001000100110001110100011011010111000110101111010,RHJPOCZCLUVVCE-UHFFFAOYSA-N
N(C1=C(C=CC=C1)N2CC3CCC2C3)C(=O)[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)Cl)F,2DF08AAF98C5014B_3371B3B2C72612ED_6038_UN,7.512931,00000000000000000000000000000000000000000010000000000000010000100000000000010001000101010111100011101001010101110000011011100100110011110110001011011011111011110111110,FNYTWXKWBCZNQL-SJGGKYOUSA-N
CC1=C(C=C(C=C1)F)NCC2(CCCCC2)OC3CCCC3,29204C166078BCA7_4058BFBE40475E12_7022_UN,8.068478,00000000000000000000000000000000000000000010000000000000000000000010000000000000001000010011000110001000000110001000001000000011110011110000000111010011110111101111110,RTZUXGUIYIGSAR-UHFFFAOYSA-N
N(C1=C(C=CC=C1)N2CC3CCC2C3)C(=O)[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)F)F,C411DF8787575E86_50E45290C2C3EB68_6038_UN,7.512924,00000000000000000000000000000000000000000010000000000000010000100000000000010001000101010111100011101000010101110000011011100100110011110110001011011011111011110111110,YLPBMXYYSAXJKR-SJGGKYOUSA-N
CC1=C(C=C(C=C1)Cl)NCC2(CCCCC2)OC3CCCC3,E6D46E7CC1B32B3D_AC5B525442F56120_7022_UN,8.068467,00000000000000000000000000000000000000000000000000000000000000000010000000000000001000010011000110001001000110001000001000000011110011110000000111010011110111101111110,OAGJPYVPWDEXNT-UHFFFAOYSA-N
C(C1CC2CCC1CC2)=CC4=CC=C(C3=C(C)C(=CC=C3)F)O4,19626C3D56D268AC_F7ADA70F1C6CD0C7_7019_UN,8.311535,00000000000000000000000000000000000000000010000000000000010000100000000000000000000100010000000010010000010100000000001000000100110000100100000011010010100000001011110,ZDNWDARBEONLKX-UHFFFAOYSA-N
O[C@@H](CCl)C1=CC(=CC=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,39F3E9D494739A74_BF9BE440684F9CB0_6041_UN,9.029624,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101100001011110101001100011010001101011101100110111110111001001011111110111111111110,ITWIFTUMVPZBKJ-BZSNNMDCSA-N
O[C@@H](CF)C1=CC(=CC=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,AE23AD7DA01EBFC5_347552D0E4B58C3D_6041_UN,9.02962,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101100001011110101000100011010001101011101100110111110111001001011111110111111111110,AKUDSTSMYSKMGQ-BZSNNMDCSA-N
N(CC23CC(CC1=CC=CC=C1)(C2)CO3)[S](C4=CC5=C(C=C4)[NH]C(=N5)CCl)(=O)=O,AD9907190A16F810_79EF65CCB37491E0_6029_UN,7.770498,00000000000100000000000000000000110000100000000000010001011111001111010001000101011100001011001110001111111001011000010011001100111110101110001001101001110111110111110,BHOIRDDOXXPKRV-UHFFFAOYSA-N
CC1(C)[C@@H]4C[C@H]1C2(CC2)C5=NC3=C(C=CC(=C3)Cl)C(=C45)C6=CC=C(C=C6)F,3548E7607397A944_6C371C31C43D902B_2201_UN,7.525608,00000000000100000000001000000000000000000010000000000000000000100110000000100000000000010000000000100101010110001000100001000100110000100100000011010100000010001111010,WCLPGIQMPGRHAY-IEBWSBKVSA-N
FC1=CC4=C(C(=C1)C=CC3=C2CSCCC2=N[N]3C)OC(OC4)C5=CSC=C5,914C9F8A3A7A1D52_50AD0C839B3CEB86_7019_UN,8.346924,00000000000000000000000000000000000010000010000000001000010000100100000000010000100100111100011010110100010111010100001011111100110000100110001011011010110011111111110,RJYFBNLIWDNAES-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NCC4=C5C(=CC(=C4)F)COCO5,4C7E547F90DD9A5C_C71738CB3AF33673_6041_DP,8.412425,00000000000000000001000001001000000000100010000000000000010000000100000000000100101101110111010011101100111101010100101011110100110101110110001011011001110111111111110,YNVCONWSDIDAIU-BCDXTJNWSA-N
CCC1=C(C=CC(=C1)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,8CDF644B131C298A_1BF433CC8652B2CC_6041_UN,7.98225,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010010001011100100110001110110001011011111010110101111010,MGLSMDHFXXXHHU-IERDGZPVSA-N
CCC1=NC(=C[N]1CC2CC2)NC4(CC3=C(C=CC=C3F)F)CCCC4,D76CD1955A0378A9_1524A336499FFF22_6041_UN,8.125327,00000000000000000000001000000000000000100010000000000000000000000110000000010101100101010011000010001000100110011010001011100100110001110100001010011011010110101111010,MTXUJFHFJYKALB-UHFFFAOYSA-N
C[N]1N=C(C=C1N[C@@H](CC)C2=CC(=C(C=C2)C)F)C3CCCC3,CB608EE374C5C3AB_034AA2689F8A7A3C_6041_UN,8.485224,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010000011010000000100100010010001011101100010001110100011010011111000110101111010,HWROOINLERXHTP-KRWDZBQOSA-N
FC1=CC4=C(C(=C1)NC2CCN(C)C3CCCC23)OC=C4,BC7B48F974B1C63D_8D4678B6D5AD88B0_6041_UN,8.667309,00000000000000000000000000000000000000000010000000000000010000000000000000010000100101110011010110101100110110010001101011100100110001110100001001011001110010101111110,UWNCWXGFBROORJ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3C(C3)C4CCCC4,A3BC1F3B38D4BC22_3803DF1816CC968C_6041_UN,7.8736033,00000000000000000000001000000000000000100000000000000000000000100100000000000100001000000011000010101100010010000000001001000100110001010100011011010111010110101111010,XQJJOKBLFVRESK-UHFFFAOYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC(C4=NC=C[N]4C)C5=C(C=C(C=C5)F)F,C6DDCE06874D751B_274D0CC6EB9DC62D_6041_DP,8.094265,00000000000000000000000000000000000000100010000000000000000000100100000000010101100101010011010010100000110100010000001011100100010101110100001011011011000010101111010,PGFIQGRNRNHEID-XWRAKQQISA-N
C1(=CC=C(S1)C2(CCC2)C#N)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,91B50B616F87200C_BEAF6FE46B2DCF34_6041_DP,7.2883315,00000000000100000000000000000000000010000110000100000100000000100010000000000000111100111011000010101000100100011000001011000100110101110110001001010011010110100111010,HQBTWDCOJRTCIO-FUHWJXTLSA-N
CC(C)C2=C1N=C(C=C(C1=CC=C2)C)NCC34CC(CC)(C3)CO4,66D0291778B08CFD_B34D6C7FB6928BBA_6041_UN,8.016833,00000000000100000000000000000000000000100000000000000000010000000110000000100100001100000011000110101100010001001010100011000100110011010110011001000101110111101111110,GFNKRCMGLSFQQM-UHFFFAOYSA-N
ClC1=C(C2=C(C=C1)C=CN2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5)Br,E0035EEBAB933A45_985CCE551EF1D8C2_6034_UN,8.564934,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101101010100010000001011100100110001100110001011011010010110101111010,UTCGNMCJCJTMDB-QRWLVFNGSA-N
FC1=C(C2=C(C=C1)C=CN2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5)F,3FA86900794BEDFF_0A457CE61BD70D66_6034_UN,8.564926,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,LCDQHKGAUJFWKT-QRWLVFNGSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)N[C@H]4[C@@H](C4)C5=C(C(=CC=C5)F)F,E6E5F6FD60E1411A_3C398E91705A4CD6_6041_DP,8.104915,00000000000000000001001000000000000000100010000000000000000000100100000000000101100101010011010010100000110100010000101011100100110101110100001011011011000010101111010,SHEZRORLRBZZSW-OOVXDXFJSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC4CC3=C(C=N[N]3C)CC4,66D9DA59683882A7_73D124A70269ADF9_6041_UN,8.03368,00000000000000000000000000000000000000000010000000001000010000100100000010010000100100010010011010000100110111010000101011111100110011110110001011011011010011111111110,XWOYNDNSBZZANN-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C3=C(C)C4=C([NH]3)C=C(C=C4)F)=O,C4C18C4172CF8849_95EC2FE3ECB999F1_6038_UN,7.9211407,00000000000000000000000000000000000000000010000000000010010000000100000000000001001100010001100110001100110100110000011011000100110110100100001011010011111111111111110,ZQSAZYZIKUPXIW-UHFFFAOYSA-N
C1(=C(C=CC(=C1)F)OC(F)F)NCC2COCCN2C,995D36D92D276327_5D0052DC66D62915_7022_UN,7.613345,00000000000000000000000000000000000000000010000000000000010000000000000000010001001001110011010101101000001101010101101011100011110011110110001111011011110111111111110,HFCBJVFATFJYFD-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC3CC2(CCN2)C3)F,2CEE863A905C1C27_C537829E9A62B43A_7022_DP,7.4324856,00000000100100000000000000000000000000000010000000000000000000000010000000100000001001110011010000001000110100011001001001100000110101110110001010011111010110101111010,MMMJJAFTXWFTEB-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC(COC)C2CCCOC2)Cl)C3CC3,3A9A1734AE7507EE_BCD7AAA173DF4409_7022_UN,7.071419,00000000000000000000001000000000000000000000000000000000010000100000000000000000000000110011010101100001100111010001001000000010110011110110000011010111010111111111110,LGHMMONECNFENK-UHFFFAOYSA-N
COC1=CC2=C(C=C1)N(C=C2C3=CCNCC3)CC4(N)CC=CC4,5D1558DB127E6BE2_F8BBB56D84FFE7E4_6034_UN,8.440237,00000000000000000000000000000000000000000000000000100000000000100110000000011001001111100001010010111100110000011100001011100111110101000110001101011001110111101111110,GMKAEWQBBKFFBS-UHFFFAOYSA-N
FC2=C(C(=C1[NH]C=CC1=C2)F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,0D740353759DBA34_E62188FBB50FE69F_6041_UN,8.805995,00000000000000000000001000000000000000000010000000000100000000100100000000010101101101010011010010101100010100010000001011100100110101110110001011011011010110101111010,JOJCCECWDCCFEW-SZNDQCEHSA-N
FC1=C(C(=CC=C1)NCC2(C)C(OCC2)C3CC3)C4CC4,0FB6353036B7EFB6_9032C8D5B39AE7FA_6041_UN,7.970399,00000000000000000000001000000000000000000010000000000000010000100010000000000000001100010011000011001000000111001001101000000000110011110110000010010011110111101111110,TUIWZXHSSFRSEN-UHFFFAOYSA-N
CN4CCC1=C(C3=C(N1CC2CCCCC2(C)C)C=CC(=C3)Cl)C4,8B3626DD5F524722_D2846FEB7081BBD4_6034_UN,7.66541,00000000000000000000000000000000000000000000000000000000000000000110000000110000100101110000010010101101010110011001101011100100110000100110011011011110010110101111010,HYDDNCCSHLHYAD-UHFFFAOYSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)C[C@H]4[C@@H](CNC4)C5=CC(=CC=C5)F,2A04C46D63042F35_C4478F158A79BE93_6034_UN,8.586571,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011000110101100110101010000001011100100110110100110001001011011010111100111110,FBAFRWIMIUHBJK-LVRVKJESSA-N
C[N]1C(=CN=C1C2CCCCN2)NC3(CCOCC3)C4=CC=C(C=C4)F,C9B7C554716C2AA0_4CAC817778342180_6041_DP,7.808991,00000000000000000000000000000000000000100010000000000000010000100110000000010101101101110011010011101000100111011000001011100100110111110110001011011011010011101111110,DPBXSYTZGGZSSK-UHFFFAOYSA-N
CCC5CCC1=C(C4=C(N1CC2=N[N](C)C3=C2CCNC3)C=CC(=C4)C)C5,A3959E17D8C6267E_6868D6F339D70E92_6034_UN,7.674346,00000000000000000000000000000000000000000000000000001000000000000100000000010001101101100001011010101100110010010010101011101100110000000110011011011101010110101111010,MRVQQUFHEGPVFJ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@]23[C@@H](CCC2)OCC3)Cl)C4CC4,8342AB5F68A72846_9C1166EE65D72983_7022_UN,7.682565,00000000000000000000001000000000000000000000000000000000010000100010000000000000001100010011000011001101010111001000001000000000110011110110000010010011110111101111110,PVRIBOJBTCAHOK-QZTJIDSGSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2NCCC2C)F)CC3,E04BFD0AFE6B7EE7_0E55EEB5755448D9_6041_DP,7.86761,00000000000000000001000000000000000000000010000000000010000000000000000000010001101101110011010010001000100110010001101011100000110101110110001010011111010110101111010,GEDKWFITZOTULY-UHFFFAOYSA-N
FC1=NC2=C(C=C1)C=C(C=C2)NC3(CCCCC3)C4CC4,6C01CA3D48F3F530_C0AFD667C0853838_6041_UN,8.694056,00000000000000000000001000000000000000000010000000000000000000100110000000000000000000010011000000100100110100011000001001000100110001110100001001010001000010100111010,UFXUSNQSGBXTLC-UHFFFAOYSA-N
FC2=C1C=C[NH]C1=CC=C2NC(CC)C3CCOCC3,7132319D43D28454_02E17A9E4B012A7A_6041_UN,8.213947,00000000000000000000000000000000000000000010000000000000010000000100000000000000000100110011000010100100110111010010001011000100110111110110001011010011010111101111110,XGNIILKBMJGXQU-UHFFFAOYSA-N
C2(=C1OC=CC1=CC=C2F)NCC(C3CCCN3)(C)C,5CFB4201183A182E_EB7E7AB7660F956A_7022_DP,7.8769283,00000000000000000000000000000000000000000010000000000100010000000010000000100000101100010011000110001100110110011001101011000100110101110110001010010111110110101111110,GFVAWBLRAUPYNW-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2C3(CCCC2)CCC3)F,62EF70BA5332CD97_0F13965ADCE6C246_7022_UN,7.371271,00000000000100000000000000000000000000000010000000000000000000000010000000100000001001110011010000001000010100001001001000100000110001110010001011011111010110101111010,AJKUNQJENGQQMV-UHFFFAOYSA-N
N4CCC1(CCC1)C(C=CC2=C[N](N=C2C)C3=C(C=CC=C3)F)C4,ABEBACB1B4E67EF6_E53769048ACB3847_7019_DP,8.247233,00000000000100000000000000000000000000000010000000001000000000100110000000010000101100110001001010111000110100011000001011101100110001110110001011011011010010101111010,CJXUDAZHLBDQRC-UHFFFAOYSA-N
N4CCC1(CCC1)C(C=CC2=C[N](N=C2C)C3=C(C=CC=C3)Cl)C4,E931DA0657EB8E17_A881B3DC8817697E_7019_DP,8.247233,00000000000100000000000000000000000000000000000000001000000000100110000000010000101100110001001010111001110100011000001011101100110001110110001011011011010010101111010,NQBGQYBBBCEUSJ-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,E5DDFBEF64A22FD3_E5E76AD8744D674A_6041_UN,7.9493966,00000000000000000000001001000000000000000010000000001000000000100100000000010101101101010011011010101100011110010000001011101100110001110110001011011111010110101111010,SUSNYLQABUZJCS-VLIAUNLRSA-N
FC1=C(C(=CC=C1)NCC23CC(C)(CC2)CO3)C4CC4,0A0406A00CF454F9_521F0A9FB3926254_6041_UN,6.7911983,00000000000000000000001000000000000000000010000000000000010000100010000000000000001100010011000110101000010111001001101000000000110011110110000011010011110111101111110,BCSHFFKWNMSWQQ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2CC4=CC3=C(N(C)CCC3)C=C4)C5CCNCC5)F,2C0132CBEB5D015F_BA96A11546F3A741_6034_UN,8.091822,00000000000000000000000000000000000000100010000000000000000000100100000000010101001101110001010010101100110110010001101011100100110000110110001011011011010110101111010,DAUXLYMEGOOVGQ-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(CC)CCCCCC2)F)CC3,8B3A009A5B4FD190_5C9C6B45A52C77F3_6041_UN,7.7193303,00000000000000000001000000000000000000000010000000000000000000000010000000010001101001110011010000001000000110011011101011100000110001110110001010011111010110101111010,BKNCEFPIXKBZGW-UHFFFAOYSA-N
COC1=CC(=C(C=C1)Cl)NC23CC4CC(F)(C2)CC(C3)(F)C4,1C72052DDE2224A6_A9EC481F3635616A_7022_UN,8.077172,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010001010001000101110100011100000000000011100001110000000111000011100011101111110,NBBJTTUAXWVIQY-UHFFFAOYSA-N
COC1=CC(=C(C=C1)F)NC23CC4CC(F)(C2)CC(C3)(F)C4,834CADEBF7EE1F01_A2127D54C7EB6106_6041_UN,8.077173,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010001010001000100110100011100000000000011100001110000000111000011100011101111110,GKKXVRXIBWKOKA-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C[N](N=C3C)C4=C(C=CC=C4)F,9D04360F033928FC_3F8A26978059FA77_7019_UN,8.001655,00000000000100000000000000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011010000010101111010,VPMKVHFMTKDTKX-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NC(CCC)C3CCCC3,CB8EB186ABAFD05A_4B0DCA1D9B5E10BB_6041_UN,8.302742,00000000000000000000000000000000000000100011000000000000000000000100000000000100000100010011000010000100110100010011001001000100110101110100001000010001000110101111010,CKICQAIDGDFNLV-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C[N](N=C3C)C4=C(C=CC=C4)Cl,90C66AC9B4C4F488_723CFC4F8285AB4E_7019_UN,8.001646,00000000000100000000000000000000000000000000000000001000000000100110000000010000100100010000001010010001010100001000001011101100110001110100001011011010000010101111010,FOKOEAGYOOFOKL-UHFFFAOYSA-N
C[N]1N=C(N=C1NC2=C(C=C(C=C2)C3CCOCC3)F)C4CCC4,4D7D5795EF55D746_F4182D20826AA716_6041_UN,7.9843397,00000000000100000000000001000000000000100010000000001000010000100100000000010101100100110000011010100000001101000000001011101100110011110110001011011011010011101111110,KFCSUPJNKAKBBX-UHFFFAOYSA-N
CC(C)C1=CC(=C(C=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)F,C313B336B05D5571_37FFF415696FBBEB_7022_DP,8.541218,00000000000000000000000000000000000000000010000000000100000000100100000000110101101101110011010010001000000110000000000011100100110101110110011010001111010110101111010,SUFBECSTPDWPMU-LSDHHAIUSA-N
C2(=NN=C1C3=C(CCCC1=C2)C=CC=C3)NC4=CC=C(CC[Si](C)(C)C)C=C4,B84906A5D645BD37_2B95E8B20D961282_6041_UN,8.005606,00000000000000000001100000000010000000100000000000001000000000000100000000100101000000100001011000100100010000001001101011001100000001010100011011011101010110101111010,UZAMYFOZKXQDQD-UHFFFAOYSA-N
ClC1=NC2=C(C=C1)C=CC(=O)N2CC3(N)CCCC4=C3C=CC=C4,6737A62B91482B85_EDE0EAD67899CBC3_6034_UN,8.721532,00000000000000000000000000000000000000100000000000000000000000000110000000010101000011010011100001101101110100111100011011100101110001100100001111011011011110100111110,TZBHMXXEUAZANX-UHFFFAOYSA-N
CC4=CC1=C(C=C(C=C1C)NCC2(CC2)CC3CC3)[NH]4,9CB12535CACD3AC2_694AB0C63A068A69_6041_UN,8.065501,00000000000000000000001000000000000000000000000000000100000000000110000000000000101100000011000010001100010000001000001001000100110101010100001000010101010110101111010,JMYAMQFJOIDZIS-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)Cl)C5CC5,C1E6CB73C782F13F_C4C9A2B685B52A00_7022_UN,8.383656,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101010011010010101001000110010000001011100100110001110110001011011111010110101111010,GTZOZEJEPWJESR-HXOBKFHXSA-N
CN5CCCN(CC1=C(C=C(C=C1)NC24CC(OC23CCNCC3)(C)C4)F)CC5,5EC4298BE49DA79F_6403E732DDF05302_6041_DP,7.1135697,00000000000100000001000000000000000000000010000000000000010000000010000000010001101101110011010111101000110110011001101011100000110111110110001011011111110111101111110,NPNZNPGHHXMWAY-UHFFFAOYSA-N
O(C2CC[N]1C=CC=C1C2)CC3=CC4=C(C=C3)NC(=O)O4,9B13822BB15901C8_51FE67F93CF7F9EE_6039_UN,9.737455,00000000000000000000000100000000000000000000000000000000010000000100000000000000000101000000000111101100011001110100011011110111110010000110001111111001111111110111110,NHRBIULWTWSLLJ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C#N)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F,65D001D2D6548B94_A2FD3F08330DBCBF_6041_DP,8.10993,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010100111010,ZZVLQYQPBFXUAS-FZKQIMNGSA-N
CC1=C(C=C(C(=C1)NCC2CCN(C)C2C3=CC=CS3)Cl)C4CC4,D4AC07A4699F3E5D_009F769FC7698807_7022_UN,8.037864,00000000000000000000001000000000000010000000000000000000000000100000000000010000111101111011010010001001000110010001101011100100110001110110001010011111010110101111010,GVHMXXTVRGVCHT-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[CH]3C[C]2(C[C](C)(C2)C)C3)F)CC4,A43104253CBEC9DC_A0AE8605CAED1763_6041_UN,7.7553625,00000000000100000001000000000000000000000010000000000000000000000010000000110001100001110001010000001000110110011001101011100000110001110110011010011111010110101111010,MEDJJRRIAZJZIO-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC2CCCC3=C2C=C([N]3CC)C)C4OCCO4,55C876DC4590F436_BA8A3EC40AECA246_6041_UN,7.84006,00000000000000000000000000000000000000000010000000000000010000100100000010010000100101010011000010001100110111010010101011110100110011110110001011011111010111111111110,USBNVRBVAZXHNW-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NCC(C2CCNCC2)F)F)C#N,8A31E25BF01D7714_1E27DB3C4E37372E_6041_DP,8.719166,00000000000000000000000000000000000000000110000000000000000000000000000000000000001000110001000000101000100100010000001001000000110101110110001011010011010110101111010,BAJHLEJUCDZVFJ-UHFFFAOYSA-N
C1(=C(C=CC=C1)C2CCC2)NC3=CC4=C(C(=C3)Cl)OCCCO4,30FEED5A0E3AECD0_99F613D7B3F45CB3_7022_UN,8.957109,00000000000100000001000000000000000000000000000000000000010000100000000010000000000000010101000001000101010101000100001010000100000011110110000011010011110011110111110,SMQMLJDTJQVSNO-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CCC3CCC(C(CC)(C)C)CC3)Cl,84238BC0E4D75522_952EE99B69E234EC_6034_UN,8.7612,00000000000000000000000000000000000010000000000100000000000000000110000000110110010101011011000010001001001110011011101111100100110001110100011011011111010110101111010,PUHHJQZTUSGJKW-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CC3(CN2)CCC3)Cl)C4CC4,4D0C3EF3820A7B8C_649C285A34B45618_7022_DP,7.7667985,00000000000100000000001000000000000000000000000000000010000000100010000000000001001100010011000010001001110110011000001001000000110101110110001010010011010110101111010,VYMDYXZWDYLWDR-UHFFFAOYSA-N
C1(=C(C=CC=C1)C2CCC2)NC3=CC4=C(C(=C3)Br)OCCCO4,683C1FAB16F18D02_6935AA1B61035C62_7022_UN,8.957106,00000000000100000001000000000000000000000000001000000000010000100000000010000000000000010101000001000100010101000100001010000100000011110110000011010011110011110111110,PRKASYHGATUKTK-UHFFFAOYSA-N
O(C3CCN(CC1=CC=CC=C1)C2(CC2)C3)CCC4COC(C)(C)O4,B77E17BF7213CDF6_04BA824445059FF2_6039_UN,8.005228,00000000000000000000001000000000000000000000000000000000010000000010000010110000000101100100000011101000010011011000101011110011110010000110000101111100110111111111110,NYPSWPOYTGEVRU-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCC4(CC3)COC4,BAFC314F05DC9FEB_BA9160A6995FF5EA_6041_UN,7.6552935,00000000100100000000000000000000000000000010000000001000010000000110000000010000101100110011011010001100010101001000001011101100110001110110001001011001010111101111110,GVQMGYFQEPHSLA-UHFFFAOYSA-N
CN4CCN(CC1=C(C=CC=C1)NCC2(CCOCC2)C3=C(C=C(C=C3)Cl)Cl)CC4,993D1825A2C812E9_4A15CC2CEF31DED2_7022_UN,8.020529,00000000000000000000000000000000000000000000000000000000010000100010000000010001101001110011010000101001000101011001101011100100110011110110001011011011010111101111110,PWPOZNYEJZIESE-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)Cl)C4CC4,E8DA1546027DCA3E_E9B254A9396981A9_7022_DP,8.540613,00000000000000000000001000000000000000000000000000000100000000100100000000010101101101110011010010001001000110000000000011100100110101110110001010011111010110101111010,STDJYGGOUFKFMQ-GOEBONIOSA-N
FC1=C(C=C(C(=C1)C#N)F)N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,98BF5D9A8E119CDA_D7D71C1BB83B0C9F_6041_DP,8.20161,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010100111010,JMNZKRAGRBKKSB-RDTXWAMCSA-N
CC3CCCC(C=CC1=C[N](C)N=C1C2=C(C=CC(=C2)F)F)C3,7E5649C0E47365C0_E6CE1D17ED99F40C_7019_UN,8.311949,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010000000110000001101011101100110000100100001011011110000010101111010,OUGOECGIRTWNQL-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[CH]4C[C]3(C[C](C)(C3)C)C4,BCAD7234F6904EDD_64AF0EE0CCDF7E6D_6041_UN,7.918743,00000000000100000000000000000000000000100010000000000000000000000110000000100100001000010010000000101100010110001001000001000100100001110100011011000111010110101111010,LGNYFNOJWLZBDX-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,D703B1357A301B96_9535948C3C7777A0_6041_UN,8.041179,00000000000000000000001000000000000000100010000000001000000000100110000000110101101100010011011010101100010100001001101011101100110001110100011011011111010110101111010,WCYTVTGXFKCIGD-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC(CC)C2CCOC2)F)CC3,1A8B73E066E70797_8EBE975869ECBDC2_6041_UN,7.413725,00000000000000000001000000000000000000000010000000000000010000000000000000010001100101110011010011001000100111010011101011100000110011110110001010011111010111101111110,KJJHNVFLOMANOJ-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CC=C1)NC[C@@]23CCCN[C@H]2CCCC3,1C4A7D58741052E3_AF798E09DEAD4C08_6041_DP,7.677493,00000000000000000100100000000010000000000000000000000100000000000010000000100000101000100011010000101100110000011000001001000000110101010110011001011101010110101111010,TULGGZISIDFBFG-LEWJYISDSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CN(CCO2)C3CC3)F)CC4,24FBE3A79B256164_FF21D970E3F4033F_6041_UN,7.490638,00000000000000000001001000000000000000000010000000000000010000100000000000010001101001110011010100101000000111010001101011100000110011110110001011011011110111101111110,RUHHAZVITXOJOB-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)N[C@H]3[C@@H](OCC3)C4=CC=N[N]4CC5CC5,2365880272196F90_3E6AB466E748CA26_6041_UN,8.143233,00000000000000000000001000000000000000100010000000001000010000100100000000010100100100010011001111101100110101010000001011101100010011110110001011011111110111101111110,XDDIUZDFAQGGDC-WIYYLYMNSA-N
CN(C)CC1=C(C=C(C=C1)NCC2C3(CCCC2)CCC3)F,DC94A91976A31B10_175DF721458451D0_7022_UN,7.6103435,00000000000100000000000000000000000000000010000000000000000000000010000000100000001001110011010000001000010100001001001000100000110001110010001011011111010110101111010,PTUQRWQHOYHDHR-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC23CC(OC2)C=CC3)F)CC4,AA0613D2A2166412_7CFB36270153F828_6041_UN,7.255983,00000000000000000001000000000000000000000010000000000000010000000010000000010001100101110000010111011000110111011001101011100000110011110110001011011011110111101111110,VESZZAYJCOELDO-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)[NH]C=N2)NCC(N3CC(C)OC(C3)C)C4=C(C=CC=C4F)F,87127AE87DF6FED9_D24D1C78E5646CA5_6041_UN,8.5584545,00000000000000000000000000000000000000000010000000000100010000000100000000010101101101110001000110101100010110010001000011100100110111110110011011001111110111101111110,AEFGQNMXTHKEIU-UHFFFAOYSA-N
C(C12CCC(CC1)CC2)=CC3=NC4=C([N]3C)C=C(C=C4)Cl,CF96D61F116B4D1B_3BBA627E8B6A633D_7019_UN,8.2995615,00000000000000000000000000000000000000100000000000000000000000000110000000010101000101010000010010010101010100001000001011100100110000100100001011011010000010101111010,FZHMWYXJOGJOPG-UHFFFAOYSA-N
N1CCC(CC1)C2=NC=C(S2)NC3=CC(=C(C=C3)N4CCCCC4)F,0D47FCD1A3BFB48E_D5CCAC0F93F7DFEF_6041_DP,7.829573,00000000000000000000000000000000000010000010000100000000000000100100000000010001111101111001000010101000100100010000001011100100110101110110001011011011010010100111010,NOSBJTPHQILRSE-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC3CCC(CN3)(C)C,7C90AC2EC1F549DC_7A856C3AF0D13F26_7022_DP,8.067994,00000000000000000000000000000000000000000010000000001010000000000110000000110001101100010011001010101000100100011001101011101100110101110110001011011111010110101111010,VNPVZTOKTOXUFX-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2(CCOCC2)C3=CC(=CC=C3)F)C4CCCC4,75DA3A880F7E1ABC_3EC25788418CB81B_6041_UN,8.07946,00000000000000000000000000000000000000100010000000001000010000100110000000010101100100110010011011100000100101011000001011101100110011110110001011011011010011101111110,TXBITRFDWMOUJG-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=NNC(C=C2)=O)NCC3CC4(C3)C5CCC(C4)C5,E02885C632861BE1_E9C05313E1C5B971_6041_UN,7.889305,00000000000100000000000000000000000000000010000000001000000000100110010000000000001000010010101110101000010100101100011011001101110101110100001111010011011110100111110,BINXVKGCAYOAHN-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)N[C@@H]4C5=C(OC(C)(C4)C)C=CC(=C5)F,9F9A12F7AABE4ADA_737D6967C3C6A702_6041_DP,8.153035,00000000000000000001000001000000000000100010000000000000010000000110000000100100100101010011010011100100111100011101101011100100110111110100011011011101100011101111110,MXRFXPOYTQGBGZ-ZMMAXQRCSA-N
NC4CCC1=C(C3=C(N1CC2(C)CNC2)C=CC(=C3)Cl)C4,09EC34EA5C4F5EF2_C01B4241DE2ED368_6034_UN,8.093453,00000000100100000000000000000000000000000000000000000000000000000110000000010000101111110010000010001101110100011001001011100100110101100110001011011001010110101111010,OLTVOKFOWMEILX-UHFFFAOYSA-N
O[C@H](CCl)C1=CC=C(C=C1)NCC23CCC(C)(CC2)OC3,7E41DE21D14A1137_7B0A3FC0CD29C1BC_6041_UN,7.9168754,00000000000000000000000000000000000000000000000000000000010000000010000000000000001000000011000001101001110001001001101000000000110111110111000001010001110111111111110,ZBCRUUFCVVODSN-KLAILNCOSA-N
FC1=CC2=C(C=C1)C(=CN2C[C@@H]3CCCO[C@H]3C4=NC=C[N]4C)C5=CCNCC5,7598B5A654BACF47_5EFF1FE8DF86CFA5_6034_UN,8.867809,00000000000000000000000000000000000000100010000000100000010000100100000000011101001101110001010111111100110101010000001011100100110010100110001011011011110111101111110,WFHGRXBXOKBPRG-HTAPYJJXSA-N
FC1=CC(=C(C(=C1)F)F)NCCN(C)CC2COCCC2,F610119221FFDC9D_19F3CE043F0ECC93_6041_UN,7.730857,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001011011011010111101111110,MMPCQBTUWUAWPY-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CN(C3)C4COC4,89157549080D346F_0D39D6D36C858C3F_6041_UN,7.6435375,00000000100100000000000000000000000000100000000000000000010000100100000000010100101001100010000100101100010011010000000011100100110001010110011011001111010111101111110,GAIQQKILXFKZEH-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCCCCC3)C4=CC=CC=C4,68EC5EC4365EF1F4_2796B3024FF7EF18_6041_UN,7.492375,00000000000000000001000000000000000000000010000000001000000000100110000000010000101100010011011010001100010100001000001011101100110001110100001001011001010110101111010,PFOCQQROTYWVSF-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3(CC3)C4CCCC4,B1980BDF92998CAE_5A1895241DF5B168_6041_UN,8.365043,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010011011010000100110100011000001011101100110001110100001000011001000010101111010,LYLSZSSILBBRRR-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)N[C@@H]4[C@H]3[C@](C(C)C)(C3)CC4,9711B0F320B7133E_667903DF389ED49E_6041_UN,8.348722,00000000000000000000001000000000000000000010000000000000000000000110000000100000100000010011000010100100110110011000101001000100110001110100011011010111000010101111010,UEIAAWPQOPUICB-ZJBJCVSYSA-N
C2(=C1C=C[N](C1=CC=C2)CCN3CCCC3)NCC4C[Si](C)(CC4)C,45A16EFB16587A9E_CB20AC7D2A358B95_6041_UN,8.484174,00000000000000000000100000000010000000000000000000000000000000000100000000110001101101100011010010001100010010011001101011100100110001010110001000011101010110101111010,ZJYFOUCRRZDFMA-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CSCC3=CC(=C(C=C3)Cl)Cl,A41C2AEC8A91CC1B_DF9060674E3EF510_6038_UN,7.9398136,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000111011100000011001110100110000011000000000110010100010000011010011011110100111110,CJOQIPPYAGLKLO-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CC3(NCC2)CC3)F,E054AA066960C516_443EAF796D075215_7022_DP,7.552771,00000000000000000000001000000000000000000010000000000000000000000010000000100000001001110011010000101000110100011001001001100000110101110110001011011111010110101111010,AMJIFGXWXHDEMS-UHFFFAOYSA-N
CC2=C1CCCC1=CC(=C2)NC3=CN=C([Si](C)(C)C)C=C3,9BB287C73E6EA821_7174B085561B1531_6041_UN,7.51248,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100001010010100100010010001000101001000100010001010100011011011101000010101111010,WAYWHCKGTOUNRI-UHFFFAOYSA-N
CO[C@@H]1C[C@H](NC1)C2=NC=CN2CC4CN(CC3=CC=CC=C3)CC45CCC5,D005FD865417C342_3540E75CA3E35D3C_6034_UN,7.6905227,00000000000100000000000000000000000000100000000000000000000000100110000000010101101101100011010111001000110000011000101011100111110010000110001110011011110111101111110,JECZIWNDNIMTBU-JUODMZLFSA-N
O([C@@H]1CN[C@H]2COC[C@@H]12)C3=C(C)C=CC=C3C5=NC4=C(C=CC(=C4)Cl)[N]5C,AF7DB740E754B449_A7438B59F768AF4A_6035_UN,8.159948,00000000000000000000000000000000000000100000000000000000010000100100000000010101001101110111010111001101110101010100000011100111110010100110001111001111110011111111110,QCEXXBXRBAOGJZ-HHXXYDBFSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NCC3CC34CCSCC4,54B26C9FE91642F5_8BE9E7D6CB504879_6041_UN,7.9280214,00000000000000000000001000000000000010000010000000000000000000000110000000100000101000111011000000101100010100001000001011000100110001110110011011010111010110101111010,RIWFOQCOGKNYAO-UHFFFAOYSA-N
O([C@@H]1CN[C@H]2COC[C@@H]12)C3=C(C)C=CC=C3C5=NC4=C(C=CC(=C4)F)[N]5C,D12BD264830873EE_916EB43F989C66F2_6035_UN,8.159954,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101110111010111001100110101010100000011100111110010100110001111001111110011111111110,ZBNIKWOWBODCPX-HHXXYDBFSA-N
CC1=C(C=CC(=C1)NC24CC3CC(C2)CC(C3(F)F)C4)OC5CCOC5,6E1BEB0F4CA4AB5E_8D125A3FF77841D3_7022_UN,7.567915,00000000000000000000000000000000000000000010000000000000010000000010000010000000000100110101000010000100110101011100001000000011110011110110000111010011110011111111110,MGRAKZRBORITCV-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CC3(NC2)CCC3)F,9B501CC349F631C2_D7D90EFC15F92871_7022_DP,7.460762,00000000000100000000000000000000000000000010000000000100000000000010000000100000101101110011010010001000110100011001001001100000110101110110001010011111010110101111010,AGYVFOSPEUAHNE-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCC3(CC2)COC3)Cl)C4CC4,1F3085EECB911D39_45DFC1130BB02654_7022_UN,7.535074,00000000100100000000001000000000000000000000000000000000010000100010000000000000001000110011000000001001010111001000001000000000110001110110000011010011010111101111110,LDNJEULVOHBNPA-UHFFFAOYSA-N
C1(=C(N=CC=C1)Br)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,EE46C8251FF23D2B_8833F022A9CF8FCB_7022_UN,7.8825445,00000000000000000000001000000000000000000000001000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,BUWOEQFLFQGRLU-DYVFJYSZSA-N
C1(=C(N=CC=C1)Cl)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,3BDB469CD03CA6C5_3FDAA72F06F4FDBE_7022_UN,7.8825455,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,HPMWDFXOERTZCU-DYVFJYSZSA-N
C(C2CCC1(CC1)C2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,031DFAE6F0703359_8DFD31EF5DFCF7AF_7019_UN,7.944618,00000000000000000000001000000000000000000010000000000000000000000010000000000000000001010000010010010000010110011000101000100000110001110000000010011010000010101111010,BUXUFBRWFXYJIW-UHFFFAOYSA-N
C(CC2COC1(CCCC1)O2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,95B84902E05A35B0_3511B072E90F53E5_7019_UN,7.8272285,00000000000000000000000000000000000000000010000000000000010000000000000010000000000101010000010010010000010111011000101010110000110011110100000010011010110111111111110,BYCAOVWNGGOYCN-UHFFFAOYSA-N
FC2=C(C=C1OC=CC1=C2)NCC3CCCCN(C)C3,3897C8F5A140F9E6_DDE2E81DCAB2A967_6041_UN,7.828488,00000000000000000001000000000000000000000010000000000000010000000000000000010000101101110011010011001100010110010001101011100100110001110110001010011011110110101111110,XBGCQHYTBKEVCB-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C4=C(C3=CN=C[N]3C)C=C(C=C4)F)=O,526D07EF65979C08_F7333FF03E3A0162_6038_UN,7.903489,00000000000000000000000000000000000000000010000000000000010000100100000000010101001101010001110010001000110100110000011011100100110010100100001011011011111111111111110,JMYLTLNFQPXYKM-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C#N)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F,C40CE06F130AAFBE_23D3B1A40B45DC91_6041_DP,8.038415,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010100111010,ZJDHLGNBDNQJSO-FZKQIMNGSA-N
FC1=CC3=C(C(=C1)NCC2C(C)(COCC2)C)[NH]C=C3,6EC844BBE163AAA3_224A21084A3CEAC9_6041_UN,8.283104,00000000000000000000000000000000000000000010000000000010010000000110000000100001001100110011000010101100010111001001101011000100110111110110001001010111010111101111110,HQNAZNMHAULBBJ-UHFFFAOYSA-N
FC1=CC=C(C=C1)C3=CC2=C(C=CC=C2)N3CC4(F)CNCC45CCC5,1103B8FA536AAC73_2080CF4D0AEB5848_6034_UN,8.710095,00000000000100000000000000000000000000000010000000000000000000100110000000010000101101110011000010001100010100001000001011100100110000100110001011011011010110100111010,HVJUTXIBJSJNTG-UHFFFAOYSA-N
FC2=C1C=CN=CC1=C(C=C2)NCC3CCCN(C)C3C4=CC=CS4,3918D81BE55E229D_7B601EECF000D540_6041_UN,8.560538,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,SWUFGJZKVPLTBX-UHFFFAOYSA-N
FC1=CC2=C(C=C1)OC=C2NC4=C(CN(C)C3CCCCC3)C=CC=C4,0407178F4F7C683E_91F5FC5586371F1F_6041_UN,8.331271,00000000000000000000000000000000000000000010000000000000010000000000000000000000100101110010010111001100010110010001101000100100110001110100001011011011110110101111110,OPOMKNYECAQXQJ-UHFFFAOYSA-N
CN(C1CCCNCC1)C2=NC(=CN=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,CE25B84AB52B3840_B7248EB652A759D9_6041_DP,8.344475,00000000000000000001000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100110101110110001001011111010010101111010,GQULUPXNDARSLU-MDKRWRRSSA-N
CC1=C(C=C(C(=C1)NCC2(C)CCCCCC2)Cl)C3CC3,92ECFBC447FE447C_60174D48D7586761_7022_UN,7.451152,00000000000000000001001000000000000000000000000000000000000000100010000000000000001000010011000000001001000110001001101000000000110001110000000010010111010110101111010,UKUSRDOYSVGSEI-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C2CC2)NC4C[C@H]3CCC[C@H](N3C)C4,9290E410A88B8270_9AB2A9C0932FB1FD_6041_UN,7.4716372,00000000000000000000001000000000000000000010000000000000000000100000000000010000100001010001010000100100110110010000101001100000110001110100001011011011000010101111010,CNEDENZFPRZQOU-MQVJKMGUSA-N
FC1=C(C(=CC=C1)NC2=CC=CC(=C2)CC3CCCN(C)C3)C4CC4,1F73C2AF36A1944D_C69FC1E408D3A11A_6041_UN,7.6838684,00000000000000000000001000000000000000000010000000000000000000100000000000010000000001110001010000101000000110010001101001100100110001110110001011011011010110101111010,FRUHGXSBQLTQLK-UHFFFAOYSA-N
FC1=CC5=C(C(=C1)C=CC3=CC(=C2OCOC2=C3)C4=C(C)[N](N=C4)C)OC(OC5)C6=CSC=C6,2EE0E24E488A2E90_BC7E2A535E49A012_7019_UN,8.60778,00000000000000000000000000001000000010000010000000001000010000100100000010010000100100011100011010110100010101000100000011111100000000100110101011101110110011111111110,MQHHZBOYNGGSME-UHFFFAOYSA-N
FC2=C1N(C3=C(C1=CC=C2)CCCC3)C[C@]45[C@](C)(C4)CNC5,CC78F97A5FAA7028_5300A0564B3A414B_6034_UN,8.020114,00000000000000000000001000000000000000000010000000000000000000000110000000010000101101110011000010101100010110011001101011100100110000100110001011011011010110101111010,JNXHUEDRDFANRN-MOPGFXCFSA-N
FC1=CC(=C(C=C1)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,3D36A97715261B7A_BF9EA63D69B998B0_6041_UN,8.843288,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,GSTDRRKFKMWQLE-HOTGVXAUSA-N
CC5=NC1=C(C=C(C=C1F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)S5,4AA9C34D4AA529E3_5722699EAD2607DD_6041_UN,8.419258,00000000000000000000001000000000000010000010000100000000000000100100000000010101111101011011010010101100010100010000001011100100110001110110001011011111010110101111010,FZXVNWVCCWIRRU-SZNDQCEHSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC3=CC=C(C=C3)C46CC5CC(CC(C4)C5)C6,92D3E9C95563FA20_8BBEF05CD96F81B8_6041_UN,7.838796,00000000000000000000000000000000000000100010000000001000000000100110000000010101100100010000011010100100010100001000000011101100100001110100001011001011000010101111010,MJHSKWKNQJPRFR-UHFFFAOYSA-N
CC3(C)OC4(C[N]1N=NC(=C1)CNC2=CC=CC(=C2)F)CC3C4,46474BEAA1C953D4_ABA58A18CE3E12F9_2875_UN,8.209913,00000000000100000000000000000000000000000010000000001000010000000110001000110101101100010000001111001000010110011000100011101100101011110110001000001101110111101111110,RAXQIOWOZZOMCL-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)CC3=CC(=C(C=C3)F)Cl,06459ADDD81A7097_589B0DAF1F786085_6038_UN,7.9452066,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001110011110000101001110110110001111001100000110010100110001011011011011110101111110,LNSJPQMWLZVZED-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)CC3=CC(=C(C=C3)Cl)F,1BD514C8939539C3_3D97DFD1AAB005BA_6038_UN,7.9451985,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001110011110000101001110110110001111001100000110010100110001011011011011110101111110,KBMAOPJFXAMMFV-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)CC3=CC(=C(C=C3)Br)Cl,6AA8F2C24767450C_8CF216717C71F47F_6038_UN,7.9452,00000000000000000000000000000000000000000000001000000000000000000000000000010000101001110011110000101001110110110001111001100000110010100110001011011011011110101111110,AENXWIIABWVXCK-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)CC3=CC(=C(C=C3)F)F,8791A49F5436275A_15C6035774D183C6_6038_UN,7.945189,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001110011110000101000110110110001111001100000110010100110001011011011011110101111110,YJERCLVMBYCWTF-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)CC3=CC(=C(C=C3)F)Br,2DB313EDC7D72A02_5128B403C0AF07AF_6038_UN,7.9451914,00000000000000000000000000000000000000000010001000000000000000000000000000010000101001110011110000101000110110110001111001100000110010100110001011011011011110101111110,WXPJYXSUWBOQIJ-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)CC3=CC(=C(C=C3)Cl)Cl,B35F7196627F489A_9D759B0F46465432_6038_UN,7.945188,00000000000000000000000000000000000000000000000000000000000000000000000000010000101001110011110000101001110110110001111001100000110010100110001011011011011110101111110,SYNMKWKHNDWIAJ-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)CC3=CC(=C(C=C3)I)Br,9AB53214309D6AD4_4FE5C098046C4C1B_6038_UN,7.945189,00000000000000000000000000010000000000000000001000000000000000000000000000010000101001110011110000101000110110110001111001100000110010100110001011011011011110101111110,XWRRWZIOOKBSOH-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)CC3=CC(=C(C=C3)Br)Br,FA5B2126B73B81D9_CA577C6D36C30240_6038_UN,7.9451904,00000000000000000000000000000000000000000000001000000000000000000000000000010000101001110011110000101000110110110001111001100000110010100110001011011011011110101111110,ZDHOZUMUGSLGHA-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)CC3=CC(=C(C=C3)Br)F,8AF04E81E46F5456_58DAC7DB0191C1BA_6038_UN,7.9451737,00000000000000000000000000000000000000000010001000000000000000000000000000010000101001110011110000101000110110110001111001100000110010100110001011011011011110101111110,MWTPRRJRDCOKSA-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CC3)C4=CC(=CC=C4)F,54BFB7C3DBFDEB64_7089B6945CDFDF2A_6041_UN,7.7810793,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100000001110100001010011011000010101111010,MCYBYMRIAIRCRZ-UHFFFAOYSA-N
BrC1=C2C(=CC=C1)C4=C(N2CCCC3CC3(C)C)CCNC4,D73A70793578AC59_4CF1440B385170B9_6034_UN,8.745141,00000000000000000000001000000000000000000000001000000000000000000110000000110000101101110001000010101100110110011001101011100100110000100110001011011111010110101111010,UDHZPIBVNCDUMZ-UHFFFAOYSA-N
FC1=C2C(=CC=C1)C4=C(N2CCCC3CC3(C)C)CCNC4,8FE9741499C0F127_38E83C9B72C8CBBF_6034_UN,8.74513,00000000000000000000001000000000000000000010000000000000000000000110000000110000101101110001000010101100110110011001101011100100110000100110001011011111010110101111010,QDAQRTUNLWYWIB-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CC3(NCC2)CC3)Cl)C4CC4,9B686B592F7CDFA4_E3E7E54AC2BDFEF3_7022_DP,7.762291,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010011000000101001110110011000001001000000110101110110001011010011010110101111010,RWGKTDPVBQHAKH-UHFFFAOYSA-N
C1(=CC=C(C=C1)C[N]2C=NC3=C2CCCC3)NC4=CN=C([Si](C)(C)C)C=C4,94143FDF9832814D_028FF0623423D878_6041_UN,7.3796263,00000000000000000000100000000010000000000000000000000000000000000100000000110101000101100000010010101100010000011000001011100100110001010100011011011101010110101111010,OWWDHWPYFPTIAO-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC2CCCN2CC3CCCN3)C=CC(=C4)Cl)C5,84C0C95AA0EA270E_BBF755EFE25699AF_6034_UN,7.228789,00000000000000000000000000000000000000000000000000000000000000000100000000010001101101110011010010101101110100010001101011100100110000100110001011011011010110101111010,UUFUMHFNOYVWLO-UHFFFAOYSA-N
N(CC1C3CC2CC(CC1C2)C3)[S](C5=CC4=C([NH]C=C4Cl)C=C5)(=O)=O,64B76DD823EE1978_F5C26D97DC230BA8_6029_UN,8.009086,00000000000000000000000000000000110000000000000000010001001111001101010001000000011100011001001010001111011100001000010001001100111100101100001001001001010110110111110,UFABLNNUAZOMIS-UHFFFAOYSA-N
C1(=C(C=CC2=C1OCO2)F)NCCC3CC(C)CC(C3)(C)C,692E72B5918B7C7A_4FC3871E260CCED0_7022_UN,7.754567,00000000000000000000000000001000000000000010000000000000010000000010000010100000001100010001000111001100110111011101001010010000110001110110010011010111110111111111110,DEGLCNBYEGZGOT-UHFFFAOYSA-N
CN4CCC(CNC(=O)CC1CC2CC1C3CC23)C4C5=CC(=C(C=C5)Cl)F,C532BC40E2691FD9_E932231B85E5EF73_6038_UN,8.170518,00000000000000000001001000000000000000000010000000000000000000100000000000010000101101110011110010001001110110110001111001100000110010100110001011011011011110101111110,FLBINFBYUQKLCP-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(C)CCCCC2)Cl)C3CC3,40F15EFB2C453D74_E4E536F5EEF7DBA7_7022_UN,7.648039,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010011000000001001000110001001101000000000110001110000000011010111010110101111010,HFAZZUCIZRXXFA-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC3=CC2=C(C=C[N]2C)C=C3)C4OCCO4,FEF7D8D5501BC1F1_5339B6C2FE9935D5_6041_UN,8.34749,00000000000000000000000000000000000000000010000000000000010000100100000010010000100101010000010010000100010101000000001011110100000011110110001011011011010011111111110,IVKQEPPOZIEREC-UHFFFAOYSA-N
FC1=CC(=CN=C1)C2=C5C(=CC(=C2)C=C[C@@H]3CCO[C@H]3C4=CC=N[N]4C)OCO5,A26FB8FF4E28C207_FF2F4EB389F6C9D4_7019_UN,8.324845,00000000000000000000000000001000000000000010000000001000010000100100000010010000100100010000011111110100010101000100001011111100000010100110001011111010110011111111110,VYNDWNJRQRCURS-QVKFZJNVSA-N
CC(OC[C@@H]2C[C@H]1COC[C@H]1O2)C3=C(C=CC=C3F)N4CCOCC4,0AE0DA3F1CCA209C_3D4B92D5D9DA15EE_6039_UN,7.877858,00000000000000000000000000000000000000000010000000000000010000100000000010010000000101110100000111101100010101010000101011100010110011110110100011111010110111111111110,ZAZHNQOZUGYDDY-QMKZIMJPSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5)C,E11CBEEB8130DD6E_EA848C0C9C9560F8_6041_UN,8.203798,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010110010000001011100100110001110110011011011111010110101111010,WMOFUABCNMXLHI-OSPHWJPCSA-N
N(CC1C2CCC(C1)C2)C(C3=C(CC)C=CC(=C3)F)=O,3DAD97FAA2B1A354_5BB2269D3EEAB799_6038_UN,7.876448,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001000010100100010011000000000110000100000000011010011011110101111110,HBPFHSATZWDFCL-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC[C@H]3O[C@H]2CCC[C@@H]2NC3)F,05E18DF6549E98A0_0A05F540029F7DC0_7022_DP,7.4959526,00000000000000000000000000000000000000000010000000000100010000000000000000100000101001110011010110101100110100010001001011100000110111110110001011011111110111101111110,ADLKKVBODVGIKF-PVAVHDDUSA-N
FC2=C1N=CC(=C(C1=C(C=C2)F)NC[C@@H]3CNCC(O3)(C)C)C#N,480D9E561DF4CE91_50FCC5A2F060F160_6041_DP,8.200779,00000000000000000000000000000000000000000110000000000100010000000110000000100000101000110010000100101100010110001001000011000100100111110110001011000111110111101111110,MFGLWYFHCSZGMB-NSHDSACASA-N
CC2=C1N(C=CC(C1=CC(=C2)Br)=O)CC3(CC34CCNCC4)C#N,344C691283E16BAE_369534D8DE5F2C48_6034_DP,8.371481,00000000000000000000001000000000000000000100001000000000000000000110000000010000101001110001000001101100110110011100001011100101110000100110001101011001111110101111110,QUNSADZELZBKSY-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NCC3C(CC)CCCC3,5639EA0A53DC1BD8_6481DDAEA913DF37_6041_UN,8.058526,00000000000000000000000000000000000000000010000000000000000000000100000000000001001000010011000000101100010110000010101001000100110001110100001011010011010110101111010,PGTXJNDHHFSZJY-UHFFFAOYSA-N
NCCCC(OC1=C(C=CC=C1)C2=CCCNC2)C3=CC=C(C=C3)F,AD43F66F03AF65F4_06E2E66BFB440FC6_6035_UN,8.432545,00000000000000000000000000000000000000000010000000100000000000100000000000001000001010110011000000111000100100010100001001000111110110100110001111010011110101100111110,HOLWLHOMWFTHGE-UHFFFAOYSA-N
FC2=C1C=CC=CC1=CC(=C2)NCC3CCCN(C)C3C4=CC=CS4,2010C35F5B6BF5A1_E627FEDAF290222D_6041_UN,8.442264,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,RCRUZRHZZUAUKO-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NC[CH]4C[C]3(C[C](C)(C3)C)C4,751E6D096AFA3133_451A6BB08FECA4DC_6041_UN,7.751811,00000000000100000000000000000000000000000010000000000000000000000110000000100000101000010010000000101100010110001001000001000100100001110100011011000111010110101111010,UFAREECFNZPCIF-UHFFFAOYSA-N
C1N[C@@]2(C1)C[C@@H](C2)C3=NC=CN3CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,6E2A506EB16AC0D8_64CD560D69053C14_6034_UN,8.395227,00000000100100000000000000000000000000100000000000000000000000100110000000010101001101010011000010001001110110011010101011100100110100100110001010011011010110101111010,FYPGJGGQSNCGMT-PBYGKSEMSA-N
O(C3CCC4C1CC(C2OC12)C34)CC5=CC=C(C(C)(C)C)O5,D0A63597FE01D44C_DB8CE97D12E1D6F0_6039_UN,7.9653606,00000000000000001001001000000000000000000000000000000000010000000010000010100000000100000000000010100100010001001000001010000011110010000100010101110100110101011011110,DREOHTOLDYPNBG-UHFFFAOYSA-N
CC2=C1N=CC(=C(C1=CC(=C2)F)NCC3C4(CCNC3)CCOCC4)C#N,98CBE3AEDEC2D671_280BEB76B72EBF9A_6041_DP,7.5641217,00000000000000000000000000000000000000000110000000000100010000000110000000000000101000110011000000101100110101011000001011000100110111110110001011010011010111101111110,UKGPATPMBSCIAQ-UHFFFAOYSA-N
O(C2CCOC1(CCOCC1)C2)CCC3N(C)CCC3,49E7BEE3BFBD40D6_7F8C8943C81B732E_6039_UN,7.0330915,00000000000000000000000000000000000000000000000000000000010000000010000000010000000101100100010011101000010011011001101011100011110010000110000101111010110111111101110,RCAODMUPNHLQEJ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC4=C2C=NC=CC2=C(N3CCN(C)CC3)C=C4)C5OCCO5,67BD90B6B1189550_4C496D035817D256_6041_UN,8.121006,00000000000000000000000000000000000000000010000000000000010000100100000010010001100101110000010010101100010101010001101011110100110011110110001011011011010011111111110,WTGMFGWZSQCWPY-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CC(C)(CC2)C)F)CC3,8A2948E61F7B153A_8112A9C4784BF33C_6041_UN,7.8761377,00000000000000000001000000000000000000000010000000000000000000000010000000110001101001110011010010001000000110011001101011100000110001110110011010011111010110101111010,BBGFGIQYPSVLGF-UHFFFAOYSA-N
O(C1C3CC2CNC1C2C3)C4=CC=C(C=C4)C(=O)CCl,97F0FB2D60AC24E2_E8AB60AE0C7F6925_6035_UN,8.330811,00000000000000000001000000000000000000000000000000000000000000000000000000000000001100000011000110001101010000000100000001000011110010100110000101000001111111110111110,KWDVHDHBPYYNJY-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC(CC)C3CCCOC3,E91F4CBE406144A8_4DBE2AAE1A7F951A_6041_UN,7.8271623,00000000000000000000000000000000000000100010000000000000010000000100000000000100000000110011000001100100110111010010001011000100110011110110011011010111010111101111110,RXYPAYBXWACFTQ-UHFFFAOYSA-N
CC1=C[NH]C2=C1C=CC(=C2)NCC3N(C)CC4(CC3)CCC4,FB70F5C843130B40_F9988BBC0ECD165A_6041_UN,7.7427826,00000000000100000000000000000000000000000000000000000100000000000110000000010001101101100011010010101100010010011001101011100100110101010110001001011111010110101111010,REMHLJULMQYMAI-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NC[C@@H]2OCCN(CC)[C@H]2C3=C[N](N=C3)C)C4CC4,92A9B85CD8C1765B_A93D263694966A38_6041_UN,8.847409,00000000000000000000001000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010010101011101100110011110110001011011111110111101111110,CUCBSZIGDFNOKB-PMACEKPBSA-N
C1(=CC(=C(C=C1)Cl)Cl)NC24CC(C2)(N3C(CCCC3)=O)C4,39F2F81E0EB523F7_4E2317B4E900E062_7022_UN,7.556665,00000000000100000000000000000000000000000000000000000000000000100010000000010000100001010001100000101001110100111000011001100001110011110100001111011011011010100111110,DCOQVGIPSXHSDW-UHFFFAOYSA-N
C1(=CC(=C(C=C1)F)F)NC24CC(C2)(N3C(CCCC3)=O)C4,4638B953265E1A19_63A73B8817509DF6_7022_UN,7.556657,00000000000100000000000000000000000000000010000000000000000000100010000000010000100001010001100000101000110100111000011001100001110011110100001111011011011010100111110,CYOMDKLOVUOOFA-UHFFFAOYSA-N
C1(=CC(=C(C=C1)Cl)F)NC24CC(C2)(N3C(CCCC3)=O)C4,F7308621A88806D1_3146DD8BA7504908_7022_UN,7.556628,00000000000100000000000000000000000000000010000000000000000000100010000000010000100001010001100000101001110100111000011001100001110011110100001111011011011010100111110,KEWVMANWNWWMQS-UHFFFAOYSA-N
C1(=CC(=C(C=C1)F)Cl)NC24CC(C2)(N3C(CCCC3)=O)C4,BA36BF4023EE39CF_660D7CDC19F93EDB_7022_UN,7.5566254,00000000000100000000000000000000000000000010000000000000000000100010000000010000100001010001100000101001110100111000011001100001110011110100001111011011011010100111110,PKOJRCZKBXZPHQ-UHFFFAOYSA-N
C2(=C1OC=CC1=CC=C2F)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,F784752ABB0E5346_58D43017991E1530_7022_UN,8.166688,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101100010111010001101011101100110011110110001011011111110111111111110,QLDFYLUISITQSG-RDJZCZTQSA-N
CN(C)CC1=C(C=C(C=C1)O[C@@H]2C[C@H]3C[C@@H]2CC34OCCO4)F,8A672E099B4ADDA1_9F1E74A3ABDF83F1_7022_UN,7.6454067,00000000000000000000000000000000000000000010000000000000010000000000000010100000000101110000010010001000010101001101001010110011110010100110000111111110110101111111110,OFVKXJVUYIOOML-CKEIUWERSA-N
C1(=CC=C(C=C1)C[N]2C=NC3=C2CCCC3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,EB234644C78A1058_0892699BED6D64D6_6041_UN,8.287632,00000000000000000000000000000000000000000010000000000000000000100100000000010101100101110011010010001100110110010001101011100100110001110110001011011011010110101111010,RPRBBYRDSMGKAW-NOZRDPDXSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCC3CN(CC2=CC=CC=C2)CC34CCOCC4,2422ABD6FF5C0629_E015AAA2F94F82AB_6041_UN,7.925151,00000000000000000000100000000010000010000000000000000000010000000010000000110000111101101011010010101000010001001000001011100100110011010110011011011111010111101111110,XNPOCQZVQKQISH-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(C4=CC3=C(C(=CC(=C3)C)F)N=C4)=O,AB308673665A4F29_E1591D541C22D0AF_6038_UN,7.9473667,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010011100011101100010100100000011001000100110000100100001001010001011110101111110,JKUVMKFQHSZGMK-UHFFFAOYSA-N
ClC2=C1C(=CN(C1=NC=C2)CC45CC3(CC(CC(C)(C3)C4)C5)C)CC6=CC=CC=C6,56BFAADF2662F2CA_226EC7D554777DB9_6034_UN,7.362253,00000000000000000000000000000000000000100000000000000000000000000110000000010100000101010000000010101101010110001001000011100100100000100100001001001100010110101111010,ODDICNGRKGGYBZ-UHFFFAOYSA-N
FC2=C1N(C3=C(C1=CC=C2)CCCC3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,DF3FC9E96CD587A0_66DBB262C93B7B78_6034_UN,8.37508,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,ZQQLABVAEFTCGT-OSPHWJPCSA-N
N(CC1CC2CC1C=C2)C(=O)C3CC(F)(C3)C4=CC(=CC=C4)F,113152BB5D33DF7A_2BB98A42E70F34EB_6038_UN,7.3343797,00000000000100000000000000000000000000000010000000000000000000100010000000000000001000010011100010011000010100101000010000000000110000100000000001000001011110100111110,BBUCTVYQGOUHQQ-UHFFFAOYSA-N
CN4C[C@@H]3CC[C@H](OC1=C(C(=CC=C1)C2CNCCC2)F)[C@@H]3C4,84E8BA59B1D70943_0D49167F2E05DAAC_6035_UN,8.485894,00000000000000000000000000000000000000000010000000000000000000100000000000010000001101110011010011101100110110010101001011100011110010100110001111011011110001101111110,UGDXRRXDQABUDJ-NXOUSBOSSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC[C@H]4[C@@H](C4(C)C)C5=CC=CC=C5,3AD76AF49252A4C0_F2E25C7409C2AF13_6041_UN,8.151248,00000000000000000000001000000000000000100010000000000000010000100110000000100101001101110000000010101100010111001000101011100100110011110110001001011111010111101111110,YSJKVQMBDQXTHH-UGKGYDQZSA-N
FC1=C(C=C(C=C1)NCC3=C(CN(C)C2CCCCC2)C=CC=C3)C4OCCO4,A0A3B505155A63DB_1B3C34BD466D7F1A_6041_UN,7.9455113,00000000000000000000000000000000000000000010000000000000010000100000000010000000001101110001010010001000000111010001101010110100110011110110001011011011010111111111110,OTVZRKYUNFGJMZ-UHFFFAOYSA-N
O=[N](=O)C1=C(N=C(C=C1)NC2=CC3=C(C=C2)COCC3)C4=CC=C(C=C4)F,5EF952F856C9198B_15BCF54F664C785F_6041_UN,7.759434,00000000000000000000000010000000000000100010000001000000110000110100001100000101000000110001001001100110010101000000001111101100111011110110001011111011010011110111110,NCPRAWOOHGBTBJ-UHFFFAOYSA-N
FC1=C(C(=CC=C1)F)CCC=CC2CNCC(C2)(C)C,2FE654CF269BA69C_CD4BAE427DDC156A_7019_DP,8.875031,00000000000000000000000000000000000000000010000000000000000000000010000000100000001000110010000000111000000110001001001001000000100000100110000011010111010100101111010,NSAMGITWVSXEOC-UHFFFAOYSA-N
COC1=C(C=CC(=C1)C(F)(F)F)NC23CC(OC2)C=CC3,BEB5BAFD0D7D5BAA_81966F2FC54B8F57_7022_UN,8.193071,00000000000000000001000000000000000000000010000000000000010000000010000000000000000100000000010111010000111101011100000000000011110011110100000111000011110011111111110,UFVBTEHETRKVCZ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3C2CCCC2C3)F)CC4,F720C2710B198A6F_87E1657C655B7E82_6041_UN,7.8918743,00000000000100000001000000000000000000000010000000000000000000000000000000010001101001110011010010001000010110010001101011100000110001110110001010011011010110101111010,SRXFIHDSXKDUSA-UHFFFAOYSA-N
CC(C)(C)C2=CC1=C(C=CC(=C1)F)N2C[C@H]3[C@@H](CNC3)C4CCOCC4,9BD84A65E8681F6E_8E65FE0F1865D334_6034_UN,8.090031,00000000000000000000000000000000000000000010000000000000010000100110000000110000101101110011000010101100010111001000001011100100110010100110011011011111010111101111110,ZMMDHCVDWJXJML-HKUYNNGSSA-N
BrC1=CC2=C(N=C1)N(C=C2CC3=CC=CC=C3)CCC4CNCC(C)(C)O4,BE32F541EBBDD369_48C6FA9E6DB088A3_6034_UN,8.331331,00000000000000000000000000000000000000100000001000000000010000000110000000110100001101110011000111101100010110011001001011100100110010100110001001011101110111101111110,KGRRVIFEFVMPRU-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2C[C@@H]3CCO[C@H]3C4=NC=C[N]4C)C5=CCNCC5,7C3846C9B7FFA8C5_AAD65CDD89B26612_6034_UN,8.929651,00000000000000000000000000000000000000100010000000100000010000100100000000011101001101110001010111111100110101010000001011100100110010100110001011011011110111101111110,NDSBLZZCBLWENS-HRAATJIYSA-N
CN(C)CC1=C(C=CC(=C1)NC3=NC=C(CC2CCOCC2)S3)F,7700B9C1C5F868DE_F4B679536376886C_7022_UN,7.8945456,00000000000000000000000000000000000010000010000100000000010000000100000000100100010101111001010010101000001101000001001011100100110011110110001011011111010111101111110,SZJQSSFBFWGFPQ-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC2CC23CCC3)C=CC(=C4)Cl)C5,14EC349CB9FF296A_68AC783688870D8B_6034_UN,7.2101154,00000000000100000000001000000000000000000000000000000000000000000110000000010000100101110000010010101101010100011001101011100100110000100110001011011000010110101111010,XMBLUHDWAREFKZ-UHFFFAOYSA-N
FC2=C1C=C(N=CC1=CC=C2)NCC3CCCN(C)C3C4=CC=CS4,1E5F54CFFFE371C3_D50918C3AFD268ED_6041_UN,8.473972,00000000000000000000000000000000000010100010000000000000000000100100000000010100111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,OXKGPEURXYFXFL-UHFFFAOYSA-N
N4CC(OC1=CC(=C(C=C1)Cl)N2CCN(C)CC2)CC3(CCOCC3)C4,D98615C770E25F54_AA23765715462BA8_6035_DP,7.3889894,00000000000000000000000000000000000000000000000000000000010000100010000000010001001001110011010101101001010101011101101011100011110011110110001111011011110011111111110,SQEWGSDYBIDDPZ-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2CC4(CC3CO3)CCCC4,6F5CF26B4E07ACC0_169EB58CEDBFFDBE_6034_UN,7.845862,00000000000000001000001000000000000000000000001000000000010000000110000000010000000101010000000010001100010101001000101011100100110010100110000010011110110111101111110,NCSJJUDSFGONOX-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC34CCC(CC3)CC4,F33AA2F51E661126_BA03D39C2CDC55C8_6041_UN,8.127233,00000000000000000000000000000000000000000010000000001000000000000110000000010000101100010011011010001100010100001000001011101100110001110100001001011001010110101111010,NDFMBJXRVLRPGK-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCC(CC2)C3=CC=CC=C3)Cl)C4CC4,6872999C6B0BD628_8634B8454113626F_7022_UN,7.893181,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010011000000001001000110000000001000000100110001110000000011010011010110101111010,KHAJNZVWTXJZLI-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=CC4=C(C=C2)OC3(CCCCC3)O4,0D72D50229D3C14C_94F2AFA47292400F_6041_UN,8.003107,00000000000000000000100000000010000000000000000000000000010000000100000010100001000100100000010011100100010000001100001011010100110011010100011011011111100011111111110,GRRIAEKJAASTGH-UHFFFAOYSA-N
C(C[C@]12C[C@H]1CCC2)=CC3=C[N](N=C3C4=CC=CC(=C4)C)C5=CC=C(C=C5)F,6642AFFC47BD0AF2_430E84472AD268DC_7019_UN,8.223833,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011010000110101111010,KYEZQRVNCPRGNB-BWKNWUBXSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CC4=C(C(C)CC3)C=CC=C4,53F90B2D5AA1A8BC_E87AFF7FA57E2800_6041_UN,7.7445564,00000000000000000001000000000000000000000010000000001000000000000100000000010000101100010011011010001100010110000001101011101100110001110100001011011101010110101111010,IPVVIUIENIDRLD-UHFFFAOYSA-N
CC2=C1C=CN(C1=C(C=C2)Br)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,B25DA31865CC167D_6D90E5C1F6D40F2C_6034_UN,8.466991,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011110010110101111010,AHHGJIGXUOAKBM-IERDGZPVSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC[C@H]3[C@H](OCCO3)C4=CC=CC=C4,9B2FD21EE4D1AA9A_C4001AB1104F68C3_6041_UN,8.17773,00000000000000000000000000000000000000000010000000001000010000100100000010010000101100010001011111101100010101000000001011101100110011110110001001011011110111111111110,WXWRMFVLLXZWBZ-PKOBYXMFSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC4=C(C=CC=C4)C5=C(C=CC=C5F)F,AD6160D7AAC2CD41_9AA5B814A14650A5_6041_DP,8.167896,00000000000000000001000000000000000000100010000000000000000000100100000000000101100101010011010010100000110100010000101011100100110101110100001011011011000010101111010,RAODAPIPAGYOEB-BJWYYQGGSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC4=CC(=C(C(=C4)F)N5CCCCC5)F,FF8B839B959E09D4_911DD840A0775776_6041_DP,7.9345703,00000000000000000001000000000000000000100010000000000000000000100100000000010101100101110011010010101000110100010000101011100100110101110110001011011011010010101111010,HASJSGPZOOISBP-ALXJQNPVSA-N
FC1=CC2=C(C=C1)C(=NO2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,358F58FADC4EDA37_52DEBB7F62C49F75_6041_UN,8.589165,00000000000000000000001000000000000000100010000000001000010000100100000100010101101101010011011111101110010100010000001011101100111001110110001011011011110110101111110,LEUFPXQGQNGMJL-YJYMSZOUSA-N
FC2=C1C=CC=CC1=CC(=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,8AA2EB27B78F6EB3_2B1624FD96C99996_6041_UN,8.177557,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,MYIAHJRIFJVWHC-HXOBKFHXSA-N
CC1=C(C=CC(=N1)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,2266D8A937DC021D_4B610FD276746FFE_6041_UN,8.407895,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000110010000001011100100110001110110001011011111010110101111010,WBSJGDOCOWCXLP-KUHUBIRLSA-N
FC2=C1C=CN=CC1=C(C=C2)NCC3CCCCN(C)C3,7C40275A1B27FDCB_8DA4399AD6E92619_6041_UN,8.45145,00000000000000000001000000000000000000000010000000000000000000000100000000010000101001110011010000101100010110010001101011100100110001110110001001011001010110101111010,ICSZGSSRWMOLFG-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC45CC(C4)(F)C5,785B3F60B6401A7A_4F64E0D8B6812DFA_6041_DP,8.142889,00000000000100000001000001000000000000100010000000000000000000000110000000000100100101010011010010100000111100011000101011100000110101110100001001011001000010101111010,LQTXANMLXMHOHR-NEDPOTEPSA-N
C1(=C(C(=CC=C1)Br)Cl)NCC34CC2CC(CC(C)(C2)C3)(C4)C,5DF72233086504A2_C2ACAC3EFEE10302_7022_UN,7.669115,00000000000000000000000000000000000000000000001000000000000000000010000000000000001000010010000000001101010110001001000000000000100001110000000011000111010110101111010,UPKJXSBLDRODMK-UHFFFAOYSA-N
C1(=C(C(=CC=C1)F)F)NCC34CC2CC(CC(C)(C2)C3)(C4)C,17D69E7A5BEDF435_4C35061EF4CAE19F_7022_UN,7.6691136,00000000000000000000000000000000000000000010000000000000000000000010000000000000001000010010000000001100010110001001000000000000100001110000000011000111010110101111010,VLBAQBLWZRDCMC-UHFFFAOYSA-N
C1(=C(C(=CC=C1)Cl)Cl)NCC34CC2CC(CC(C)(C2)C3)(C4)C,970AA7418FC0A218_D7ACCA808FFD3C3F_7022_UN,7.6691093,00000000000000000000000000000000000000000000000000000000000000000010000000000000001000010010000000001101010110001001000000000000100001110000000011000111010110101111010,VOWXREPLXYFLFC-UHFFFAOYSA-N
C1(=C(C(=CC=C1)Cl)F)NCC34CC2CC(CC(C)(C2)C3)(C4)C,CEE38C091413A8E1_8D54B3701FBC3139_7022_UN,7.66908,00000000000000000000000000000000000000000010000000000000000000000010000000000000001000010010000000001101010110001001000000000000100001110000000011000111010110101111010,NPLBZESGMKSPKB-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2COCCNC2)F)CC3,6A08E968930C793B_F810B8AEA228E123_6041_DP,7.248967,00000000000000000001000000000000000000000010000000000010010000000000000000010001101001110011010101001000100111010001101011100000110111110110001010011011010111101111110,NOBXCXMJXWPQAH-UHFFFAOYSA-N
C1(=C(C(=CC=C1)Br)F)NCC34CC2CC(CC(C)(C2)C3)(C4)C,F0755CCD5C69461E_921030A2577BD5C3_7022_UN,7.669072,00000000000000000000000000000000000000000010001000000000000000000010000000000000001000010010000000001100010110001001000000000000100001110000000011000111010110101111010,XZEPLYJYQBDVOK-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NCC3(CCCO3)C4CC4)C,EB28221574B0C92D_3A47FF5B823347DB_6041_UN,7.8586907,00000000000000000000001000000000000000000010000000000000010000100110000000000000101100010011000110101100010111001000001011000100110011110110001011010111110111101111110,ZHOJQQGCBUXLJH-UHFFFAOYSA-N
COC1CC(NC1)C2=NC=CN2CC4(CC3=CC=C(C=C3)F)CCNC4,07A83813411997B1_6C6561B93AB79C84_6034_UN,8.39549,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101110011010111001000100100011000101011100111110110100110001110011011110111101111110,DLGXIYQHMXDRDL-UHFFFAOYSA-N
C1(=CSC=C1Br)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,EA82C3CC126BA9DF_DDE8A2698981E13E_7022_UN,8.011942,00000000000000000000001000000000000010000000001000000000000000000010000000100000001100011011000010001100010100001001101000000100110001110100000011010111010110101111010,XARVTPUSQZJMGS-UHFFFAOYSA-N
C1(=CSC=C1Cl)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,781805CC3C057994_645E102A06CFF894_7022_UN,8.011936,00000000000000000000001000000000000010000000000000000000000000000010000000100000001100011011000010001101010100001001101000000100110001110100000011010111010110101111010,BAKXPOAAABYCOJ-UHFFFAOYSA-N
COCC[N]1C=CC2=C1C=C(C=C2)NCC3(CCOCC3)C4=CC5=C(C=C4)OCO5,80DB71DB60EDFA7A_7C627D86EA09D870_6041_UN,7.7623196,00000000000000000000000000001000000000000000000000000000010000100110000010010000101101100011010110101100010001011101101011110110110011010110101011111001110111111111110,NFYUCMVYZUCTLH-UHFFFAOYSA-N
CC1=C(C=CC(=C1)N[C@@]34[C@@H]2OC(C)(O[C@@H]2[C@@H](CC3)C4)C)C=C,D58F014A28CFB3C6_80E0CC060A32C1DB_6041_UN,8.003566,00000000000000000000000000000000001000000000000000000000010000000010000010100000000100000011000111010100110000011000001010010000010001010100010011010111100011111111110,DMAVCBXGUFWNFQ-WFEDQXDTSA-N
CC1=C(C=C(C(=C1)NC[C@@]23[C@@H](CCC2)CCO3)Cl)C4CC4,21FC691151239D84_C209F06C1A14B82F_7022_UN,7.5907254,00000000000000000000001000000000000000000000000000000000010000100010000000000000001100010011000110001101010111001000001000000000110011110110000010010011110111101111110,PAXAUVOQARGGKX-KBXCAEBGSA-N
BrC1=CC2=C(C=C1)N(C3=C2CCCCCC3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,B548E78A2C51F3E2_A580AE0B93B1BDB5_6034_UN,8.277719,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,DQQWLXYOPMQGCE-WINIVTDRSA-N
CN(C)CC1CCCCC1OCC2=C(F)C=C(C=C2)C3=NC=CO3,13CA21ED82ED29C0_CDC3EF9FA5C4D37A_6039_UN,8.108134,00000000000000000000000000000000000000000010000000000000010000100100000000100000000101110000110111001000000111100001011011100111110010100110001111011110110111111111110,GCVYKFDBTXMQMO-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC34OC(C)(C)C(C3)C4,0046F6E5866385EB_CC4D4755A124273B_6041_UN,7.827378,00000000000100000000000000000000000000000010000000001000010000000110000000110000101100010010011110001100010110001000100011101100100011110100011000001101110111101111110,AAKGSWPSIKZLPB-UHFFFAOYSA-N
[NH]1C=CC2=C1C=C(C=C2)[S](=O)(=O)N4CC3=C(C=C(COC)C=C3)CC4,41A9646BAA1064D3_CDC2D7DA10189370_6026_DP,9.108257,00000000000000000000000000000000110000000000000000010001001111001101000001010000010100101000011010101110011001011001011011101110111000001110001011111001010111111111110,OWKKEROOBQZWME-UHFFFAOYSA-N
FC1=CC=C(C=C1)C3=C[N]2N=C(SC2=N3)NCC6C4(C5=C(C(C)(CC4)C)C=CC=C5)C6,1B90F6E929681B73_986C2F3F9E4B3660_6041_UN,8.64274,00000000000000000000001000000000000010000010000100001000000000100110000000100101111100011011001010001100011100001001101011101100110001110100001011011101010110101111010,GFEJIXQGTXCQBB-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2OCC3(C2)CCOCC3)F,AE51A4D25810D498_FF8FDCECCF6DD888_7022_UN,7.149087,00000000000000000000000000000000000000000010000000000000010000000010000000100000001101110011010110101000010101001001001010100000110011110110001011011111110111111111110,UAGRNTLSMDEKIE-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CO2)NC3=CC=CC(=C3)CC4CCCN(C)C4,50FC5F65D1E55736_CA40AB89666B821D_6041_UN,7.6810155,00000000000000000000000000000000000000000010000000000000010000000000000000010000000101110001010110101100010110010001101011100100110001110110001011011011110110101111110,UXIKZLAHEWQVDE-UHFFFAOYSA-N
FC2=CC(=C1OCCC1=C2)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,24B743F8DF1A4716_6E18B57437DA9BEB_6041_UN,8.605357,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011010110101100010111010101101011100100110011110110001011011011110111101111110,WUHOHYBIMBAECN-YJBOKZPZSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC3CCNCC34CCC4,B63C45F4D75724AA_900BB50B5F13BA64_6041_DP,7.599143,00000000000100000000000000000000000000100000000000001100000000100110000000010101101101100011011010101000110000011000001011101100110101010110001011011111010010101111010,KWLNBQCLWWAMCA-UHFFFAOYSA-N
N(C1C2CC3CC1CC(C2)(F)C3)C(C4=C[NH]C=C4CC)=O,E355324F6193DCB6_A931A84D045DEE28_6038_UN,7.7703395,00000000000000000000000000000000000000000010000000000100000000000110000000000000100100010011100011000100010100101010010001000000100101100100001011000011001110101111110,PBFWJGULPCEYGR-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)C[C@H]3[C@@H](CNC3)C4CCOCC4)CC#N)F,73558C38642E6777_A937BD197F89BE90_6034_UN,8.128136,00000000000000000000000000000000000000000110000000000000010000100100000000010000101101110011000010101100010101010000001011100100110010100110001011011011010111100111110,YKFDYSZQDYCCDM-RDJZCZTQSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CCCCC2)C3=CC=CS3)F)CC4,42D18F1AB5BE38AC_13047087FA9AE41B_6041_UN,8.425873,00000000000000000001000000000000000010000010000000000000000000100010000000010001111101111011010010001000000110011001101011100100110001110110001011011011010110101111010,PDRPOKAFBFNRSF-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC(=C2)NC4=C3C5CCC(C3=CC=C4)O5)F,44562EA01AD833B5_7AB9C59EDD628C4D_6041_UN,7.953553,00000000000000000000000000000000000000000010000000000000010000000100000000010101100101010001010011000100011100000000001011100100000011110100001011011011100011101111110,SOYKPBSYTPHHNW-UHFFFAOYSA-N
O(C(=O)C[N]1C=CC2=C1C=C(C=C2)Br)CC4=CC3CCC(N3)C4,B2479CF66308ED7A_71EAD4421F24D402_6031_DP,8.165012,00000000000000000001000000000000000000000000001000100000000000000100000000011000000101010011000110111100110101010000001011110110110010100110001001011001011111110111110,LRFCRBWDSQAUES-UHFFFAOYSA-N
O(C(=O)C[N]1C=CC2=C1C=C(C=C2)F)CC4=CC3CCC(N3)C4,D79D2EC922BBA2BD_0B8AF9F5043602C1_6031_DP,8.165011,00000000000000000001000000000000000000000010000000100000000000000100000000011000000101010011000110111100110101010000001011110110110010100110001001011001011111110111110,CHOWKNQEDNVZQD-UHFFFAOYSA-N
O(C(=O)C[N]1C=CC2=C1C=C(C=C2)Cl)CC4=CC3CCC(N3)C4,ED977A11DD1D450A_EF80912D07A0C8AA_6031_DP,8.165001,00000000000000000001000000000000000000000000000000100000000000000100000000011000000101010011000110111101110101010000001011110110110010100110001001011001011111110111110,YEFFDYSCDFIEOJ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3(CCNCC3)C4=C(C=NC=C4)F,550B9EA15B69F046_DF158C2741CFAA5C_6041_DP,8.084534,00000000000000000000000000000000000000100010000000000000000000100110000000000100001000110011000000101100110110011000001011000100110101110110001011010111010110101111010,UEARNABZMWTOJE-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)C=C,F607B8A2AE399CBA_AD4A151919A07BE9_6041_UN,8.153291,00000000000000000000001000000000001000000010000000001000000000100100000000010001101101010011011010111000000100010000001011101100110001110110001011011011010110101111010,XCIBBWQEQZWTLQ-VFNWGFHPSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CC4=C(C(=CC=C4)F)F,5F85B2190ACAA08D_66A09E056B572967_6038_UN,7.0963125,00000000000100000000000000000000000000000010000000000000000000000010000000000000001000010010100010001000110100111000011000000000110010100000000011010011011110100111110,FQJMGNVKNLIPIG-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3CCCC(C)CC3,41C25B3AEF679FDB_D3F32EABF918D3F9_6041_UN,8.582487,00000000000000000001000000000000000000000010000000001000000000000100000000010000100100010011011010000100110110010001101011101100110001110100001000011101000010101111010,FGRBAYYXUDCWMD-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CC4=C(C(=CC=C4)Br)F,6926F53273F535E0_8D630BB969796697_6038_UN,7.0963097,00000000000100000000000000000000000000000010001000000000000000000010000000000000001000010010100010001000110100111000011000000000110010100000000011010011011110100111110,RGAWMYOCBJSKDW-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CC4=C(C(=CC=C4)Cl)F,B55A41AAB49DDDA3_BF8585D020DE2376_6038_UN,7.096307,00000000000100000000000000000000000000000010000000000000000000000010000000000000001000010010100010001001110100111000011000000000110010100000000011010011011110100111110,ODNNKRVUXSRUMY-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C3=C2CNCC3)CCC4CCCN(C)C4,A35E11337E37D2D1_AF24C1A874245697_6034_UN,8.067488,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101100001010010101100110010010001101011100100110000000110001011011101010110101111010,MKFFHDNMILBUGH-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CC4=C(C(=CC=C4)Cl)Cl,AD4A9F9A791013B6_7111F6C35BF3849B_6038_UN,7.0962973,00000000000100000000000000000000000000000000000000000000000000000010000000000000001000010010100010001001110100111000011000000000110010100000000011010011011110100111110,QGNRMOPVWZYXTC-UHFFFAOYSA-N
CCN3CCC1=C(C(=CC(=C1)NC(CC)C2CCCCO2)F)C3,831C99E14205CC3A_69AA57D65F960119_6041_UN,7.7156987,00000000000000000000000000000000000000000010000000000000010000000000000000010000000001110011000100101100110111010010101011100000110011110110001011011101110111101111110,LQPOIHVHOFKNDJ-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC(C)C3CCCCC3,189A6F096BFED3C9_35C373E21CD7B2E7_6041_UN,7.7370853,00000000000000000000000000000000000000000010000000001000000000000100000000010000101100010001011010001100010110000001101011101100110001110100001001011101010110101111010,UQCKAQRUTGBCDZ-UHFFFAOYSA-N
CC1(C)O[C@@H]2CC[C@H]1C[C@H]2OC4=C3C=C(C(=CC3=NC=C4)F)F,95C03A42395A2B8B_A93A69B7B36589E1_6035_UN,8.233299,00000000000000000000000000000000000000000010000000000000010000000110000010100000000000010000000001100100010110001100101011000111110010100100000111010110100011011111110,PIBPDAFMDHWNFK-LZVXQISVSA-N
CC1(C)O[C@@H]2CC[C@H]1C[C@H]2OC4=C3C=C(C(=CC3=NC=C4)Cl)Cl,CB122A9A50F5640F_4DE283FC94B63C3B_6035_UN,8.233292,00000000000000000000000000000000000000000000000000000000010000000110000010100000000000010000000001100101010110001100101011000111110010100100000111010110100011011111110,IWDJXOAHXHGPJY-LZVXQISVSA-N
CC1(C)O[C@@H]2CC[C@H]1C[C@H]2OC4=C3C=C(C(=CC3=NC=C4)Cl)Br,482B8D6CCAAF685E_3434BCD98D316F9F_6035_UN,8.23329,00000000000000000000000000000000000000000000001000000000010000000110000010100000000000010000000001100101010110001100101011000111110010100100000111010110100011011111110,ZPVACGCHIGHRPC-LZVXQISVSA-N
N3=C(C1(C)CCCC2=C1C=CC=C2)[N](C4=C3C=C(C=C4)Cl)CC5CCCCC5,F386EE032FCF8DC7_1A18D14E1860CA29_7013_UN,7.867461,00000000000000000000000000000000000000100000000000000000000000100110000000010101000101010000000010001101010110001001101011100100110000100100001011011010010110101111010,AWBJIVPTKNKVQA-UHFFFAOYSA-N
CN(C)C3CCN(CC1=CC=C(C=C1)NCC(OC)C2CCCO2)C3,36991A597679A440_5B3068ACE026C449_6041_UN,7.733628,00000000000000000000000000000000000000000000000000000000010000000000000010110001101101100001010111001000000011010000101011100010110011010110011000011101110111111111110,SPRFUESXWPLLAR-UHFFFAOYSA-N
CC1=C(C(=CC=C1)NCC2N(C)CC3(CC2)CCC3)F,05ABEC7967D2DA5B_6C75A8468D7EF016_6041_UN,7.6132984,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011111010110101111010,ZQWBIEOMOLSCLV-UHFFFAOYSA-N
CC1=C(C(=CC=C1)NCC2N(C)CC3(CC2)CCC3)Br,81659287A7C6D1AA_642DD6B1076E4B76_7022_UN,7.613295,00000000000100000000000000000000000000000000001000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011111010110101111010,DCKMTEMUTMZRDH-UHFFFAOYSA-N
C(N1CCNCC1)C2=C3C(=CC=C2)C=C[N]3CC4(CCN4)C,0F40F443276A6357_8653DF498E0C85CF_6034_DP,8.348096,00000000100100000000000000000000000000000000000000000000000000000110000000010001101101100011000010101100110000011001101011100100110100000110001001011001010110101111010,AKGYXJJWWVFYPN-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)F,E241D789AD861773_6E191A43BED50640_6041_UN,8.41134,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110011011011111110111101111110,KUWLBCYNCLSNHF-IRXDYDNUSA-N
CC1=C(C=C(C=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)Cl,AA7A164CA63F48EA_502364B3F855F984_7022_UN,8.4113245,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110011011011111110111101111110,NPWSRWXXCODUDB-IRXDYDNUSA-N
N(C1C2CCN(C1)CC2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)F,DD617BADECBC9D28_9B4E21826F42CA65_6038_UN,7.4593287,00000000000100000000000000000000000000000010000000000000000000100010000000000001000001110011100000101001110100111000011001100000110001100110001011011011011010100111110,KENBWISDLLVYRW-UHFFFAOYSA-N
N(C1C2CCN(C1)CC2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)Cl,B9CF5285F7A1CE3A_54AB7B8AB474B343_6038_UN,7.459332,00000000000100000000000000000000000000000000000000000000000000100010000000000001000001110011100000101001110100111000011001100000110001100110001011011011011010100111110,BCWJCBGDLAWBJQ-UHFFFAOYSA-N
CC(C)C1=CC2=C(C=C1)N(C(=C2)C)C[C@H]3[C@@H](CCNC3)C4=CC=C(C=C4)F,266BE5870F78D0CB_B849D0F9EF221A93_6034_UN,8.498273,00000000000000000000000000000000000000000010000000000000000000100100000000110000101101110011000010101100110100010000101011100100110000100110011011011111010110101111010,FQLQXAWRLSWJDB-GMAHTHKFSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2C=C(C(=CC2=NC=C3)Cl)Br)C4,C105AE5DED6A34BE_816A209B366A0D40_6035_UN,8.002227,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000010011101101010100000101001001100111110000100100001111011110110111101111110,GARZPOMMEPNSOQ-GWSNDMCOSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2C=C(C(=CC2=NC=C3)Cl)Cl)C4,D95A07CCFF84DE4A_F8BC1FBE2FED5EE4_6035_UN,8.002219,00000000000000000000000000000000000000000000000000000000000000000100000000100000000001110000010011101101010100000101001001100111110000100100001111011110110111101111110,FEJXAKMSTIKRFV-GWSNDMCOSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2C=C(C(=CC2=NC=C3)F)F)C4,B1A6B58D55FB3607_1C64F5F5083EEB3E_6035_UN,8.0022135,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010011101100010100000101001001100111110000100100001111011110110111101111110,FHTMMAZRCRGXNC-GWSNDMCOSA-N
ClC1=NC=CC(=C1)C2=NC=CN2CC4[C@@H]3C[C@@H](C3(C)C)CC4,4859AEDD253EBA4A_B3C833869C453530_6034_UN,8.625708,00000000000100000000000000000000000000100000000000000000000000100110000000110101000101010000000010101001010110001000101011100100110000100100001011011110010110101111010,IQKBMAJJQLTJJT-FGRDXJNISA-N
CC1=C(N=C(N=C1)NCC[C@@H]2CC[C@H]3C[C@@H]2C3(C)C)C4=C(C=CC=C4)F,53AD0A6D36874A58_DE335C24A086CF93_6041_UN,7.5880375,00000000000100000000000001000000000000000010000000000000000000100110000000100100101000010001000000101000111110011000101011000100110001110100011011010111010110101111010,YIQZVVOPMAATHS-BQFCYCMXSA-N
CC3CCCC(CC=CC1=C([N](N=C1C)CC2=C(C=CC=C2Cl)Cl)C)C3,600EDBB75FF81E41_4E4C10E25E78A221_7019_UN,8.43171,00000000000000000000000000000000000000000000000000001000000000000100000000010000100100010000001010011001000110010001101011101100110000100100011011011110010110101111010,SPJSARIMPSNQNE-UHFFFAOYSA-N
N(C1C2CCC(CC1)CO2)C(=O)C[N]3C=CC4=C3C=CC(=C4)F,00EC01ED0CF62046_AA147A0CAB6F8BC1_6038_UN,7.729644,00000000000000000001000000000000000000000010000000000000010000000100000000010001000101010011100110101100110101110000011011100100110011100110001001011001111111110111110,WSOOFDCBOGSUDH-UHFFFAOYSA-N
CC1=CSC(=N1)[C@@H]2C[C@H]2C=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,65AA30084B764BBB_33AE605FE37DEB83_7019_UN,8.605538,00000000000000000000001000000000000010000010000100000000000000100100000000000000010101011000010010010000000110010000101011100100010001110100001010011110000010101111010,KMKBJDCXSLLKND-DNVCBOLYSA-N
O([C@@H]([C@H]1NCCC1)C2=CC=CC=C2)C3=NC(=CC(=C3)C#N)Cl,DC9CDA9622D9FE0E_CAAD398003414345_6035_UN,7.807061,00000000000000000000000000000000000000000100000000000000000000000100000000000000001100010011100110101001100100110100011011000111010000100100001101010001110011100111110,INPLZYNCNAHSEW-WMLDXEAASA-N
CC1=C(C=CC(=C1F)C#N)N[C@H]2[C@H](CCNC2)C3=CC=CC=C3,6815DB267BE3DD87_7C20829C5F9AF53D_6041_DP,7.62474,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010101111010,QPOOCSOEBUZDHH-SJLPKXTDSA-N
C2(=C[N]1CCOCC1=N2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,CCE35894E5F3317F_7C88B9BEA8FA6C6C_6041_UN,7.94981,00000000000000000000000000000000000000100010000000000000010000100100000000010101100101110011010110101100110111010001101011100100110011110110001011011011010011101111110,FVXVZDZOIQUKPW-PBHICJAKSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCCC3CCCC(C)C3,13DC2F9E27CE4FBA_BF2504137816B9F0_6041_UN,7.851617,00000000000000000000000000000000000000000010000000001000000000000100000000010000101100010001011010001100110110010001101011101100110001110100001001011101010110101111010,IBJIFSAUGVEQBT-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CC3(CN2)CCC3)F,8460DD1DF91A2593_C34562699B0EFAFE_7022_DP,7.3869696,00000000000100000000000000000000000000000010000000000010000000000010000000100001001101110011010010001000110100011001001001100000110101110110001010011111010110101111010,RVCNKUKZYLBUDD-UHFFFAOYSA-N
FC2=CC1=C(C=CC=C1)N(C2=O)C[C@H]3[C@@H](CNC3)C4CCOCC4,5807790FD702E420_6CBC40D6AC400997_6034_UN,8.362068,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011100010101100010101100100011011100101110010100110001111011011011111110111110,HAZIOAYADBLSLR-HOTGVXAUSA-N
CC1=C(C(=CC(=C1)F)N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,68E0A1DB101AD818_585C7B6FF94748D3_6041_DP,7.596424,00000000000000000000000000000000000000000110000000000010000000100000000000000001101000110011000000101000100100010000001001000100110101110110001011010011010010101111010,GNFTZYICHQYQKT-VQIMIIECSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NCC3N(C)CC4(CC3)CCC4)C,226CF9933EE1B832_3B4D8FFBD1A16F3E_6041_UN,7.7206726,00000000000100000000000000000000000000000000000000000100000000000110000000010001101101100011010010101100010010011001101011100100110101010110011011011111010110101111010,GAFUNXWXKUTRAG-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCCN(C)CC3COCCC3,B13D837287661A0E_E3A4FF3537E0D874_6041_UN,7.590979,00000000000000000000000000000000000000100010000000000000010000000100000000000101001001110001010001101100110111010001101011100100110011110110011011011111010111101111110,PPZRWYADBLTBLO-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NCC45CC(CC)(C4)CO5,5CC58ED9845DABB9_5D8F01CD6F6A2394_6041_DP,8.011201,00000000000100000000001000000000000000100000000000000000010000000110000000000101101101100011010110101000010011001010100011100000110111010110001001001101110111101111110,NJVFGTGRFFXSQL-WPFWNBIPSA-N
CCN3CCC1=C(C(=CC(=C1)NCC(OC)C2CCOC2)F)C3,1B085D37EC71ABFD_C5262577A9906D45_6041_UN,7.414171,00000000000000000000000000000000000000000010000000000000010000000000000000010000001101110101010110101100010111010010101011100010110011110110001011011101110111111111110,YCALWMPVYMFXPV-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CCC3CCCN(C)C3)Cl,8CFC9249CA88BA42_122F45520938603A_6034_UN,7.8954597,00000000000000000000000000000000000010000000000100000000000000000100000000010110010101111011010010101001001110010001101111100100110001110110001011011111010110101111010,RBHRRYXPJHTRBZ-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC3(CC3)C4CCSCC4,E88E6C7C91848258_4D38E2CB878062B9_6041_UN,8.197292,00000000000000000000001000000000000010000010000000000000000000100110000000100000100000111011000000100100110100011000001011000100110001110110011011010111010010101111010,YAMMOZYSVNKWKQ-UHFFFAOYSA-N
O(C(=O)C[N]1C=CC2=C1C=CC(=C2)F)CC4=CC3CCC(N3)C4,5C3CC58B09BC4E52_D9C68627144DB95E_6031_DP,8.179398,00000000000000000001000000000000000000000010000000100000000000000100000000011000000101010011000110111100110101010000001011110110110010100110001001011001011111110111110,GOEGYUBFPIEFHQ-UHFFFAOYSA-N
O(C(=O)C[N]1C=CC2=C1C=CC(=C2)Br)CC4=CC3CCC(N3)C4,53FC1A994F2E4084_EFD065E7FAFFB7D2_6031_DP,8.179375,00000000000000000001000000000000000000000000001000100000000000000100000000011000000101010011000110111100110101010000001011110110110010100110001001011001011111110111110,LLFRWZZFEVEURU-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CCNC34CC4,63520719BC9AC3EC_352CB72907AD0F07_6041_DP,7.543168,00000000000000000000001000000000000000100000000000000100000000000110000000000100101100000011000010101100110010011000001011000100110101010110011011010111010110101111010,YHFUBIFBISLLMU-UHFFFAOYSA-N
N(C1C3C2CC(CC(C1)C2)C3)C(C4=C(CC)[N](N=C4)C5=CC=C(C=C5)F)=O,6A0CAE4386089859_FFAED3D0974447D0_6038_UN,8.127761,00000000000000000001000000000000000000000010000000001000000000100100000000010000100100010011101011000100110100110010010011101100110001110100001011001011001110101111110,DWXPPVDLYNYHGY-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CCC2)C3CCCO3)F)CC4,8B2A31E755A9749D_16BAF1D26EBC4BD4_6041_UN,7.5960464,00000000000100000001000000000000000000000010000000000000010000100010000000010001101101110011010011001000000111011001101011100000110011110110001010011011110111101111110,FVWXPOOMLOWKEE-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCCCC23OCCO3)F)CC4,2F94D383AFAE8E66_3325498925E36C3C_6041_UN,6.9752755,00000000000000000001000000000000000000000010000000000000010000000000000010010001100101110011010110001000110111011001101011110000110011110110001011011011110111111111110,LOIKIVSIINHDON-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CC3(OCC2)CCC3)F,A0B20A06647F56E6_BE1E3731FD1B1666_7022_UN,7.290898,00000000000100000000000000000000000000000010000000000000010000000010000000100000001001110011010000101000010101001001001000100000110011110110001011011111110111101111110,PXILNZISKMSNPD-UHFFFAOYSA-N
C1(=CC(=CC=C1)C(F)F)NC2CCN(C)C23CCCNC3,3F42BC1DE7CDD64E_D46155CB05037801_7022_DP,7.7210765,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101100011010010101000110110011001101011100000110101110110001001011001010010101111010,BUPHDDODKRIQHJ-UHFFFAOYSA-N
CN(C)CC1=NC(=CC=C1)NCC2(CCNCC2)C3=C(C=NC=C3)F,FF6C3CC05DAA1B7F_83C08A7B55A90009_6041_DP,8.013165,00000000000000000000000000000000000000100010000000000000000000100110000000100101001001110011010000101000100100011001001011100100110101110110001011011111010110101111010,SKIKBAIAWSLKRG-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC2=NC=C[N]2C[C@@]34CCN(C)C[C@H]3CNC4,1B7A134652554781_1601A11AA732E180_6034_DP,8.08586,00000000000000000000000000000000000000100000000000000000000000000110000000010101101101110011010010101101010110011001101011100100110101110110001011011111010110101111010,BTTPLDZQEGWNNP-UZLBHIALSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CCC3)C4=CC(=CC=C4)F,6F7222D3D742E760_0E3EC55A4972FD92_6041_UN,7.712781,00000000000100000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001001011011010110101111010,QBILRMBSCQOTMX-IBGZPJMESA-N
FC2=C1C=CN(C1=CC=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,510BDD1771BE5443_7AE95F80A9B7E3A6_6034_UN,8.373896,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,FZRBVWLYRJZBKD-VFNWGFHPSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CCSCCC3,AD697A1B0B5586F8_4D6AA967E665050B_6041_UN,7.4221582,00000000000000000001000000000000000010100000000000000000000000000100000000000100001000101011000000101100010010000000001011000100110001010110011011010111010110101111010,MFUPEWXUCDTEKW-UHFFFAOYSA-N
N1CC[C@@H]2CN(CC[C@H]12)C3=NC=C(N=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,F8EBD1237636B592_CB64F142ED5898A6_6041_DP,8.69139,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101100110110010001101011100100110101110110001001011011010010101111010,ZVFOOGSABDAKTO-TXXUCJGISA-N
BrC2=C1C=CN(C1=CC=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,4F26C9E660EF3BF6_526818FF6EDAE4CC_6034_UN,8.373861,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,RBZFSJFTKDQQBJ-VFNWGFHPSA-N
ClC2=C1C=CN(C1=CC=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,28A1632557076AC9_983EC0AEE0124600_6034_UN,8.373857,00000000000000000000001000000000000000000000000000000000000000100100000000010101100101010000010010101101010100010000001011100100110001100110001011011010010110101111010,LAEOHLOPXBYERO-VFNWGFHPSA-N
CC1(C)O[C@@H]2CC[C@H]1C[C@H]2OCC3=C(F)C=C(C=C3)C4=NC=CO4,B9FACAD9095F9A6F_DF8A7D8E1FB1A46E_6039_UN,8.151881,00000000000000000000000000000000000000000010000000000000010000100110000010100000000100010000100110100000010111101000111011000111110010100100000111110110110111011111110,DNYGUSGUBFXPEA-USXIJHARSA-N
CC1=C(C(C4=C(N1CC3(CC2=CC=CC=C2)CCCNC3)C(=CC=C4F)F)=O)C,1C4871F97EBD94F5_98A00B696C2E947D_6034_UN,8.600257,00000000000000000000000000000000000000000010000000000000000000000110000000010000101001110011000001101100110110011100101011100101110000100110001111011111111110101111110,VNINHAGMNCMHGO-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(C4=CC3=C(C)C=C(C=C3[NH]4)F)=O,87094CB00868987D_C7FE31CF7141FE80_6038_UN,8.338299,00000000000000000000000000000000000000000010000000000010000000000100000000000001001100010011100110001100010100100000011001000100110100100100001001010001011110101111110,PZTILLLTCUFDOF-UHFFFAOYSA-N
O(C2C1CCOC1C23CCC3)C4=C(C=C(C(CC)(C)C)C=C4)Cl,AF16A5F2E0687B2C_64FCFBF329B0FB07_6035_UN,7.711953,00000000000100000001000000000000000000000000000000000000010000000010000000100000000100010100000010000001010101001111001000000011100010100100010110010110110101011011110,BOKZGINEYJBGRO-UHFFFAOYSA-N
C(CC1CCOC1)=CC2=C[N](C)N=C2C3=C(C=C(C=C3)F)F,6F4D09914A0EEBBE_E3C9BCBD9CA3448B_7019_UN,8.060838,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100110000011010010000000101000000001011101100110010100110001010011010010111101111110,SXNRLRZIODLUFW-UHFFFAOYSA-N
CC2=NC1=C(C=C(C=C1C)Br)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,90E79E5BCCC1F5CE_D857A5757B74A3B4_6034_UN,8.281475,00000000000100000000000000000000000000100000001000000000000000000110000000110101000101010000000010001100010110001000101011100100110000100100011011011110010110101111010,HFKFMXWOVQMRAR-DSUHRAPHSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC3C4(C3)CCOCC4,C75913E45D48FD44_DD9B356D25CC3605_6041_UN,7.5022793,00000000000000000000001000000000000000100000000000001000010000100110000000010101100101100011011010100000110001011000001011101100110011010110001011011111010011101111110,AUCXCFLALADVEA-UHFFFAOYSA-N
C2(=C1OCCC(C1=CC=C2)=O)NC3=CC=C(CSC)C=C3,1C789DDD005025BD_A5F1AD7D1EE10200_6041_UN,9.496665,00000000000000000000000000000000000000000000000000000000010000000000000000000000000000101101010100100100010001000101001000000101000011010110000111010001111111111111110,CSAUIRQVSFFKAU-UHFFFAOYSA-N
FC1(CCOCC1)C2=CC=C(C=C2)N[C@@H]3CCN(CC)[C@H]3C4=CC(=C(C(=C4)F)F)F,34EDDBA9A3FE2A3D_1C71B6561D93DECD_6041_UN,8.325144,00000000000000000000000000000000000000000010000000000000010000100010000000010001100101110011000010101000100111011010101011100100110011110110001011011011010111101111110,OMQNGKQXGSRBPP-IRLDBZIGSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC(CC2CCCCC2)C3COCCO3)F)CC4,98789BDA4B0F27F3_C3865F88C4C9DDEE_6041_UN,7.4958525,00000000000000000001000000000000000000000010000000000000010000000000000010010001100001110011010101101000100111010001101011100000110011110110001011011011110111111111110,DDIPDLPJPMURQQ-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NC[CH]3C[C]2(C[C](C)(C2)C)C3)OC=C4,2E0F25DE8A10CD25_86C0EE0622689162_6041_UN,8.207676,00000000000100000000000000000000000000000010000000000000010000000010000000100000001100010010000110001100010110001001000000000100100001110100000000000101110110101111110,UKZNUGDWEPZFPJ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CC4(C3)CCOCC4,0424EF2306A13F63_22BEAADB03B22029_6041_UN,7.127125,00000000000100000000000000000000000000100010000000000000010000000110000000000100001000110010000000101100010111001000001011000100110011110110001011010111010111101111110,BQJCZBBSRMOVDX-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)O[C@@H]2CNC[C@H]2CC3=CC=CC=C3,6E23DD7BB708CAD0_609764EDCBF5B3FB_7022_DP,7.8450327,00000000000000000000000000000000000000000110000000000000000000000000000000000000001100110011000111001001000100000100000001000111110010100110001111000011110101100111110,MAASAZDCDQLSQI-CXAGYDPISA-N
C1(=C(C=C(C(=C1)F)F)F)NC(COC)C2CCCOC2,5B8457E5F11EA3DC_097FA28D77646491_7022_UN,7.989208,00000000000000000000000000000000000000000010000000000000010000000000000000000000000000110011010101100000100101010001001000000010110011110110000011010011010111111111110,CDSYBFOLTLHRAD-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)F)Cl)NC(COC)C2CCCOC2,7629ED98D722B659_6DCF194EC9175D61_7022_UN,7.9892044,00000000000000000000000000000000000000000010000000000000010000000000000000000000000000110011010101100001100101010001001000000010110011110110000011010011010111111111110,WXLAYHGDOATCIL-UHFFFAOYSA-N
FC1=C(C=NC=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,04C07ECDD4864681_11D34488FB7B8A24_6041_UN,8.597907,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,BREQUADRCCGMBB-ACJLOTCBSA-N
C1(=C(C=C(C(=C1)Cl)Cl)Cl)NC(COC)C2CCCOC2,5F2B241DB9261A97_F248D88297055AAD_7022_UN,7.989195,00000000000000000000000000000000000000000000000000000000010000000000000000000000000000110011010101100001100101010001001000000010110011110110000011010011010111111111110,WZSBPLHPXPIQAR-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NCC2CC3(NCC2)CC3,05375E574F784685_4079C07EAB96A24F_6041_DP,7.5493636,00000000000000000000101000000010000000000000000000000000000000000010000000100000001000100011010000101000110000011000001001000000110101010110011001011101010110101111010,WPAFRSYUKKJHDQ-UHFFFAOYSA-N
CC3=NC1=C(C=CC2=C1CCCN2)N3C[C@H]4C[C@@H](C)NCC4,4FB3DFF885080674_6F692B6A40ACEE1B_6034_UN,7.373988,00000000000000000000000000000000000000100000000000000000000000000100000000010101101101000011000010101100110010010001101011100100110100010110001011011111010110101111010,ZLNYUHFBHSNNEX-TZMCWYRMSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2CC3(C2)CC3,F9F5359E522420DF_0DDC2D4C7C47D8C9_6041_UN,7.375347,00000000000100000100101000000010000000000000000000000000000000000110000000100001001000100010010000101000010000001000000001000000110001010100011010011111010110101111010,YOQMDVVKILSILT-UHFFFAOYSA-N
CC3=NC1=C(C=CC2=C1CCCN2)[N]3C[C@H]4C[C@@H](C)NCC4,4FB3DFF885080674_FDDA0F5300F3B340_6034_DP,7.373972,00000000000000000000000000000000000000100000000000000000000000000100000000010101101101000011000010101100110010010001101011100100110100010110001011011111010110101111010,ZLNYUHFBHSNNEX-TZMCWYRMSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NCC3(C)CCCS3)C,E282781AC03A4C38_0C61E2BE5178B2FA_6041_UN,8.155208,00000000000000000000000000000000000010000010000000000000000000000110000000000000111100011011000010101100010110001001101011000100110001110110011011010111010110101111010,YYABGDHTTZLYRE-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CC3=C(C=CC(=C3)F)F,371154D6694CC1DD_A358F2B95B885C2D_6038_UN,7.3572783,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001000110100110000011000000000110010100000000011010011011110100111110,FHLFVWJHQLVIRI-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,421BEE57DDE3ADAB_59E84F8F4D2B5F2B_6041_DP,7.1173005,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100110010000001001000100110101110110001011010011010110101111010,PNXSZVPRMQXWCS-FUHWJXTLSA-N
NCCCC(OC1=CC(=CC=C1)C2=CCCNC2)C3=CC=C(C=C3)F,B88D84BE7483113A_5CDEF452C8484EA4_6035_UN,8.439336,00000000000000000000000000000000000000000010000000100000000000100000000000001000001010110011000000111000100100010100001001000111110110100110001101010001110101100111110,ZZGIQPHTBALDOC-UHFFFAOYSA-N
FC2=C1OC=CC1=C(C=C2)NC[CH]4C[C]3(C[C](C)(C3)C)C4,D6C8600E8508D5B7_B95B44A23B4EA621_6041_UN,8.086105,00000000000100000000000000000000000000000010000000000000010000000010000000100000001100010010000011001100010110001001000000000100100001110100000000000101110110101111110,VXRMBMJMOQCIOP-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(C3=NC(=C(C)C=C3)F)=O,C124EB246D7186E7_1D6B00568425D0B5_6038_UN,8.175775,00000000000000000001000000000000000000000010000000000000010000000100000000000001001100010010100110101000010100100000011011000000110010100100001011010011111111111111110,USOAXJQDYMJYCQ-UHFFFAOYSA-N
CC2=C1N(C=CC(C1=CC(=C2)Br)=O)CC3(CNCC3)C4CCOCC4,CC4257B573A3AF0A_454FFA4B6E23FDBA_6034_UN,8.369322,00000000000000000000000000000000000000000000001000000000010000100110000000010000101101110011000011101100110111011100001011100101110010100110001101011001111111111111110,XMLLQPWBSFERKV-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC2CCNC3(C2)CCC3,837DD90D787C268C_6BC7156E005199DE_6041_DP,7.6232176,00000000000100000000000000000000000000000110000000000000000000000010000000000000001000010011000000101000110110011000001001000000110101110110001011010011010110101111010,AAKVDOSDMHVCEQ-UHFFFAOYSA-N
CC1=C(SC=N1)C5=NC2=C(C=C(C=N2)NCC3CC4=C(C(C)CC3)C=CC=C4)[NH]5,D05553CE2A736E0E_15DDC9A668DB6D9F_6041_UN,8.084161,00000000000000000001000000000000000010100000000100000100000000100100000000000101111100001011000010101100010010000001101011000100110101010100001011010111010110101111010,KSMWMBDNBLYCID-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NC3CCN(C)C34CCCNC4,60658C2DA1178D98_2B739A7DC153DDC7_6041_DP,7.669698,00000000000000000000001000000000000000000010000000000100000000100010000000010001101101110011010010101000110110011001101011100000110101110110001011011011010010101111010,SDPDDUCLUKUJCT-UHFFFAOYSA-N
NCC1(C(CCC1)OC2=CC(=CC=C2)C3CNCCO3)CC4=CC=C(C=C4)F,47E56C1590540A02_2184C7C0AD28BA57_6035_UN,7.9278145,00000000000000000000000000000000000000000010000000000000010000100010000000000000001010110011000111101000100101011100001011000111110110100110001101010011110101110111110,XYYFEAHHJVRVOT-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3N(C)CC4(CC3)CC4,EA16E1CA975EC755_3D05E184A0B16649_6041_UN,7.810352,00000000000000000000001000000000000000100000000000000000000000000110000000010101001001100011010000101100010010011001101011100100110001010110011011011111010110101111010,FRKUZMJLWXRPIQ-UHFFFAOYSA-N
N(CC2=NC1=C(C=CC=C1F)O2)C(C4=CC3CCC(N3)C4)=O,983E193DA3216076_1CA05531D2EEEB88_6038_DP,8.346078,00000000000000000001000000000000000000000010000000100000010000000100000000001001001100010011100110111100110100110000011011000100110110100100001001010001111110110111110,XICKFWBPSQESIC-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C([N]1CCC2SCCNC2)C=CC(=C3)Br)C4,D8B019B0C318C173_E1FFE2392D0EC1FC_6034_DP,8.3408165,00000000000000000000000000000000000010000000001000000000000000000110000000110000011101111011000010101100110100011001101011100100110000100110001011011101010110101111010,WLOGHZLBTVYKIO-UHFFFAOYSA-N
N4CCCC1=C(C=C(S1)NC2=CC(=C(C=C2)N3CCCCC3)F)C4,83554247A20F8DE6_DB1405C0387EF24A_6041_DP,7.5297494,00000000000000000001000000000000000010000010000100000000000000100000000000010000011101111011000010101100110100010000001011100100110101110110001011011011010010100111010,FVODWFZANCMYHM-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2=CC(=C(C=C2)N3CCCC3)F)C4CCCC4,78796030922736E1_62B64BD6C8C99A63_6041_UN,8.542523,00000000000000000000000000000000000000100010000000001000000000100100000000010101100101110000011010001000000100010000001011101100010001110110001010011011010010101111010,CASUULPAZDGWJS-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3C(C)(COCC3)C,3B5F72559C35A39C_43E91F62FDA48E88_6041_UN,7.9612827,00000000000000000000000000000000000000100010000000000000010000000110000000100100001000110011000000101100010111001001101011000100110011110110011011010111010111101111110,ZDETZPLNXAYPKP-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NC3(CC3)C4C5=C(CCC4)C=CC=C5,61FAB9792043777F_D83A4AAA93347DE4_6041_UN,8.17515,00000000000000000000001001000000000000000010000000000000000000100110000000010101000101010011010010000100111100011000001011100100110001110100001011011011000010101111010,YFEJUHGJNPDTBU-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NCC2(COCCNC2)F)F)C#N,474699DC090AF070_08EFEF3B0A1369C9_6041_DP,8.291923,00000000000000000001000000000000000000000110000000000100010000000010000000000000101000110011000101001000100101011000001011000000110111110110001010010011010111101111110,HQZAYDCWKCWGLN-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)N[C@@H]4C6=C(OC5(C4)CCCC5)C=CC(=C6)F,21C9FCFF86F186FA_45D66DB1A6FF3B8C_6041_DP,8.185076,00000000000000000001000001000000000000100010000000000000010000000110000000000100100101010011010011100100111100011100101011100100110111110100001011011001100011101111110,QBBLLQCEAQWXET-JTJHWIPRSA-N
FC1=CC(=C(C=C1)NC[C@@H]2CCCN(C)[C@H]2C3=CC=CC=C3)C4CC4,351BB97680AB7283_A75A07759EE46935_6041_UN,8.274366,00000000000000000000001000000000000000000010000000000000000000100000000000010000101001110011010000101000000110010001101001100100110001110110001011011011010110101111010,WHQJFPOMRIKPEO-AVRDEDQJSA-N
CN(CC1CNC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=CC(=C(C=C4)F)F,E3A9633A47CBD4AF_A6341D7F7546CE6B_6041_DP,8.316388,00000000100100000000001000000000000000100010000000000000000000100100000000000101101001110010010000101000100110010001000011100100100101110110001011001011010110101111010,XNBKVUUYQGWWDR-XJKSGUPXSA-N
CN1CCCC1C2=CC=C(C=C2)NCC3(CNC3)C4=NC=C(C=C4)F,C9F65DAE0B75DDCA_246786DFDB0AA4CE_6041_DP,7.838064,00000000100100000000000000000000000000000010000000000100000000100110000000010000101101110010010010101000000110011001101011100100110101110110001001011011010110101111010,VEJAVRDIERPOOV-UHFFFAOYSA-N
CN4CCC1=C(C=CC=C1N[C@@H]2CCO[C@H]2C3=CC(=C(C=C3)F)F)C4,7E67BCDF4F9192F1_5D1E268B984E1D0C_6041_UN,8.168388,00000000000000000000000000000000000000000010000000000000010000100000000000010000000101110011010111101100110101010001101011100100110011110110001011011011110011101111110,ISSMSCRRMPCHGP-UXHICEINSA-N
C[C@H](OCC(OC)C1CCCOC1)C2=C(C=C(C=C2F)F)F,037BE7F7BB0D31E6_9A274FD64804B72B_6039_UN,7.923809,00000000000000000000000000000000000000000010000000000000010000000000000010000000000000110100010000100000000111000000101000000010110010100110000011110110110101011011110,RYRQHKIDUZRNEI-NLTNOIMHSA-N
C[Si](C)(C)C1=CC(=CC=C1)NCC2=CC=CC3=C2CCCN3,B82E3B17785F6B3E_C03AA0A8B658FBB1_6041_DP,7.7149734,00000000000000000000100000000010000000000000000000000000000000000000000000100000001000100011010000101100110000011000001001000100110101010110011011011101010110101111010,TULWPSVQJMIUHP-UHFFFAOYSA-N
CC2=C(C=C1N=C(C(=CC1=C2)C)NC[C@@H]3CC[C@@H](O3)C4CC4)C,BF37D272919B7501_9467F6D1B4FEA5A5_6041_UN,7.6527853,00000000000000000000001000000000000000100000000000000000010000100100000000000100001100000011000110101100010010000000001011000100110011010100011011010111110111101111110,GCPIMRIXAMOQBR-PKOBYXMFSA-N
CC2=C1N=CC(=CC1=CC=C2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,C9C4CA08DEDB20E2_E7FA1D2803FC0D4F_7022_UN,7.8442645,00000000000000000000000000000000000000000000000000000000000000100100000000010001101001110011010000101101010110010001101011100100110001110110001001011111010110101111010,JYCMQZRXCZTRHW-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2CCC23CCCC3)F,05511F885EA7291D_2CDBF286D7F96116_7022_UN,7.953802,00000000000100000000000000000000000000000010000000000000000000000010000000100000000001110011010010001000110100011001001000100000110001110000001010011111010110101111010,XUFWZWABTFUQEF-UHFFFAOYSA-N
C1N[C@@]2(C1)C[C@@H](C2)C3=NC=CN3CC5=CC(=C(N4CCN(C)CC4)C=C5)F,141FFE58301005D4_3A0723F6DC47F60E_6034_UN,7.4831977,00000000100100000000000000000000000000100010000000000000000000100110000000010101001101110011010010101000110100011001101011100100110001110110001011011011010110101111010,XMOKUPULBMJJPD-CYWCHRQTSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CCC3=CC(=C(C=C3)Cl)Cl,11FA74BDEED5B47A_47341DB59B68B652_6038_UN,7.631638,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010010100000001101110100110000011000000000110010100000000011010011011110100111110,NSEXOABVXBVJOJ-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CCC3=CC(=C(C=C3)Br)Cl,4158FCA8E26CF071_3D6D80A0589BFF1A_6038_UN,7.631632,00000000000000000000000000000000000000000000001000000000000000000000000000000000001000010010100000001101110100110000011000000000110010100000000011010011011110100111110,VTXALYZXZWGOHD-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CCC3=CC(=C(C=C3)Cl)F,A18C52EEB31B564F_5669A63C0E02FD09_6038_UN,7.631627,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010010100000001101110100110000011000000000110010100000000011010011011110100111110,NUNKKCQUDXSRHN-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC34CCC(CC3)O4,CA9A54A246BD0A4D_746E66988370D24D_6041_UN,7.7924905,00000000000000000000000000000000000000100010000000001000010000100110000000010101101100010011011110101000010100001000001011101100110011110100001011011011110111101111110,QMDDFJDAYUKVMM-UHFFFAOYSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3(C)CCOCC3)C4,5D2A9F02C4F74B0F_5A42A69C5D939B31_6041_UN,7.62288,00000000000000000000000000000000000000000000000000000000010000000110000000010000101101100011010010101100110001011001101011100100110111010110001011011101010111101111110,XYRSIKDEAXMJFR-UHFFFAOYSA-N
CC2=CN(C3=C1C=C(C=CC1=NC=C23)Cl)CC5CN(CC4=CC=CC=C4)CC56CCC6,A766F3AE9CAA1ECF_F46B50A7F5216819_6034_UN,8.233576,00000000000100000000000000000000000000000000000000000000000000000110000000010000100101110000000010101101010110001000001011100100110000100110001001011000010110101111010,BYTSETPIZLCONU-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NC3CCN(C)C34CCCNC4,5603A27D2B17BFB0_6E9818CBBA453F77_6041_DP,7.7675667,00000000000000000000000000000000000000100000000000001100000000100110000000010101101101100011011010101000110010011001101011101100110101010110011011011111010010101111010,ZPEQYOUELWKMDV-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3=C2CCCCC2=CN=C3)F)CC4,9D7813BCDC077655_6F42AC84AAB8491D_6041_UN,7.2818832,00000000000000000001000000000000000000000010000000000000000000000100000000010001100001110011010000101100010110010001101011100100110001110110001011011011010110101111010,YWGSXEYXWRDYQA-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)N[C@H]4C6=C(OC5(C4)CCC5)C=CC(=C6)F,82E6CA49DD9F3772_C65299EC594F2236_6041_DP,8.252952,00000000000100000001000000000000000000100010000000000000010000000110000000000101100101010011010011100100110100011100101011100100110111110100001011011001100011101111110,YSNWZBPEGATGOH-AJYBTWMASA-N
N5CCC1(CCCC1C=CC4=CC2=C([N](N=C2C)C3=CC=CC=C3)N=C4Cl)CC5,7D51A33CAAE42B84_A8CDBBF4650059ED_7019_DP,8.062794,00000000000000000000000000000000000000100000000000001000000000100110000000010101101100110001001010111101110100011000001011101100110001110110001011011011010010101111010,AFLMVSREPIPLAT-UHFFFAOYSA-N
CC1CCOC1CC=CC2=C[N](C)N=C2C3=C(C=C(C=C3)F)F,BAC8E86D0BA30A17_81C5C49CC019F24E_7019_UN,7.922503,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010000011010010000000111000001101011101100110010100100001010011110110111101111110,OVLBLEUBPMCHPR-UHFFFAOYSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC3=CC=C(C=C3)C4CNCCC4,2E7C8A4D852D3E52_757540A66C381186_6035_UN,8.425726,00000000000000000000001000000000000000000010000000000000000000100010000000000000001010110011000001101000100101011100001001000111110100100110001101010011110101100111110,NLKZQWWIZVVDKO-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC45CC3CC(CC(C3)O4)C5,6CC7CDBC0444E898_A9B33A700E3505B1_6041_UN,7.778841,00000000000000000000000000000000000000000010000000001000010000000110000000010000101100010010011110101100010100001000000011101100100011110100001001001001110111101111110,OXWSBYXKIDOBFU-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C)C4CC4,BBF0EB3AF18EFFE2_8D7AC9E3DAF2AEDB_6041_UN,8.659696,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101110011010010101000000110010001101011100100110001110110001011011111010110101111010,JCLBEBZAUMZOJN-MGPUTAFESA-N
C1(=C[NH]N=C1CC2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,08FCD33608F3F6BD_B348E9D8EE29DFFB_6041_UN,8.785527,00000000000000000000001000000000000000000010000000001110000000100100010000010001100101110011011010001000100110010001101011101100010101110100001010011011010110101111010,IJVSUEHJVTXSOC-QAPCUYQASA-N
FC1=C(C=C(C=C1)NCC2(CCN(C)CC2)N3CCCCC3)C4OCCO4,0A0B076EEB12F5C4_EE9E2FFE52903A18_6041_UN,7.2701488,00000000000000000000000000000000000000000010000000000000010000100010000010010001101101110011010010101000000101011001101011110000110011110110001011011011010111111111110,ZNNURSHHOKYXES-UHFFFAOYSA-N
N4CC1=C(C=C(C=C1)NC2=CN=CC(=C2)[Si](C)(C)C)C3(CC3)C4,327C690FC4C8895E_D7FD0E0B59D0BDBD_6041_DP,7.472418,00000000000000000000101000000010000000000000000000000000000000000110000000100001001000100011010000101100010000001000000011000100110101010110011011011101010010101111010,RHLREYFSRAYUGR-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC2=CC=NC(=N2)C3CCCN3,BEAD949B53990169_C630C09A85191704_7022_DP,8.49984,00000000000000000000100000000010000000100000000000000000000000100100000000100101101100100011010010101000100000011000001011000100010101010100011001011101010010101111010,ROWDALQJKMRGLU-UHFFFAOYSA-N
CC1=C(C=CC=C1Br)NCC3CCCN(CC2CC2)C3,214E28F77039D438_819EF6BB5B9CFA09_7022_UN,8.270095,00000000000000000000001000000000000000000000001000000000000000000000000000010000101001110011000000101000000110010000001001100000110001110110001011011011010110101111010,NAMFJZLQPBNQNQ-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC3CCCN(CC2CC2)C3,08B8B28A0B6AD5B1_5D9DA4A7F2D26E3B_7022_UN,8.270088,00000000000000000000001000000000000000000000000000000000000000000000000000010000101001110011000000101001000110010000001001100000110001110110001011011011010110101111010,CXUVTCBMGINBRK-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC34CC(C3)CO4,B6769FF7347F67CB_DC1616215D25F04C_6041_UN,7.660609,00000000000100000000000000000000000000100010000000001000010000100110000000010101101100010011011110101000010101001000000011101100110011110110001010001011110111101111110,ZJIBPSHMQYLIMD-UHFFFAOYSA-N
CC1=C(C=CC=C1F)NCC3CCCN(CC2CC2)C3,228A5231D77A15A0_B3BC7395AE030A23_6041_UN,8.270076,00000000000000000000001000000000000000000010000000000000000000000000000000010000101001110011000000101000000110010000001001100000110001110110001011011011010110101111010,NPALXKDNSSBUTN-UHFFFAOYSA-N
CC1=C(C3=C(C=C1)N=C2CCCCC2=C3N[C@@H]4CCN(C)[C@H]4C5=CC=CC=C5)F,827CE0C92659CC77_BAA112A60C53A835_6041_UN,7.556317,00000000000000000000000000000000000000000010000000000000000000100100000000010001100101110011010010101100110110010001101011100100110001110100001011011111010010101111010,PEEBBMFCHHDBRW-BWKNWUBXSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC4CC3CCOCC3CC4,3BA2C8304A212585_459D45F4256CBD96_6041_UN,7.9890547,00000000000000000000000000000000000000100010000000000000010000000100000000000100001000110011000000101100010111000000001011000100110011110110001011010111010111101111110,USNJEHZEAOOKGY-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)OC(C2=NC=C[N]2C)(C3CC3)C4=NC=C[N]4C,90BE7C2131141BD8_C77EBEF40F62DA04_7022_UN,8.497787,00000000000000000000001000000000000000100010000000000000000000000110000000010101100101010000010110010000000100001000000011100110000000100100001010011110100011101111110,LDPQOAVGHWEYLE-UHFFFAOYSA-N
ClCC3=NC1=C(C(=CS1)C2=CC=CO2)C(=O)N3CC4C(C)(C)C5CCC4C5,B280AE38E60CAB25_589E6F2FEF87338C_6034_UN,8.528739,00000000000000000000000000000000000010100000000100000000010000100110000000110100110101001000100011101101010010111100111011100101110000100110001111011110111110111111110,HJKLNDQKHCJRHL-UHFFFAOYSA-N
NC2=NN=C(NC1=CC(=CC=C1)Cl)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,E3913CDB4F54DA24_9A9CA3D604897876_6034_UN,7.9030185,00000000000100000000000001000000000000000000000000001100000000000110000000110101100111010010001010001001011110001000101011101100110101110100001011011111010110101111010,UBCAGGCPEOPJOK-LBBQAWJBSA-N
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C[C@@H]3N(C)CCC3,D720BAC598818249_A9BE7A006FAB6D98_6039_UN,8.261347,00000000000000000000000000000000000000000010000000000000000000100000000000010000000101110000010110001000000111010001101001100011110010100110000111011010110111101111110,FMQRSKVUWNNRDK-JKIFEVAISA-N
CC4(C=CC1=C[N](C)C2=C1C=C(C=C2)F)CC3OC3C4,99F36A889EA4CEE9_D9F1D78F4C3A7B0E_7019_UN,8.291146,00000000000000001000001000000000000000000010000000000000010000000110000000010000000101010000010010110100010100001001000011100100110010100100000001001100100011101111110,KGFKFDFYFXJYRL-UHFFFAOYSA-N
CN(C)CC1=C(C4=C(N=C1C2=CC=C(C=C2)C3CCC3)C=C(C=C4)Cl)C5COCCC5,B3B0F7D40F77B41A_DAD13E250A54EE86_2201_UN,7.9669113,00000000000100000000000000000000000000000000000000000000010000100100000000100000100001110000010000101101010101000001001011100100110010100110001011011110010111101111110,HTLAICGSLWWAAQ-UHFFFAOYSA-N
N3CCC1=C(C=CC=C1NCC2(CN(C)C)CCCC2)C3,61E3D26CCD852353_978172A0E16EC1DE_6041_DP,7.042565,00000000000000000000000000000000000000000000000000000000000000000010000000100000101001100011010010101100110010011001001001100000110101010110001011011101010110101111010,USJQCEOHCDTIFQ-UHFFFAOYSA-N
FC1=CC=C(C=C1)CC2=NN=C(Cl)N2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,3ABDC48FFAF4727C_DA030C0111C5F235_6034_UN,8.0934515,00000000000100000000000000000000000000100010000000001000000000000110000000110101100101010000001010001001011110011000101011101100110000100100001011011110010110101111010,PDTNILWURWHHFE-ZMSDIMECSA-N
C[N]1N=C(C=C1NC3(CC2=C(C=CC=C2F)F)CCCCC3)C4CCCC4,C1980EC124D0487F_C1B5AFEBEA6F9D51_6041_UN,8.001667,00000000000000000000000000000000000000100010000000001000000000100110000000010101100100010011011010000000100100011000001011101100110001110100001011011011000110101111010,SAXKZPYYCFVHLN-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(CC)CCCN3)C4=CCNCC4,3D24EC3B941361AB_5AC80481A7F34D95_6034_UN,8.63103,00000000000000000000000000000000000000000010000000100000000000100110000000011001001101110011000010111100110110011010101011100100110100100110001001011001010110101111010,JPZFYBSOXBNXSS-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NCC4(CCC4)C5=C(C=CC=C5F)F,5CD7670F80C95D83_3055968CDAA91176_6041_DP,8.1138935,00000000000100000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000010110001000001011100100110101110110001011011011010110101111010,QLPKELVUQOZMJK-RAKKMVLPSA-N
CC4(C)CCC1=C(C3=C([N]1CCCC2CCCNC2)C=CC(=C3)Br)C4,A456D8F86DA693F2_71E4E26F84502D01_6034_DP,8.128134,00000000000000000000000000000000000000000000001000000000000000000110000000110000001101110011000010101100110100011001101011100100110000100110001011011101010110101111010,GQMNMYURVRMQQL-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC3=CC2=C(CCCN(C)C2)C=C3,BFDD87BD292B4251_407F6EC416B20438_6041_UN,8.130793,00000000000000000001100000000010000000000000000000000000000000000100000000110001000001100001010000101100010010011001101011100100110001010110011011011111010010101111010,SOTSARPAKUSINY-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,E3492832B6DD67AA_4F92F86EBF9FA248_6041_UN,8.098183,00000000000000000000000000000000000000100010000000000000000000100100000000010101100101110011010010101000100110010001101011100100010001110110001001011111010010101111010,MNBGDRVYNRFJIW-DYXWJJEUSA-N
CC(C)(C#N)C1=C(C=C(C=C1)NCC2CCC23CNC3)F,11A7715D5DB2CA44_C923914C6C39AE9E_6041_DP,7.975561,00000000100100000000000000000000000000000110000000000000000000000010000000100000001000110011000000001000010100001000001001000000110101110110001010010111010110101111010,XVDKAVOUGQRVGO-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC4CC3(CNC3)C4,CAABF9D6A50849C1_7C2B533AEF285188_6041_DP,7.685258,00000000100100000000000000000000000000100010000000000000000000000110000000000100001000110010000000101100010110001000000011000100100101110110001011000111010110101111010,IKUWTSSYCOICHT-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC(N3CC(C)OC(C3)C)C4=C(C=CC=C4F)F,395FBD66392AC8A5_DDC821026B2168DE_6041_UN,8.344004,00000000000000000000001000000000000000000010000000001000010000100100000000010001101101110001011110101000000110010001000011101100110011110110011011011111110111101111110,OSFGGVWVKFLNNE-UHFFFAOYSA-N
CC2OC1=C(C=C(C=C1C2=O)NCC4C3CCC(N3)C4)F,C2308853068A2109_E4C96CF6CA7EBD2A_6041_DP,8.169793,00000000000000000000000000000000000000000010000000000100010000000000000010000000101100010111000010001100110100010100001011000001110101110100001111010011111111111111110,OIWQLAVPJUYWQN-UHFFFAOYSA-N
CC1=C(C3=C(N1CCC2CCN(C)C2)C=CC=C3)C4=CCNCC4,23C27195884B5E49_1A8EDA536B982D94_6034_UN,8.113168,00000000000000000000000000000000000000000000000000100000000000100100000000011000001101100001010010111100110010010001101011100100110000000110001011011111010110101111010,JEDMBRGKCURMRK-UHFFFAOYSA-N
C[N]1N=CC(=C1F)NC2C4CCC2CC3=C(C=CC=C3)C4,BDF42C3CCCBB529D_14D18B5AD17996FD_6041_UN,8.3090105,00000000000000000001000000000000000000000010000000001000000000000100000000010001100100010011011010000100010100000000001011101100110001110100001010011011000010101111010,GMEVNPDGGCAMGJ-UHFFFAOYSA-N
C[N]1C=CC2=C1N=CC(=C2)NC3C4CC5CC3CC(C4)(F)C5,4E7013B136ECC265_EBD523254FFF4228_6041_UN,7.833578,00000000000000000000000000000000000000100010000000000000000000000110000000010101000101010010010010100100010100001000000011100100100001110100001001001001000010101111010,ODNVGJDQAFJJRP-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2C[C@@H]3CCO[C@H]3C4=C[N](C)N=C4)C5=CCNCC5,74B7D1ACAAB75843_ACD5E89B6842DE50_6034_UN,8.348591,00000000000000000000000000000000000000000010000000101000010000100100000000011000101101110001011011111100110101010000001011101100110010100110001001011011110111101111110,LXEQTTQAIPIYAP-KSFYIVLOSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC23CC(CN2)C3)F)CC4,2D24255A56258424_86B1F35AB1DD6C64_6041_DP,7.331427,00000000000100000001000000000000000000000010000000000010000000000010000000010001101101110011010010001000110110011001101011100000110101110110001010011011010110101111010,XDQQTSXSRCVZBD-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CC3)C4=C(C=CC=C4)F,CC1935A90D80123F_85FA31DEC6D46EF9_6041_UN,7.4914956,00000000000000000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100010001110100001010011011010110101111010,DEUQFGNDTUEPEN-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=CC(=CC=C2)C3=NC(=CC=N3)Cl)C4,480E3A262F27C546_6B3886F57F504B0B_6035_UN,8.242799,00000000000000000000000000000000000000100000000000000000000000100100000000100100100001110000010011101001010100000101001011100111110000100100001101011110110111101111110,VUUNGCDYFCBSIR-BDEJMISXSA-N
CCNC4CCC1=C(C3=C(N1CC2=C(N=C(C(C)C)C=C2)C)C=CC(=C3)Cl)C4,4AE1A05DE289F546_0CBDFC1DBAF2ECE6_6034_UN,8.048702,00000000000000000000000000000000000000000000000000000000000000000100000000110000101101010010000010101101110110010010101011100100110001100110011011011111010110101111010,WXVNTEJHGMIRGR-UHFFFAOYSA-N
CC1CCCCN1CC2=CN=C(C=C2)NC3=C[N](C[Si](C)(C)C)N=C3,4B3397811DC656F8_8F6D300AE7BB5625_6041_UN,8.168834,00000000000000000000100000001010000000100000000000001000000000000100000000110101100101100001011010101000000010011001101011101100110001010110011001011111010110101111010,BRXWWNYHCQZHMK-UHFFFAOYSA-N
FC1=CC(=CC(=C1)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F)C4(CC4)C#N,28BCB544D12857C8_4C0DE6E6AAE031B0_6041_DP,7.2890415,00000000000000000000001000000000000000000110000000000010000000100010000000000001001000110011000000101000100100011000001001000100110101110110001001010011010010100111010,OXBFELGQFSMBSA-WOJBJXKFSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=C(C=C(C=C2)Br)C3=CC=NO3)C4,F59F551FE768C3B1_A7B78498D547E403_6035_UN,7.886501,00000000000000000000000000000000000000000000001000000000010000100100000100100000000101110100011011001010010100000101001011101111110000100100001111011110110101111111110,DMZHLNRADJVGBV-LTGQISBOSA-N
FC1=CC=C(C=C1)C(CCC=CC3=C2COCCC2=N[N]3C)C4=CC=C(C=C4)F,BF6B888CCF79E371_55E1F70ADABD9F4B_7019_UN,8.144762,00000000000000000000000000000000000000000010000000001000010000000100000000010000100100110000011011110100010111010000001011101100110010100110001011011010010111101111110,YUXDGQBXAAXEAK-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)CCC2)NCC3N(C)CC4(CC3)CC4,1D675C00D942F827_D807F6165984C36D_6041_UN,7.29341,00000000000000000000001000000000000000000010000000000000000000000010000000010001001001110011010010101100010110011001101001100000110001110110001011011011010110101111010,XFJSMZPBNLUHHY-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2(CCCCC2)CC3=C(C=C(C=C3)F)F)C4CCCC4,01EA3F8735527D3C_DE3E0536ED6E7FD8_6041_UN,8.062518,00000000000000000000000000000000000000100010000000001000000000100110000000010101100100010011011010000000100100011000001011101100110001110100001011011011000110101111010,QRVQMKFBGROHOS-UHFFFAOYSA-N
CC1=CC(=C(C=C1)C)[C@@H]2CCCC[C@H]2OCC4=NC3=C(COCC3)S4,B5466117464E4A02_73EA7D0722B6F05D_6039_UN,8.057579,00000000000000000000000000000000000010000000000100000000010000100100000000000000010100101000000111100100010011010000001011000111110010000110000111010110110111011111110,IZNCMUVSDGSDET-QFBILLFUSA-N
CC1=CC2=C(C=C1)C(=CN2CC4(CC3=CC=C(C=C3)F)CC4)C5=CCNCC5,BDF70C89FED955D5_4A1C0EB36CFE37D0_6034_UN,8.2957535,00000000000000000000001000000000000000000010000000100000000000100110000000011000001101110001000010111100110100011000001011100100110000100110001001011001010110101111010,YTSUMHXNRHRTBT-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC4(CC3=CC=C(C=C3)Cl)CC4)C5=CCNCC5,A656606BF047B717_B972D2D21D6EC55B_6034_UN,8.295751,00000000000000000000001000000000000000000000000000100000000000100110000000011000001101110001000010111101110100011000001011100100110000100110001001011001010110101111010,CHTJGRRWWXVDGC-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C=CO2)NCC3CCN(C)C3C4=CC(=C(C=C4)Cl)F,9514F42D919C89D5_476DA9C7BE7AC9D0_7022_UN,9.007894,00000000000000000000000000000000000000000010000000000000010000100000000000010000101101110011010011001101010110010001101011100100110001110110001011011011110110101111110,ZIXOTKZJHNBEGO-UHFFFAOYSA-N
CCC1=C(C(=CC=C1)F)NCC2N(C)CC3(CC2)CCC3,785A97ED33932A09_7CC4316E092E9711_6041_UN,7.3572826,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011011101001100000110001110110001011011111010110101111010,JVYUHCTWQDCJPK-UHFFFAOYSA-N
CCC1=CC(=C(C=C1)CC)NC2C4CC3C2NCC3C4,09AD11253BDE3C49_B53B01B8AEC446D4_6041_DP,8.459393,00000000000000000001000000000000000000000000000000000010000000000000000000000001001100000011000010001100010000000010000001000000110101010100001011000111010110101111010,FVKJXWXMAGQCSD-UHFFFAOYSA-N
CC2CC1=C(C=CC=C1C2=O)NC3CCOC4=C3C=C(SC)C=C4,9954877D19662EC8_AED1D480C10AE8BA_6041_UN,9.0742,00000000000000000000000000000000000000000000000000000000010100001000000000000000010000001010010011100100110001010101001000000101000011010100000111010111111011111111110,FAZZJZUNDYMYON-UHFFFAOYSA-N
C[Si](C)(C)C1=C(N=C(C=C1)NCC3CN(CC2=CC=CC=C2)CC34CCOCC4)F,4FEE6D4914D6E047_97707B6850AF291B_6041_UN,7.7302814,00000000000000000000100000000010000000100010000000000000010000000110000000110100101101110011010010101000010101001000001011100100110011110110011011011111010111101111110,ICZOVJMHCOSNEG-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC4(CC3=C(C=C(C=C3)F)F)CCOCC4,DB90C1084AE4584B_C1CDAD2689D38E3F_6041_UN,7.9575014,00000000000000000000001000000000000000000010000000001000010000100110000000010001100100110011011011100000100101011000001011101100110011110110001011011011010111101111110,FWXVNLJWTOJZTE-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC4C5=C(OC4)C=C(C=C5F)F,1787A338DFFF5408_6F660C885AD4F618_6041_DP,8.893822,00000000000000000001000000000000000000100010000000000000010000000100000000000101100101010011010111100100110101010100101011100100110101110100001011011001110011101111110,RNGJRTHQGVJURI-HCSGYOBHSA-N
FC1=CC4=C(C(=C1)NC[C@@H]2CCCN(C)[C@H]2C3=C[N](N=C3)C)N=CC=C4,F3E45F2D2B7B76E9_65E5B6983076A459_6041_UN,8.259762,00000000000000000000000000000000000000000010000000001000000000100100000000010001101101110011011010101100010110010001101011101100110001110110001001011111010110101111010,YKLODBQFWINWHO-MGPUTAFESA-N
C(C2CCCC1(CC1)C2)=CC3=C[N](N=C3C4=CC=CC(=C4)C)C5=CC=C(C=C5)F,096C803177A78CF7_4F113C115D991033_7019_UN,8.114895,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011010000010101111010,GRYJYVFIZSFAQS-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(=O)C3=NC4=C(C=C3)C=CC(=C4Br)F,541D3EEACD4389E4_81D5366E896EFAEA_6038_UN,8.049067,00000000000000000000000000000000000000000010001000000000010000000100000000000001001100010001100110101100110100110000011011000100110010100100001011010011111111110111110,ZPQYGUQZXKCABI-UHFFFAOYSA-N
C[N]1C=CC2=C1C(=NC=C2)NCC3(CCOCC3)C4=CC=C(C=C4)F,DD2F4DD8B80292E2_2A6E7B8F1AF1D976_6041_UN,7.361611,00000000000000000000000000000000000000100010000000000000010000100110000000010101001101110011010010101100010101001000001011100100110011110110001001011001010111101111110,PKPIFNIJPPEBLG-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(=O)C3=NC4=C(C=C3)C=CC(=C4F)Br,325C2019FB92013E_5635AD75C00C1FF1_6038_UN,8.049065,00000000000000000000000000000000000000000010001000000000010000000100000000000001001100010001100110101100110100110000011011000100110010100100001011010011111111110111110,ABVPZDWXTVHSHS-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)N[C@H]3[C@@H](OCC3)C4=C[N](N=C4)CC5CC5,028FF7BB92CB46A3_3BBF3B5E7BDDB238_6041_UN,8.54655,00000000000000000000001000000000000000000010000000001000010000100100000000010001100100010011001111101100110101010000001011101100010011110110001011011011110111101111110,APZFETMGKUCEFU-NQIIRXRSSA-N
CC4(C)COC3(C[C@@H]2CC(OCC1=C(C=CC(=C1)C)F)C[C@@H]2C3)OC4,23F9708876E7C857_124439EC41CAA9E0_6039_UN,8.145538,00000000000000000000000000000000000000000010000000000000010000000010000000100000000000010100000010100100010111001001000010010011110010100110010111100110110101011011110,XCDMGGPSDCDKSJ-BYICEURKSA-N
CC1=C(C=C(C(=C1)NCC2CCCCN2CC3=CC(=CC=C3)Cl)Cl)C4CC4,70FCAF495B6B26D1_3A3FD293EECCA19B_7022_UN,8.072849,00000000000000000000001000000000000000000000000000000000000000100000000000010001001001110011000000101001000110010000001001100100110001110110001011011011010110101111010,BCEAPJZIFKZLQV-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)F)NC2CCN(C)C23CCCNC3)F,8F0DFB022060F3D9_E93848B07DCBBE16_6041_DP,8.210764,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101110011010010101000110110011001101011100000110101110110001011011111010010101111010,WOLRHXRZXJCOMU-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC3(C)CCC4(CC3)CC4,DB57D0757D48D54E_8DD6C8A18E372ED6_6041_UN,7.6122856,00000000000000000000001001000000000000000010000000000000000000000110000000010101001101010011010010001100011110001001101011100100110001110100001011011111010110101111010,MHFCSRNZPVQSCB-UHFFFAOYSA-N
ClC1=CC2=C(C=C1)N=CN(C2=O)C[C@H]3[C@@H](CNC3)C4CCOCC4,F816116B5B8396CC_4FE8DCE41757A80F_6034_UN,8.6725025,00000000000000000000000000000000000000000000000000000000010000100100000000010100101101110011100011101101010101100100011011100101110010100110001111011011011111110111110,WFZUXZHHHMALMA-BBRMVZONSA-N
BrC1=CC2=C(C=C1)N=CN(C2=O)C[C@H]3[C@@H](CNC3)C4CCOCC4,16E5DD68E182A023_6DCCF39060FE4351_6034_UN,8.672496,00000000000000000000000000000000000000000000001000000000010000100100000000010100101101110011100011101100010101100100011011100101110010100110001111011011011111110111110,FUWUNCDKAKRXRX-BBRMVZONSA-N
IC1=CC2=C(C=C1)N=CN(C2=O)C[C@H]3[C@@H](CNC3)C4CCOCC4,244B4C321CEC6BED_5665376628E2D7AE_6034_UN,8.67248,00000000000000000000000000010000000000000000000000000000010000100100000000010100101101110011100011101100010101100100011011100101110010100110001111011011011111110111110,FVGSOEUQRNSUSX-BBRMVZONSA-N
FC2=C1[NH]C=CC1=CC(=C2)NC3CCN(C)C34CCCNC4,DB122CA9CD668CF0_22FA084B4DE4807A_6041_DP,8.175215,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,GQCWTYRZGIVLFJ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N=CN(C2=O)C[C@H]3[C@@H](CNC3)C4CCOCC4,FBFEA4359B642F86_333CB8751065785A_6034_UN,8.672387,00000000000000000000000000000000000000000010000000000000010000100100000000010100101101110011100011101100010101100100011011100101110010100110001111011011011111110111110,KAKJXCPQOOXEIJ-BBRMVZONSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)NC[C@@H]4CCN(C)[C@H]4C5=CN=CC=C5)F,1DC1E9BB4F7DACD9_679A9874DBB05F93_6041_UN,7.6327505,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101100010110010001101011100100110001110110001011011111010110101111010,JOAXGRYDAIIMTL-BVZFJXPGSA-N
N(C1=CC2=C(C=C1)COCC2)[S](C4=C(F)C=C3[NH]C=CC3=C4)(=O)=O,F00F31D8E01389E3_AD91C9E85EEE4B2B_6029_UN,8.534713,00000000000000000000000000000000110000000010000000010001011111001101010001000000010100111001001010100110011101001000011011001100111111111110001011111011010011110111110,DSXAMZPMYIHEPE-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)COCC2)[S](C4=C(Cl)C=C3[NH]C=CC3=C4)(=O)=O,89764FA7A393072D_308F9DA9E141A529_6029_UN,8.534714,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100111001001010100111011101001000011011001100111111111110001011111011010011110111110,XSUFRSDQZKPHFP-UHFFFAOYSA-N
FC3(F)CC(C=C[C@@H]1CCO[C@H]1C2=NC=C[N]2C)(C3)C4=CC=CC=C4,474E5A0DBB66C3A5_26717161830E7D49_7019_UN,8.151747,00000000000100000000000000000000000000100010000000000000010000100110000000010101000101010000010110010000000101001000001011100100000010100100001010011010110011101111110,ITGALCDIDJWHHJ-NVXWUHKLSA-N
CC(C)(C)C2=CC1=C(C=CC(=C1)F)[N]2CCC3OCCNC3,5ABD03C1D6827760_AC7A82CD054C8547_6034_DP,7.815508,00000000000000000000000000000000000000000010000000000000010000000110000000110000001101110011000111101100110111011000001011100100110010100110011011011111110111101111110,ZECARQQLUAQFBW-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=CC2=O)C[C@@]34CCCN[C@H]3CCCC4,F037809B3767B591_C764A11FAA924FE2_6034_DP,8.426721,00000000000000000000000000000000000000000000001000000000000000000110000000010000101001010011000001101100110100011100001011100101110000100110001101011001111110100111110,OFBSIGZHEYBAHN-RBUKOAKNSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(C4=C(N=CC(=C4)C)F)=O,85732BDD00F30FB9_82804078BD1272FB_6038_UN,7.971405,00000000000000000000000000000000000000000010000000000000010000000100000000000000100100010001100011100100010100100000011011000100000011110100001011010011101011111111110,QEIAHTYMUCBWCH-UHFFFAOYSA-N
CC(C)CC1COCCC1OCC4CC2(CC3(C2)OCCO3)CO4,E75F962C624DEE0B_A61E220766965D56_6039_UN,6.898484,00000000000100000000000000000000000000000000000000000000010000000010000010100000000100100100000010100000010011001001001010010011110010000110100100110110110101011001110,FPUMJDPMLRHWND-UHFFFAOYSA-N
FC2=C(C=C1C=COC1=C2)NC4CCC3(CCN(C)CC3)CC4,D02A96B15A683F03_4900B4FAA94C38F3_6041_UN,7.623312,00000000000000000000000000000000000000000010000000000000010000000010000000010000000101110010010010101100110100011001101011100100110001110110001011011011110010101111110,LVCPLXRJKVTWEM-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CN(C2)C3COC3)F)CC4,5CBCCFB7785A2F39_7D0F53488FD8DEC9_6041_UN,7.613046,00000000100100000001000000000000000000000010000000000000010000100000000000010001101001110010010100001000000111010001101011100000110001110110001010011011010111101111110,WKYAHGUHGYSFSZ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,9BE36E13CCEC2768_D26881AF6681D981_6041_UN,8.673072,00000000000000000000000000000000000000100011000000000000000000100100000000010100101101110011010010101100010110010001101011100100110101110110001001011011010110101111010,YOHSTAFBTYXCAT-KXBFYZLASA-N
FC2=C(C=C1OC=CC1=C2)NCC4(N3CCN(C)CC3)CCCCCC4,A5FF9FFD9F30B6D9_616098B172FD4088_6041_UN,7.4913,00000000000000000001000000000000000000000010000000000000010000100010000000010001001101110011010011101100010100011001101011100100110001110110001011011011110110101111110,GRGUECAPLIGQHZ-UHFFFAOYSA-N
ClC1=CC=C(C=C1)C2=COC(=O)N2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,6A53B7282A07E20D_1D7E857876CF7531_6034_UN,7.9620733,00000000000100000000000100000000000000000000000000000000010000100110000000110000000101010000000110001001011110111100111011110101110000100100000111011110011110111111110,XDQUDWOETCULKR-YSVLISHTSA-N
C2(=C1C=N[N](C1=CC=C2)C3CCCCO3)NC4=CN=C([Si](C)(C)C)C=C4,41D1F1853E9EA72F_CCEB54B9B462CC9A_6041_UN,7.5454645,00000000000000000000100000000010000000000000000000001000010000100100000000110001100100100000111110100100010001111000011011101100110011010100011001011101010011101111110,OCEUZWQQAIMPIM-UHFFFAOYSA-N
BrC1=CC=C(C=C1)C2=COC(=O)N2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,B626D77EF4B0D36C_C249EE4DE7FF1A90_6034_UN,7.9620595,00000000000100000000000100000000000000000000001000000000010000100110000000110000000101010000000110001000011110111100111011110101110000100100000111011110011110111111110,OWVVKDBLPNELIH-YSVLISHTSA-N
C(C1CC2CCC1CC2)=CC4=CC3=C(C=CC(=C3)C)N=C4Cl,2EF2902C8B9C1A59_6420825BEB08D6BE_7019_UN,8.534235,00000000000000000000000000000000000000000000000000000000000000000100000000000000000000010000000000110101010100000000001001000100110000100100000011010010000010001111010,KOHOOPHFQZOVKC-UHFFFAOYSA-N
FC1=CC=C(C=C1)C3=CC2=C(C=CC=C2)N3C[C@]4(C)COC[C@@H]5CCCN45,16C88F0AF182B29E_97A7E3464CAF7CAE_6034_UN,8.365134,00000000000000000000000000000000000000000010000000000000010000100110000000010001000101110000000111101100010111011001101011100100110000100110001011011010010111101111110,ZHYRRHWVNWHVTD-NZQKXSOJSA-N
CC1=C(C=C(C(=C1)NCCN2CCCC(C)C2)Cl)C3CC3,BB542B3DF64BE4EA_958A9EB05F6843F9_7022_UN,8.158234,00000000000000000000001000000000000000000000000000000000000000100000000000010001001001110001000000101001100110010001101001100000110001110110001011011111010110101111010,RQQNTFCPGOBSRX-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC4(CCCCC4)C5=C(C(=CC=C5)F)F,77B6C0507B6EEB1B_2CC7EEB01E8963F5_6041_DP,8.081382,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010010101111010,JZMJXZJZZVOJNE-YLQYIJTPSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NC(C)[CH]3C[C]4(C3)C[CH2]C4)C,42A30D5EEB484CB1_CBDE92182723EB6B_6041_UN,8.162945,00000000000100000000000000000000000000000010000000000000000000000110000000000000100000010010000000100100010100001000101001000100110001110100011011010111000010101111010,CYYLHWQSOVTZSE-UHFFFAOYSA-N
FC1=CC2=C(C=C1)OC(=N2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,100CE07F7E194E82_F1F4A0A4E3ACC3F7_6041_UN,8.772284,00000000000000000000001000000000000001000010000000000000010000100100000000010101101101010011010110101100011100110000011011100100110001110110001011011011110110101111110,DGWKGHNQFIAJKN-YJYMSZOUSA-N
CC1=C(C=CC(=N1)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F)C#N,6651CCA01E7EB144_6E127B41A56CE078_6041_DP,7.2219543,00000000000000000000000000000000000000100110000000000010000000100100000000000101101000110011000000101000100100010000001011000100110101110110001011010011010010101111010,ZUEJQSUIHJOKSG-IAGOWNOFSA-N
FC2=C(C=C1C(=CN(C1=C2)CC3CCNC(C)(C3)C)CC#N)F,BABB9CD21ADCB5B0_3D7F660F6E0290ED_6034_UN,8.525362,00000000000000000000000000000000000000000110000000000000000000000110000000110000001101010001000010101100110110011001101011100100110000100110001011011111010110101111010,LDBNFRDPSOGCSP-UHFFFAOYSA-N
O(C3CCC1=C(C2=C([NH]1)C=CC(=C2)Cl)C3)C4=CC=CC=C4[S](C)=O,E3A3865B9CF4DB01_B7930E7DB284EA77_6003_UN,8.219432,00000000000000000000000000000000000000000000000000010000000111001101000001000000010100011111010010000111110100010100001001001111110010100100000111011011100011011111110,NJMMIERBDWOJCI-UHFFFAOYSA-N
CN5CCCN(CC1=C(C=C(C=C1)NC[C@]23C[C@H]2COC34CCC4)F)CC5,494C223002D2CCE5_8B2F964A0C61F5E9_6041_UN,6.9602637,00000000000100000001001000000000000000000010000000000000010000000010000000010001101101110011010011101000010111011001101011100000110011110110001011011011110111101111110,LRHTVBZZBUTWGJ-GHTZIAJQSA-N
O(C3CCC4C1CC(C2OC12)C34)C7=CC=C(C5=NC6=C([N]5CC)C=C(C=C6)Cl)C=C7,5C5F2081CDDC8844_56F111C5F9BEB0AE_6035_UN,8.66638,00000000000000001001001000000000000000100000000000000000010000100100000000010101000101010000000010101101010100000110001011100111110010100100001111011010110111111111110,HKRJAGUAXQKIPO-UHFFFAOYSA-N
CC(CNC(=O)CC1CC2CCC1O2)C3=C[NH]C4=C3C=CC(=C4)F,CAC84FC6A7C292BE_8B2F4B75955EC594_6038_UN,7.6975584,00000000000000000000000000000000000000000010000000000000010000000100000000000000001100010001100010001100110100110001011011000100110110100100001001010001111111111111110,WJIHATXQHSSZLG-UHFFFAOYSA-N
C[N]1N=C(C(=C1)C3=C2OC=CC2=CC=C3F)C4NCCCC4,B608C4416B0242BA_F0403EE708F8B55B_6005_UN,8.742906,00000000000000000000000000000000000000000010000000001000010000100100000000010001101100010011011010101100110100010000001011101100110000100100001011011011110010101111110,HFQBWNCRJDEKJT-UHFFFAOYSA-N
C2(=C1CCOCC1=CC=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,8B43D582A6FC3BF3_4575F62BF33C056C_6041_UN,8.119098,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011010010101100110111010001101011100100110011110110001011011011010011101111110,LJPZRBHSUXVJBT-UXHICEINSA-N
N4C[C@@H]1COC[C@]1(C=CC2=C(C)[N](C(=C2)C)C3=CC(=CC=C3)F)C4,21A358E5E9D189CD_D61308CEEADE2D4B_7019_DP,8.549672,00000000000000000000000000000000000000000010000000000000010000100110000000010000001101110011000011011100010101001000000011100100110001110110001010001111010011101111110,UKAYZOAWGJANNE-XLIONFOSSA-N
C(C1CC2CC1C3CC23)=CC4=C[N](C)N=C4C5=CC=C(C=C5)F,95426B99DD679BE1_82F1A1A345CF954A_7019_UN,8.243413,00000000000000000001001000000000000000000010000000001000000000100100000000010000100100010000011010010000010100000000000011101100110000100100001011001010000010101111010,JILBXHZCNDDYAG-UHFFFAOYSA-N
CN1C(CCCC1)C=CC3=CC=C(C2=C(F)C=CC=N2)O3,3F17B9E2FA69BD0B_1D1EC7C5D85F1367_7019_UN,8.4954195,00000000000000000000000000000000000000000010000000000000010000100100000000010000000101110000010110111000000110010001101011100100110000100100001011011010110010101111110,XKSNEVARHQSTDH-UHFFFAOYSA-N
N3CCCC(CC=CC2=CC1=CC=CC(=C1O2)CC)C3,13913625B0DBD13B_FBE421B768860CCD_7019_DP,8.202526,00000000000000000000000000000000000000000000000000000000010000000000000000000000001100100011000010111100110000010010001011000100110000000110000001010001110100101111110,SIXNMQIEGUTRNY-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(=O)CC3=C(C=CC(=C3)F)F,FCB870143C226955_30587C7DBB9A67F0_6038_UN,7.3916197,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010001100010001000110100110000011000000000110010100000000011010011011110100111110,IRLOVSIPIADGBF-UHFFFAOYSA-N
N4CCC1(CCCC1C=CC2=C(Cl)[N](C(=N2)N(C)C)C3=CC=CC=C3)CC4,EADDE7E0D6D8A8EC_C8B88EC6A03045AB_7019_DP,7.1864862,00000000000000000000000001000000000000000000000000000000000000100110000000110101001101110001010010111001111100011000001011100100110001110110001011011111010010101111010,XSRFRQGSXVXECQ-UHFFFAOYSA-N
CC1=N[N](C(=C1)NC2=C(C=C(C=C2)C35CC4CC(CC(C3)C4)C5)Cl)C6CCCCO6,6D4A8833511375AA_F3814247390D3982_7022_UN,7.5242224,00000000000000000000000000000000000000100000000000001000010000100110000000010101100100010001101111100101010101111000011011101100110011110100001011011011010011101111110,LGCVGIIZYFDNBQ-UHFFFAOYSA-N
N(CCN1CC2C(C1)C3CCC2C=C3)C(=O)C56CC4(F)CC(F)(CC(F)(C4)C5)C6,AC46420AD7362EA2_72FB36C6BCBA42D6_6038_UN,7.522993,00000000000000000000000000000000000000000010000000000000000000000010000000010001001101110011100010011100110100111000011001100000110000100110001001011001011110100101110,BALDDJDZJXQAFM-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4=CC(=CC(=C4C)F)F,9C09F914710E7CE0_DFD99755466FED35_6041_DP,8.39257,00000000000000000001000001000000000000100010000000000000000000000100000000000100100101010011010010100000111100010000101011100100110101110100001011011111000010101111010,ZEXJACJCYVLHRU-QDMKHBRRSA-N
CCC4CCC1=C(C3=C([N]1CCC2CCCNC2)C=CC(=C3)C)C4,DB868B9057A68071_3C122584F9159895_6034_DP,8.547782,00000000000000000000000000000000000000000000000000000000000000000100000000010000001101100011000010101100110010010010101011100100110000000110001011011101010110101111010,ITGWCOKQKGIVIW-UHFFFAOYSA-N
N(CCC1=CC2=C(C=C1)OCC2)[S](C4=C3[NH]C=CC3=CC=C4)(=O)=O,FE8DA95078D3BA80_DA932E5970753A10_6029_UN,8.786748,00000000000000000000000000000000110000000000000000010101011111001101010001000000111100001000001011001110111001011100011011001100101110001110001011111001110111110111110,WQPVYWFBWXXEHS-UHFFFAOYSA-N
FC2=C1C=C[NH]C1=CC=C2NC4CC(C3=NC=C[N]3C)OCC4,1EB593BBF462D2C1_D351A487BF29FC3B_6041_UN,7.898191,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010010010111100100110111010000001011100100110111110100001011011011110011101111110,FWDNKPRNKAIIOT-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)C[C@@]34CCN(C)C[C@H]3CNC4)Cl,7882DC0E36033619_8D1BB604407267C2_6034_DP,8.070241,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101111011010010101101011110011001101111100100110101110110001011011111010110101111010,CCIVMEROTVNFAP-UZLBHIALSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3(CC3)C4CCCCC4,0F9AB2F111F1A276_0B536CF09D516952_6041_UN,8.042053,00000000000000000000001001000000000000000010000000000000000000100110000000010101000101010011010010000100111100011000001011100100110001110100001011011011000010101111010,WZMFDDRCXFPUFG-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NC2=C3C(=CC=C2)CCCO3,2437272D6C27264F_F86388509988BC6B_6041_UN,7.9368925,00000000000000000100100000000010000000000000000000000000010000000100000000100001000000100001010100100100010001001100001011000100100011010100011011011101110011101111110,MYLSFQJMTKDYGH-UHFFFAOYSA-N
CN(CC1CCNC1)CC2=NC=C(N=C2)NC3C(C)OC4=C3C=CC(=C4)F,5FEB34520DB3B201_6F0FF5178FA85F80_6041_DP,8.22864,00000000000000000000000000000000000000100010000000000000010000000100000000000101101101110011010111101100110110010101001011100100110101110110001011011111110111101111110,RUKFUOBKUDJLMJ-UHFFFAOYSA-N
CC1=C(C4=C(N1CC23CC(C2)OC3)C=CC=C4)C5=CCNCC5,42A698A3C343B093_3B09FCB185CB52AA_6034_UN,8.458081,00000000000100000000000000000000000000000000000000100000010000100110000000011000001101100001000011111100110011011000101011100100110010000110001011011011110111101111110,NIUNYCXDUVIJPA-UHFFFAOYSA-N
CC1=C(C3=C(N1CC2(CF)CCC2)C=CC=C3)C4=CCNCC4,6F05537A4F72B60D_F0981A5548227F57_6034_UN,8.389977,00000000000100000000000000000000000000000010000000100000000000100110000000011000001101100001000010111100110010011000101011100100110000100110001011011011010110101111010,LMXUDMINPLIFHP-UHFFFAOYSA-N
CC(Cl)C2=NC1=C(C=CC(=C1)Br)[N]2CCC3CNC(C3)(C)C,18E2E506FF9B0115_3A44A1DE392ED99F_6034_DP,8.602827,00000000000000000000000000000000000000100000001000000000000000000110000000110101001101010011000010001101110110011001101011100100010000100110011010011111010110101111010,BXVYIQGTOZSNBE-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3CNCCC3)CC4(CCNC4)C5=CC(=CC=C5)F,8406A3DA85F4D22A_96CE21BB03B4B464_6034_UN,7.8416514,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101110011000010101100110100011000001011100100110100100110001011011011010110101111010,IXVJCPSGPFYQQA-UHFFFAOYSA-N
FC1=CC2=C(C=C1)[NH]C(=C2)NC4C[C@H]3CCC[C@H](N3C)C4,D1DA4611007CC613_A4E753753C244C8C_6041_UN,8.02145,00000000000000000000000000000000000000100011000000000000000000000100000000010100100101010001010010100100110110010000101011100100110101110100001001011001000010101111010,YVBANSFTQWKNEB-GOOCMWNKSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=C(C=C(C)C=C1F)F)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,1DC1CC0098E5A55B_6112D9556AD5889A_6035_UN,9.160913,00000000000000000000000000100000000000000010000000100000000000100110000000001000000000010000000010110100010110001101101001000111110010100100010111010110100001001111110,CNCOJXYWRBKLTG-OJSVXTFUSA-N
CC4(C)CCC1=C(C=CC(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)O4,315648DC1F59E0AB_44162259E6C4A42C_6041_DP,7.570302,00000000000000000000000000000000000000000010000000000100010000100010000000100000101000110011000000101100110100011101101011000100110111110110001011010111110111101111110,HEJNLJGZQWSSRT-GHTZIAJQSA-N
CC2=C1CCCC1=CC(=C2)NC3=CC=C(CC[Si](C)(C)C)C=C3,0A01785BF76BF869_52D64D72805386EA_6041_UN,7.795761,00000000000000000000100000000010000000000000000000000000000000000000000000100000000000100001010010000100010010001001101000000100010001010000010011011101010110101111010,AVSTVJMVEMLJBM-UHFFFAOYSA-N
NCC(C1=CN(C2=C1C=CC=C2)C[C@@H]3CNC[C@H]3C4=CN=C[N]4C)C5=C(C=C(C=C5)Cl)Cl,3C9494297F955BF3_B44BB39BF7607CC9_6034_UN,7.926496,00000000000000000000000000000000000000000000000000000000000000100100000000010101101111110011010010001101010110000000000011100100110100100110001011001011010110101111010,VEDGDZWDIOLFQA-RBEDQOGGSA-N
FC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCC3)CC4[C@@H]5CNC[C@H]45,7E9148361E7EE820_0CD658C032BACAB9_6034_UN,8.953559,00000000000000000000001000000000000000100010000000000000000000100100000000010101001101110011000010101000110100010000001011100100110100100110001011011011010110100111010,JQQUXIUXEJHNPD-RYTJFDOTSA-N
FC1=CC(=CC=C1)C2=C[N](C(=N2)C3NCCC3)CC4[C@@H]5CNC[C@H]45,7E9148361E7EE820_F65B45C09A2E507E_6034_DP,8.953558,00000000000000000000001000000000000000100010000000000000000000100100000000010101001101110011000010101000110100010000001011100100110100100110001011011011010110100111010,JQQUXIUXEJHNPD-RYTJFDOTSA-N
FC2=C1C=CC=CC1=C(N=C2)NC3CCN(C)C34CCCNC4,FD3F57DE030C02FC_4427AD7E2A4BB37C_6041_DP,8.201829,00000000000000000000000000000000000000100010000000000100000000000110000000010101101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,XCDFYYWTVWSACS-UHFFFAOYSA-N
BrC2=C1N(C3=C(C1=CC=C2)CCC3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,B457B74FDB74A256_25EEEED10245525D_6034_UN,8.473729,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,KEKHASLUEKVIJC-MWTRTKDXSA-N
CC2=CC1=C(C(=CC(=C1)Cl)Cl)N2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,CBFE52118AC3C579_7DEA02C35474947C_6034_UN,8.43277,00000000000000000000001000000000000000000000000000000000000000100100000000010101100101010000010010101101010100010000101011100100110001100110001011011110010110101111010,NZSQVGGOAKMXLA-QRQCRPRQSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NCC4(CCCC4)C5=C(C=CC=C5F)F,A4F189C409BCF3DE_346D431ADE36C326_6041_DP,8.066354,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000010110001000001011100100110101110110001011011011010110101111010,MHKWQDWBCBTESJ-YLQYIJTPSA-N
FC1=CC2=C(C=C1)N=CC(=C2)NCC3N(C)CC4(CC3)CC4,FCEBDDCA35044704_9328425FDE5A711B_6041_UN,8.304405,00000000000000000000001000000000000000000010000000000000000000000110000000010001001001110011010000101100010110011001101011100100110001110110001001011011010110101111010,NFSNMBYOGSRGEC-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3CC4CCCC(C3)C4,6167E0698D88C814_B9C68DD1D6C550C8_6041_UN,8.531191,00000000000000000000000000000000000000000010000000001000000000000100000000010000100100010001011010000100110100010000001011101100110001110100001001011001000010101111010,KHWLHEYWTHEFBM-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(CC3)C4CCC4,0E727D1DE542539C_78B17E28FEB12E46_6041_UN,7.608903,00000000000100000000001000000000000000100000000000000000000000100110000000000100001000000011000000101100010010001000001001000100110001010100011011010111010110101111010,HRPUAGOLOWPPBO-UHFFFAOYSA-N
CN(CC1CNC1)C2=NC(=NC=C2)N[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,1FE1C928743C27F8_A01E05032A077B0B_6041_DP,8.283426,00000000100100000000001001000000000000100010000000000000000000100100000000000100101001110010010000101000101110010001000011100100100101110110001011001011010110101111010,NVDOVECTXBGHQG-IUODEOHRSA-N
FC1=C(C=CC=C1)C2=C[N](C(=N2)C3CCCN3)C[C@@]45CCN(C)C[C@H]4CNC5,D71E891EDF5221B4_E77D0F575355A77B_6034_DP,8.286645,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101110011010010101100110110011001101011100100110100100110001011011011010110101111010,XCFCERRBSHCJQF-QXGTWOLJSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NCC2(CCNCC2)C3=C(C=NC=C3)F,A68050D828EEDC86_DD1EDC65D5263E73_6041_DP,7.6831284,00000000000000000000100000000010000000000010000000000000000000100110000000100000001000110011010000101000100100011001001011000100110101110110011011011111010110101111010,BAUAUFUWKYAJFM-UHFFFAOYSA-N
CC1=C(C4=C(N1CC3(CC2=CC=C(C=C2)F)CCNC3)C=CC=C4)C5CCNCC5,0607D00BFF6B2C63_C2DED647C601A478_6034_UN,8.5865755,00000000000000000000000000000000000000000010000000000000000000100110000000010000101101110011000010101100110110011000101011100100110100100110001011011011010110101111010,YOGTXFLHRJLJAP-UHFFFAOYSA-N
CN(C)CC[N]1C=CC2=C1C=C(C=C2)NCC3(CC3)C4=C(C=CC=N4)F,084E9D5DE18EEC5B_87F2C907EEC48DCE_6041_UN,8.007888,00000000000000000000001000000000000000000010000000000000000000100110000000110001101101110011010010101100010100011001101011100100010001110110001011011111010110101111010,PTXXURSAHWMLPY-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C=C(S2)NCC3CCN(C)C3C4=CC(=C(C=C4)Cl)F,B978D162FCCABE0D_1A3DFD6B71E907FA_7022_UN,8.111547,00000000000000000000000000000000000010000010000100000000000000100000000000010000111101111011010010001101010110010001101011100100110001110110001011011111010110101111010,MIVBEJFQDQNBCW-UHFFFAOYSA-N
O[C@H](CCl)C1=CC=C(C=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,0AAFD073D5AD5318_635CD5F0981385D6_6041_UN,8.52952,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101000011010010101001100000010000001011100100110111110111001011011011110111101111110,GAYTWMYALSRODA-HBGVWJBISA-N
COC1=CC(=C(C=C1)Cl)NC24CC3CC(C2)CC(C3(F)F)C4,1746D90345062A87_95CEE9960617DC18_7022_UN,8.283455,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010001010001000101110100011100000000000011100001110000000111000011100011101111110,HCLXFVJBGVSYOJ-UHFFFAOYSA-N
FC2=C1CCCC1=CC(=C2)NCC3CCN(C(CC)C)C3,5D970FEAD7322529_ABAB73C02E0D90E1_6041_UN,7.423698,00000000000000000000000000000000000000000010000000000000000000000000000000010000101101110011000010001100010110010011101001100000110001110110001010011101010110101111010,QERCYEJVAMSQKD-UHFFFAOYSA-N
C[N]1C=CC2=C1C(=NC=C2)NCC(N3CC(C)OC(C3)C)C4=C(C=CC=C4F)F,6ED0EE383B72D7AF_0AD347A1E0E5B5C1_6041_UN,8.547397,00000000000000000000000000000000000000100010000000000000010000000100000000010101001101110001010110101100010110010001000011100100110011110110011011001111110111101111110,TWGLCJAOFZIPDD-UHFFFAOYSA-N
N(CCCC1=CC2=C(C=C1)OCCO2)C(C4CC3CCC(N3C)C4)=O,BAFAF362AA0F14F0_DCDB9312EB753E08_6038_UN,7.969692,00000000000000000001000000000000000000000000000000000000010000000000000010010000001101000010110010101100110011110100111011100000110010000110001011111001111111111111110,YDNOABRGBSHBIX-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3CNCC34CCNCC4)Cl,6B8DDB0732B43454_B4FBCC8E42247766_6034_DP,7.483634,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101111011000010101001111110011000001111100100110101110110001011011011010110101111010,NDXRXZVWJYGHEG-UHFFFAOYSA-N
CN(CC1CCNCC1)C2=NC(=NC=C2)N[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,A13D583272280304_3DEA3E08140B4917_6041_DP,8.409708,00000000000000000000001001000000000000100010000000000000000000100100000000000100101001110011010000101000101110010001001011100100110101110110001011011011010110101111010,AXTDNLUTCPRTGT-RHSMWYFYSA-N
FC2=C(C=C1C(=CC=NC1=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5)F,22C7E4726DAAC0F6_821E0C676860759D_6041_UN,8.79437,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,BOODPROFMVPQMN-PEBXRYMYSA-N
CCNC5CCC1=C(C4=C(N1CC(N2CCNCC2)C3=CC(=CC=C3)Cl)C=CC(=C4)Cl)C5,E1F31977F6EFBA07_C4AC3CA4D3B86E8A_6034_UN,8.360223,00000000000000000000000000000000000000000000000000000000000000000100000000010001001101110011000010101101110110010010001011100100110101100110001011011001010110101111010,JNRXUZHQXGOEKF-UHFFFAOYSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)C[C@H]3NCC4(C3)CC4,70CF822DF787EA51_E4466F00E9B00A9F_6034_UN,8.550248,00000000000000000000001000000000000010000000000100000000000000100110000000010111011101011011000010001001111100011011000111100100110001110110001010011111010110101111010,FTFSDMAZCKXYMH-JRZJBTRGSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NCCOC2CCCCO2,DB74A76F59654107_C2D4889CC6321097_6041_UN,8.449235,00000000000000000100100000000010000000000000000000000000010000000100000000100001001000100000010100101000100001011000001011010011110011010110011101011101010111111111110,TZTMHRUMCZAZLN-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CCC3=CC(=C(C=C3)Cl)Cl,B4AA3453F183DA64_2E4A94FEA60603A2_6038_UN,7.4885116,00000000000000000001000000000000000000000000000000000000000000000000000000000000000000010011100010000001110100110000011000000000110011100000000011010011001110100111110,MSBOOIYMDAGYGP-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CCC3=CC(=C(C=C3)Br)Cl,E92986830F822CD3_541309EB65F54AEA_6038_UN,7.488507,00000000000000000001000000000000000000000000001000000000000000000000000000000000000000010011100010000001110100110000011000000000110011100000000011010011001110100111110,CPSNKALLALSVBZ-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CCC3=CC(=C(C=C3)Cl)F,7B8C8A22DB364381_3F172F77336C48F9_6038_UN,7.4885015,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000010011100010000001110100110000011000000000110011100000000011010011001110100111110,RQFIRKQETMMCDR-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CC4CCC3N(C)C4,E37793B9A63DD0A0_25CE121B8469BC43_6041_UN,7.8720784,00000000000000000000000000000000000000100010000000000000000000000100000000010100101001110011010000101100010110010001101011100100110001110110011011011111010110101111010,ZJUDQYFFLYJZQN-UHFFFAOYSA-N
C1(=C(C=CC(=C1)F)OC2CCCCC2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,223A9D8A9C4950C3_AEA4F176EDAE41C0_7022_UN,7.947818,00000000000000000000000000000000000000000010000000000000010000100000000000010000101001110001010100101000000111010101101011100111110011110110001111011011110111111111110,QHIFTGFRAMJICH-ZEQRLZLVSA-N
FC2=C1C=CC=NC1=CC=C2NCC3N(C)CC4(CC3)CCC4,3E80B225883A7A7D_AD359BC8497B10F3_6041_UN,7.705036,00000000000100000000000000000000000000000010000000000000000000000110000000010001001001110011010000101100010110011001101011100100110001110110001011011011010110101111010,XSIYMMLQEJXQMO-UHFFFAOYSA-N
C[N]1C=NN=C1C2=NC=C(C=C2)NCC34OC(C)(C)C(C3)C4,DD7F3DD06A897E50_7283FC5D329DCBFC_6041_UN,7.6517043,00000000000100000000000000000000000000100000000000001000010000100110000000110101101101000010011110101000010010001000100011101100100011010100011010001111110111101111110,VEFLPFWMUJGQET-UHFFFAOYSA-N
CC1=CC=C(C#N)N1C[C@H]2[C@@H](CCNC2)C3=CC=C(C=C3)F,B768082BE7DD679C_9FA4D1B96A3B3824_6034_UN,7.901344,00000000000000000000000000000000000000000110000000000000000000100100000000010001101101110011000010101000100100010000101011100100110000100110001011011011010110101111010,RKEKGUZKYKCQKD-YJBOKZPZSA-N
N(CC1C2CCC(C1)C2)C(=O)CCC3=C(C=CC=C3F)F,1F8C3B1655C2BFD1_5E5BB1FDC7C3954A_6038_UN,7.480237,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001000110100110000011000000000110010100000000011010011011110100111110,TVVFCHDCNFWKTM-UHFFFAOYSA-N
ClC1=C(C=C(C=C1)CCCC=CC2C(CCNC2)(C)C)Cl,6332ED6DFD3F0BE3_D84A6EBB073614A0_7019_DP,8.7968235,00000000000000000000000000000000000000000000000000000000000000000010000000100000001000110001000000111001100100011001101001000000110000100110000011010111010100101111010,KCDQMVCGOXAGHJ-UHFFFAOYSA-N
O(CC1(CC=C)CCOCC1)CCC2N(C)CCCC2,62138731D91FFDBF_C3C98015B50A3405_6039_UN,7.23407,00000000000000000000000000000000001000000000000000000000010000000010000000010000000001100000010001111000000011011001101011100010110010000110000001011010010111111101110,WBJNMSYVTBKSCS-UHFFFAOYSA-N
FC1=CC2=C(C(=C1)F)C(=C(C#N)C=N2)NCC4OCC3(CCNC3)C4,523A41C24EE2865B_30D9B8CCFFD72288_6041_DP,8.203881,00000000000000000000000000000000000000000110000000000000010000000110000000000000101100110011000111101100110101011000001011000100110111110110001011010011110111100111110,GNZNTXQKNCMYFH-UHFFFAOYSA-N
C[C@@H](OCC3CCC1(CCC2(CC1)OCCO2)O3)C4=C(C=C(C=C4)F)C,7A4606950874C2C7_C25E507DC69F3C88_6039_UN,7.522729,00000000000000000000000000000000000000000010000000000000010000000010000010000000000100010000000010000000010101001000101010010010110010100110100011110110110101011011110,XGOGNVLLGFVZFD-PYUWXLGESA-N
CCC4CCC1=C(C3=C(N1CC[C@H]2CNCC2)C=CC(=C3)C)C4,82E914257553194D_D8A86C8B7F067091_6034_UN,8.70221,00000000000000000000000000000000000000000000000000000000000000000100000000010000001101100011000010001100110010010010101011100100110000000110001011011101010110101111010,YHFLLLPJLKHBJQ-DJNXLDHESA-N
C[N]1N=C(C=C1N[C@H]2C3=C(OC(C)(C2)C)C=CC(=C3)F)C4CCCC4,6F4E387CC7C51ACC_61599852BDEEB440_6041_UN,8.432541,00000000000000000000000000000000000000100010000000001000010000100110000000110101100100010000011011100100110100011101001011101100010011110100011011011111100011101111110,IHPWFZRUIHONOZ-QGZVFWFLSA-N
FC2=C1CCCC1=CC(=C2)NCC3=C(C=N[N]3C)C4CC4,50D595613B0E1094_0640FFFBB21433D5_6041_UN,7.798027,00000000000000000000001000000000000000000010000000001000000000100100000000010001101100010001011010001100010100010000101011101100110001110100001010011011010110101111010,UJWCPPSYCOUGSY-UHFFFAOYSA-N
C[N]1C=CN=C1C(NC(=O)CC2CC3CC2C4CC34)C5=C(C=C(C=C5)F)F,CC038A6DCC6957D8_244714C29780F898_6038_UN,8.186527,00000000000000000001001000000000000000100010000000000000000000000100000000010101000101010001110010000000110100110000010011100100110010100100001011001011001110101111110,YQMPYSUWGIRMOB-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NCC3N(C)CC4(CC3)CCC4,3448424E9845189B_72A6C2718BB233F0_7022_UN,7.249584,00000000000100000000001000000000000000000000000000000000000000100010000000010001001001110011010000101001010110011001101001100000110001110110001011011011010110101111010,XETMQVYILHVOSA-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NCC3N(C)CC4(CC3)CCC4,77E21E8F852E1955_8666307CC3F1924F_7022_UN,7.2495866,00000000000100000000001000000000000000000010000000000000000000100010000000010001001001110011010000101000010110011001101001100000110001110110001011011011010110101111010,JPFAFPIGDPULHF-UHFFFAOYSA-N
CC1=C(C=NC(=C1)C2CCC2)NCC34N(C)CC(C3)C4,B4C6D83A04D6E0F5_126D75ACACCA75A3_6041_UN,7.129592,00000000000100000000000000000000000000000000000000000000000000100110000000010001001101100011010010101000010010011001101011100000110001010110001010011111010110101111010,MIQQVERAOOHINK-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NC[C@@H]2CCCO[C@H]2C3=CC=N[N]3CC)C4CC4,D43E480A2689AAF4_B3C8DFDA78BA1730_6041_UN,8.136476,00000000000000000000001000000000000000000010000000001000010000100100000000010000101100010011001111101000000101010010001011101100110011110110001011011011110111101111110,XFEABMZKCSCBMV-MGPUTAFESA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NC[C@@H]3CCCN(C)[C@H]3C4=CN=C[N]4C,D36FE0514B297324_EA2D938EE1A5D5E2_7022_UN,7.600915,00000000000000000000000000000000000000000000000000000000000000100100000000010101101101110011010010101101010110010001101011100100110001110110001011011111010110101111010,ONCMIIZNPGEQSR-LAUBAEHRSA-N
C2(=C(C=C1C=CC=CC1=C2)Br)NC[C@@H]3CCCN(C)[C@H]3C4=CN=C[N]4C,F06C76ED6072C428_BACDDBB80A2EB194_7022_UN,7.600914,00000000000000000000000000000000000000000000001000000000000000100100000000010101101101110011010010101100010110010001101011100100110001110110001011011111010110101111010,MIGLFSMJNKWKIX-LAUBAEHRSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)N[C@@H]3C[C@H]3C4CCNCC4,08FAE6CD46B1C950_2235BFE6197552BC_6041_DP,8.000093,00000000000000000000001000000000000000100000000000000000000000100100000000000100001000100011000000101100110000010000001011000100110101010110011011010111010010101111010,POWNEFPGPUNLLJ-ZWKOTPCHSA-N
CO[C@@H]1COC[C@H]1OC2=CC(=C(C)C=C2C3CNCC3)Cl,DD50692B0FEE2C7B_716658BA01996CDA_6035_UN,8.095134,00000000000000000000000000000000000000000000000000000000010000100000000010000000001100110111010010001001100111010100101011000011010010100110000110110111110001111111110,HUGKBXDBSSEWKN-HJWAUIETSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CNC3)C4=NC=C(C=C4)F,2231185AD75C9646_CECA8ACCBFD2E8AA_6041_DP,7.948567,00000000100100000000000000000000000000100010000000000100000000100110000000010100101101110010010010101000000110011001101011100100110101110110001001011011010110101111010,PUEHFWKPECFUKQ-INIZCTEOSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC[C@H]4[C@@H](C4)C5=C(C=CC=C5F)F,BF7491C9250854A1_D968B2FADCA08D29_6041_DP,7.9199204,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000010110000000000011100100110101110110001011001011010110101111010,UDNKBLNKSWDQMF-FOFSIYPYSA-N
C1(=C(C2=C(C=C1)C=CC=C2)F)NCC3(C)CCC4(CC3)CC4,77076E4213EFEFEF_3793D1AEC8D09C0F_7022_UN,7.881664,00000000000000000000001000000000000000000010000000000000000000000010000000000000001000010011000000001100010100001001101000000100110001110000000011010011010110101111010,FNXDRRRCCGIMTM-UHFFFAOYSA-N
FC2=CC(=C1OCCC1=C2)NCC4=C(CN(C)C3CCCCC3)C=CC=C4,FB0AAAAE498B2463_32E4BD068BFE0D7D_6041_UN,7.8611116,00000000000000000000000000000000000000000010000000000000010000000000000000000000001101110001010110001100010111010101101000100100110011110110001011011011110111101111110,LHCDLGXXYWSISF-UHFFFAOYSA-N
CC1=C(C4=C(N1CC3(CC2=CC=C(C=C2)F)CCNC3)C=CC=C4)C5=CCNCC5,B223B2C889D10BE5_3FA007FDFF3045F1_6034_UN,8.770557,00000000000000000000000000000000000000000010000000100000000000100110000000011000101101110011000010111100110110011000101011100100110100100110001011011011010110101111010,NUZNYWBWPTVQJN-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCCC3C2CC2CCC3,1FBB807FD1AF221F_6C99CF09DA34B1A4_6041_UN,7.6789584,00000000000000000001101000000010000000000000000000000000000000000100000000100001001000100001010000101000110000011000001001000000110001010100011011011111010110101111010,VEJYCAOMWBXRPC-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCC2OC3=C(CC2)C=C(C=C3)F,A9A33ACF9CF51856_5C810F2151999C6F_6041_UN,7.7388115,00000000000000000000100000000010000010000010000000000000010000000000000000100000011100111011010110101100010100001100001010000100010011110100010011011111110111101111110,ABNQWVUGLPKHMH-UHFFFAOYSA-N
CC1=C(C=N[N]1C)C2=C4C(=CC(=C2)C=CC(OC)C3CCOC3)OCO4,D6C6F6FCF23157C6_6FD6086766DFB158_7019_UN,7.453126,00000000000000000000000000001000000000000000000000001000010000100100000010010000100100100100011010010100010011000100001011111110010010000110111010111110110011111111110,LORUZQXHLIYCCU-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)N[C@@H]4C6=C(OC5(C4)CCCC5)C=CC(=C6)F,263E0EC0B78ABBC0_5DF30039899D7C17_6041_DP,8.229375,00000000000000000001000000000000000000100010000000000000010000000110000000000101100101010011010011100100110100011100101011100100110111110100001011011001100011101111110,ORXRBTWDHRAJDL-JTJHWIPRSA-N
FC1=C(C=C(C=C1)NC[C@H]3[C@H](C2=CC=N[N]2C)C3)C4OCCO4,0E6CC89FC47B8F05_B21B8C50E832D22D_6041_UN,8.057185,00000000000000000000001000000000000000000010000000001000010000100100000010010000101100010011011010001000000111000000001011111100010011110110001010011011010111111111110,VYVUSKXLSAQBEF-WCQYABFASA-N
CC1=C(C(=C(C=C1)NCC3(CC2(CNC2)C3)C4=CC=CC=C4)F)C#N,052533DAAC85DA13_383221DD81494480_6041_DP,7.7243996,00000000100100000000000000000000000000000110000000000000000000100010000000000000001000110010000000001000010100001000000001000100100101110110001011000011010110101111010,LZZXCWYIPIKFRW-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)F)NCCN(C)C2CCOCC2,192DC4C4F7DDE3DD_A0DDD2BBB5C6CD96_6041_UN,7.354357,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110000010001101000100111010001101000100000110011110110001011011111010111101111110,SXDYMKHXTQDAIA-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)F)NCC2(CCSC2)N3CCOCC3)F,E49EF92F91E94046_B7A3C9A8256C8054_6041_UN,8.067843,00000000000000000000000000000000000010000010000000000000010000100010000000010001001101111011000110101000000101011000001011100000110011110110001011011011010111101111110,LNPKBCQWPINXML-UHFFFAOYSA-N
CC1=CC=C(C=C1)C2=NC(=C(Cl)N2CC34C(C3)CNC4)C#N,C348F32DDD1AE2B2_DFA9CDEBD9201C32_6034_UN,7.876116,00000000000000000000001000000000000000100100000000000000000000100110000000010101101101110011000010101001010100001000000011100100110000100110001011001011010110101111010,NPEAZOKRSYMVNL-UHFFFAOYSA-N
CCCC(NC(=O)CC1CC2CC1C3CC23)C4=C(C=C(C=C4)F)F,BA4C371328E353B2_E2728FBB47B2AD9C_6038_UN,8.388042,00000000000000000001001000000000000000000010000000000000000000000000000000000000000000010011100010000000110100110011011000000000110010100000000011010011001110101111110,DKVFJEVKWMVLMK-UHFFFAOYSA-N
CN(C1CNC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=C(C=C(C=C4)F)F,48D023307CFD23D5_9B1A48390E569320_6041_DP,8.491432,00000000100100000000001000000000000000100010000000000000000000100100000000000101101001110010010000101000100100010000100011100100000101110110001011001011010010101111010,GCBXGZQVVJTADQ-DZGCQCFKSA-N
C(=CC1=CC(=CC(=C1)F)F)NC[C@H]3[C@H](C2=NC=C[N]2C)OCC3,CE36D45E5512173A_42D01097C1B7A030_7022_UN,8.254513,00000000000000000000000000000000000000100010010000000000010000100100000000010101001101010011010111011000000101000000001011100100110010100110001010011011110111101111110,MHGVWLNBSLTJBW-XJKSGUPXSA-N
FC2=C(C=C1C(=CC=NC1=C2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4)F,A4BBC58DBE160D75_BF229E2759F6AB4B_6041_UN,8.363229,00000000000000000000000000000000000000000010000000000000000000100100000000010000101001110011010000101100010110010001101011100100110001110110001011011011010110101111010,LDSSKOKWPCCGEF-AOMKIAJQSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3(CCNCC3)C4=C(C=NC=C4)F,82D899EDA5D3361F_D844D3981F719C82_6041_DP,7.9810667,00000000000000000000000000000000000000100010000000001000000000100110000000010101101101110011011010101000100110011000001011101100110101110110001011011111010110101111010,UFWWALWKQXFPQF-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC2=NC=CN2CC3NCC4(C3)CCSCC4,30888679F85F7CA9_5D5439790DD41B63_6034_UN,7.989525,00000000000000000000000000000000000010100000000000000000000000000110000000010101001101111011000010101001110110011000001011100100110101110110001011011011010110101111010,PDUSUUDIGWUCLQ-UHFFFAOYSA-N
C(C2CCC1(CC1)C2)=CC3=C[N](C)N=C3C4=CC=C(C=C4)F,B60924A445B92E8F_DF4BA51884140A4E_7019_UN,7.5979924,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001010011010000010101111010,NQNAPSMNZISYLS-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3CC4(C3)C5CCC(C4)C5,C6FF6EB4BBDF0512_D56D87E79506B00E_6041_UN,8.022425,00000000000100000000000000000000000000000010000000001000000000000110000000010000100100010001011010000100110100011000001011101100110001110100001001011001000010101111010,ASSOXZWTHSHGNQ-UHFFFAOYSA-N
C(C1CCCC12CCOCC2)=CC3=C(Cl)[N](C(=N3)N(C)C)C4=CC=C(C=C4)F,8F9A19BAED294115_43B65509B2696C38_7019_UN,7.384989,00000000000000000000000001000000000000000010000000000000010000100110000000110101000101110000010010110001011101001000001011100100110011110110001011011110010011101111110,YBBRGMDTIIKBNI-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC(CC)C2CCCO2)Cl)C3CC3,FE8DD428F546B679_C8BAE88C4D8F6001_7022_UN,7.9853764,00000000000000000000001000000000000000000000000000000000010000100000000000000000000100010011000110000001100111010010001000000000110011110100000010010111110111101111110,HGWVGMGCQUVTTG-UHFFFAOYSA-N
CC1(CC1)C2=N[NH]C=C2NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,A19B825264A47650_7C8BC2B98BF6E8D4_6041_DP,7.715561,00000000000000000000001000000000000000000010000000001110000000100110010000000001101100110011001010101000100100011001101011001100110101110110001011010011010110101111010,GTKBHSYFFGLAPY-GOEBONIOSA-N
O=C2N(C1=C(CNCC1)C=C2C#N)CC4(CC3=CC=C(C=C3)F)CCNC4,A88F0020745FC48D_5DF4C302399CD1BF_6034_UN,8.086268,00000000000000000000000000000000000000000110000000000000000000000110000000010000101101110011100011101100110100111100011011100101110100100110001111011011011110100111110,ZHUNWCAWTLKPBN-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC4O[C@@H]3CCCC[C@H]3C4,136B345F87ED47AB_A459338AFE5A7DA0_6041_UN,8.347915,00000000000000000000000000000000000000000010000000000000010000000100000000000001001100010010000110101100010110000000001011000100110011110100001011010011110111101111110,PEXHPKCZDJFNCJ-PLXAZLAVSA-N
N(CC1C3CC2CC(CC1C2)C3)C(C4=C(CC)[N](N=C4)C5=CC=C(C=C5)F)=O,7C127F04B23E5EDE_88C41029C424834C_6038_UN,8.09275,00000000000000000000000000000000000000000010000000001000000000100100000000010000101100010001101011001100010100110010010011101100110001110100001011001011011110101111110,RYQMUIQDZDGQNU-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(C)CCCN3CC4=CC=CC=C4)C5CCNCC5,E04DF3B5D6A5C656_6798A224F90DD47E_6034_UN,8.464599,00000000000000000000000000000000000000000010000000000000000000100110000000010001001101110001000010101100110110011001101011100100110000100110001001011011010110101111010,HMZDAZKQBNAQOO-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC23CCCNCC2C3)F)CC4,A65BFA1E94C17C7E_C77793FEFA2AD428_6041_DP,7.6823363,00000000000000000001001000000000000000000010000000000100000000000010000000010001101001110011010000001100110110011001101011100000110101110110001010011011010110101111010,JKQNFRAIVUOWNV-UHFFFAOYSA-N
C1CCC(NC1)C3=CC2=C(C=CC=C2)N3C[C@@H](CC)NC4=NC=C(C=C4)Br,D3FD15ED7CCFD3BB_D22BC58D62908D17_6034_UN,8.066309,00000000000000000000000000000000000000100000001000000000000000100100000000010101001101010011000010101100110100010010101011100100110101110110001011011011010110101111010,JLUAAWDTHWSKFZ-MRTLOADZSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC23C(OCC2)CCCC3)F)CC4,36A257423E91593C_FABEF8377ED84F58_6041_UN,7.2281365,00000000000000000001000000000000000000000010000000000000010000000010000000010001100101110011010111001100110111011001101011100000110011110110001011011011110111101111110,OPTDXFLSHBJQRD-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)N[C@H]3[C@@H](OCC3)C4=C[N](N=C4)CC5CC5,F41F3F983E8D1124_AA68CC30F19F0624_6041_UN,8.440913,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011001111101100110101010000001011101100010011110110001011011011110111101111110,JEPDQBLMDBZFJO-NQIIRXRSSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC4(CCCC4)C5=C(C(=CC=C5)F)F,F62805A1D0606E11_2AD4D453A90D5BA6_6041_DP,8.134558,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010010101111010,IOBYXXXVSFZGMX-RAKKMVLPSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2C3=C(CC2)C=CC=N3,63FBF417120B3FE4_E7D2DE1382640F98_6041_UN,7.8318214,00000000000000000100100000000010000000000000000000000000000000000100000000100001101000100011010010101100010000001000001011000100110001010100011011011111010110101111010,QUDRMTKXPGSOBJ-UHFFFAOYSA-N
C1(=CC2=C(N=C1)[NH]C=C2C3CCC3)NC(CC)CC4=CC=C(C=C4)F,E963E9D268900885_BBEA47D23CD296AB_6041_UN,7.884593,00000000000100000000000000000000000000100010000000000000000000100100000000000101000100010001000010100100110100010010101011000100000101110100001001010001000110101111010,VPNQRCJKCLBFBP-UHFFFAOYSA-N
COC(OC)C1=CC(=C(C=C1)F)NCC2(CCCC2)C3=CC4=C(C=C3)OCCO4,ABE4ECAB35E5237A_611A10B25944011D_6041_UN,7.377851,00000000000000000000000000000000000000000010000000000000010000100010000010000000001000010011010010101100010101001100001010010110110011110110100011110111110111111111110,XBRRZWGYUSSQOB-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)N[C@H]4[C@@H](C4)C5=C(C=CC=C5F)F,2B22160851F457F6_A07FD89139541476_6041_DP,8.326208,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000110110010000000011100100110101110110001011001011010010101111010,WBOLWNDUQSDZCY-GSHMYCMBSA-N
C[N]1C=C(C(=N1)C2CC2)NC3=CC(=C(C=C3)SC4CCCC4)F,C98A8FC5E436DC5A_C7296A6D630594B5_6041_UN,7.336195,00000000000000000000001000000000000000000010000000001000000100101100000000010001110100011001011010000000000100000000001011101100010001110100001010011011000010101111010,ZUSYKQGOBNDHQZ-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2OC3(CCC2)CCC3)F,AC3BCAC713E83EF3_CD2CDDDDEA4F198A_7022_UN,7.270717,00000000000100000000000000000000000000000010000000000000010000000010000000100000001001110011010100101000010100001001001000100000110011110110001011011111110111101111110,WCFIGNXFHUMYKI-UHFFFAOYSA-N
FC2=C1C=CC=CC1=NC=C2NC3CCN(C)C34CCCNC4,77C835731CBC7909_CA53AA9C8C9778CF_6041_DP,8.176281,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001011011011010010101111010,MLIQIGGEKVLVIY-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4(CCCCC4)C5=C(C=C(C=C5)F)F,5568E8BE7D7ED459_6D8EA4D24E876E01_6041_DP,8.129745,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010010101111010,GGVAIKCFCOCCEC-GWTOYCKXSA-N
BrC2=C1N(C3=C(C1=CC=C2)CSCC3)CC4CNCCC45CCN(C)CC5,5A64A6E4FCCE279F_E7963F4634F0E4BB_6034_UN,7.633014,00000000000000000000000000000000000010000000001000000000000000000110000000010000101101111011010010101100110100011001101011100100110000100110001011011001010110101111010,ALRHAYCLFACDTR-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@H]2OC[C@H](C)CC2)Cl)C3CC3,7ECB317151EE738A_65369D3616CF97EC_7022_UN,7.9380817,00000000000000000000001000000000000000000000000000000000010000100000000000000000001000010011000100101001000111000001101000000000110011110110000011010111110111101111110,SPUWREPPWXPYIX-RISCZKNCSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC3(CCNC3)CC=C,9093B238ED79CD39_8E313B6D8BCE3D58_6041_DP,8.554996,00000000000000000000000000000000001000100010000000000110000000000110000000000101101100110011000010111100110100011000001011000100110101110110001011010111010110101111010,KAMYWFGVQUCAKQ-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NCC3(C)C4CCC(C3)O4,198707D8F7EC6532_8C6C5A75150CFDF1_7022_UN,6.878585,00000000000000000000001000000000000000000010000000000000010000100010000000000000001100010011000011001000010110001001101000000000110011110100000011010011110111101111110,ZQQUHVNSYWPVQV-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCCC3)C4=CC=C(C=C4)F,3268983774574B68_74C8116BAC4C6902_6041_UN,7.4206343,00000000000000000000000000000000000000000010000000001000000000100110000000010000101100010011011010001100010100001000001011101100110001110100001001011001010110101111010,OGZKHXMHKIMLCD-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NCC3(C)C4CCC(C3)O4,C97BAF7A9FC34269_78ACA8785D4F5C4E_7022_UN,6.878552,00000000000000000000001000000000000000000000000000000000010000100010000000000000001100010011000011001001010110001001101000000000110011110100000011010011110111101111110,TVEYDJQGEJIKML-UHFFFAOYSA-N
FC2=C1OC=CC1=C(C=C2)NC4C[C@H]3CCC[C@H](N3C)C4,90DF64F960B77306_9DEF9FA6DABF5963_6041_UN,8.080111,00000000000000000000000000000000000000000010000000000000010000000000000000010000100101010001010011100100110110010000101011100100110001110100001001011001100010101111110,LPACYVDTXIUPDW-YHWZYXNKSA-N
C(C2C1CC3CC(C1)CC2C3)=CC6=CC4=C([N](N=C4C)C5=CC=CC=C5)N=C6Cl,98354223DB1878D4_77A052EE1CDC4358_7019_UN,8.2402,00000000000000000000000000000000000000100000000000001000000000100100000000010101100100010000001010110101010100000000000011101100100001110100001011001010000010101111010,LMRSZUSOISVPSX-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2=CN(C=N2)CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,A18EDECCB9F9A726_C19B824DB01F949C_6034_UN,7.9054775,00000000000100000000000000000000000000000010000000000000000000100110000000110101000101010000000010001000010110011000101011100100110000100100001001011100010110101111010,IYPBAXKHMGTNEO-YXJHDRRASA-N
ClC1=CC=C(C=C1)C2=CN(C=N2)CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,415D409B5F1C5D07_1059CABADF18B9E8_6034_UN,7.905475,00000000000100000000000000000000000000000000000000000000000000100110000000110101000101010000000010001001010110011000101011100100110000100100001001011100010110101111010,UHDGDYAHLDWJIO-YXJHDRRASA-N
BrC1=CC=C(C=C1)C2=CN(C=N2)CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,F1A3521042955E6A_33C75A333DDE8A41_6034_UN,7.905456,00000000000100000000000000000000000000000000001000000000000000100110000000110101000101010000000010001000010110011000101011100100110000100100001001011100010110101111010,CAOBQZLQSBRQRF-YXJHDRRASA-N
N(C1=CC2=C(C=C1)CCOC2)[S](C3=CC=CC4=C3[N](C)C=C4)(=O)=O,988AD6D6A99344A9_431AD0CDDAFF886E_6028_UN,8.570646,00000000000000000000000000000000110000000000000000010001011111001101010001010000110101101001011011100110011001001000011011101100111011011110001011111001010011111111110,XNWPTJBEDQGCLL-UHFFFAOYSA-N
O[C@@H](CCl)C1=CC=C(C=C1)NCC2CC3CCC2N(C)C3,9A452329213DDBCA_5DA2CBAAB55EEB7D_6041_UN,8.253068,00000000000000000000000000000000000000000000000000000000000000000000000000010000101001100011010000101001110010010001101001100000110111110111001001011001110111101111110,HUJQVJGCCSWMSY-FEYJPFALSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC3=C2CCCC2=CN=C3,AA3E0F8E374753A5_E78343D31031FC6F_6041_UN,7.8578925,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100011010010100100010000001001001001000100010001010100011011011111010110101111010,YKXVBGVHWZPMKG-UHFFFAOYSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NC3=C(C=C(C=C3)C4CCOCC4)F)C5,B91EA5E59EEECE0F_9BC2C2FAF274D2AE_6041_UN,7.4395423,00000000000000000000000000000000000000000010000000000000010000100100000000010000100101110011010010101100110101010001101011100100110111110110001011011011010011101111110,IBURCYWJMDFNIS-UHFFFAOYSA-N
C1CC(CCN1)C3=CC2=C(C=CC=C2)N3CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,808A51A89982CC79_A2A5107D1DA8B002_6034_UN,8.381366,00000000000000000000000000000000000000000000000000000000000000100100000000010001001101110001000010101101110110010010101011100100110100100110001011011011010110101111010,WQNHFKPVSFRGTI-UHFFFAOYSA-N
NC1=CN(C2=C1C=C(C=C2)Br)C[C@H]3[C@@H](CNC3)C4CCOCC4,E174AE92CFE76958_DD55324EE9C3FAC1_6034_UN,8.814892,00000000000000000000000000000000000000000000001000000000010000100100000000010001101111110011000010101100010101000000001011100100110111110110001001011011010111100111110,YSZOMFJFSRMGCI-BBRMVZONSA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NC3CCN(C)C34CCCNC4,DC091F65C7CAA5B1_C3E26B172B43902D_7022_DP,8.3954315,00000000000000000000000000000000000000000000000000000100000000000010000000010001101101110011010010101101110110011001101011100100110101110110001011011011010010101111010,WXXZPQLGTLFFDN-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Br)NC3CCN(C)C34CCCNC4,9A38565E0CE1B1B6_93022321C0C8F45B_7022_DP,8.395415,00000000000000000000000000000000000000000000001000000100000000000010000000010001101101110011010010101100110110011001101011100100110101110110001011011011010010101111010,FLPXFJVYURCGNW-UHFFFAOYSA-N
FC2=C(C=C1C=CC=CC1=N2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,78EF5F04F96A7164_4F1AB508C7AFCF7D_6041_UN,8.085735,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,DPGLREDQDORZOO-IERDGZPVSA-N
N1CCC4(CC1)CCC2=C(C=CC(=C2)NC3=CC(=C(N(C)C)C=C3)F)O4,91B414930DB216DA_AFAA06E86CE29D14_6041_DP,7.281289,00000000000000000000000000000000000000000010000000000000010000000010000000100000001001110001010001101100110100011100001011100100110111110110001011011111110011101111110,ZABKNRHQYBGJJW-UHFFFAOYSA-N
BrC1=CC2=C(N=C1)N(C=C2C3CCC3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,CD6093B63232CA24_8AF14AE09889DCF4_6034_UN,8.338286,00000000000100000000001000000000000000100000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,ANRBKEYWKKSFDM-HXOBKFHXSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC3=CC2=C(NCCO2)C=C3,89FE58D37672FD77_05AC6796FFB4129B_6041_DP,7.61621,00000000000000000100100000000010000000000000000000000000010000000100000000100001001000100001010100101100110001011100001011000100000111010110011011011111110111101111110,XOCVZJOQHZUHKK-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CCNC3CCC(CC)CC3)Cl,8A80334749CA48B8_4CF324B90AEFBEF6_6034_UN,8.10973,00000000000000000000000000000000000010000000000100000000000000000100000000010111011101011011000010001001101110010010101111100100110101110110001011011111010110101111010,QLKCETHLTRABII-UHFFFAOYSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3(C)CCCCCC3)C4,81A8920DFDD42FBD_5CF4BA4F2C2EF0D8_6041_UN,7.763605,00000000000000000001000000000000000000000000000000000000000000000110000000010000101101100011010010101100110010011001101011100100110101010110001011011101010110101111010,IEPZISBZIZGXDS-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NCC3=C(C=N[N]3C)C4CCC4,5DA1697F760663F0_40BBB9E7B9F83E3A_6041_UN,7.6163764,00000000000100000000000000000000000000000010000000001000010000100100000010010001101100010000011010001000000101010000101011111100100011110110001010011011010111111111110,FFVMVLRWUGMSNK-UHFFFAOYSA-N
CN(C)C1=C2C(=CC=N1)C(=CC=C2)NCC3CCN(C3)C4=CC(=C(C=C4)F)F,B962C336C54E8688_0079FBBD6C51C384_6041_UN,7.734521,00000000000000000000000000000000000000100010000000000000000000100100000000110100101101110011010010101100010100010000001011100100110001110110001011011111010110101111010,GSFXDAZPWHZPEH-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NCC(N2CCCC2)C3=CSC=C3)F)C4,DE75B6B977533EC2_26DCEE7DB655DB11_6041_UN,7.850917,00000000000000000000000000000000000010000010000000000000000000000000000000010001001101111001000010101100010110010010101011100100110001110110001011011001010110101111010,HDNHJZAHZJBJFH-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CC3(C)CCN3CC4=CC=CC=C4)C5=CCNCC5)F,E917B80FB7B72CAF_02F0F6580E704F37_6034_UN,8.639811,00000000100100000000000000000000000000000010000000100000000000100110000000011001001101110001000010111100110100011001101011100100110000100110001011011011010110101111010,RESRQWHKANQKAT-UHFFFAOYSA-N
CC2=CC1=C(C=CC(=C1)Cl)N2C[C@H]3[C@@H](CNC3)C4CCOCC4,26469BC4E6457590_07328E03C0B424DE_6034_UN,8.294739,00000000000000000000000000000000000000000000000000000000010000100100000000010000101101110011000010101101010101000000101011100100110010100110001011011011010111101111110,OKBLWQNHPSXCOA-WMZOPIPTSA-N
CC2=CC1=C(C=CC(=C1)Br)N2C[C@H]3[C@@H](CNC3)C4CCOCC4,C0D486A64D0ED983_5D668F630ED48DAE_6034_UN,8.294737,00000000000000000000000000000000000000000000001000000000010000100100000000010000101101110011000010101100010101000000101011100100110010100110001011011011010111101111110,FWTXHYJADZRIHP-WMZOPIPTSA-N
CC2=CC1=C(C=CC(=C1)F)N2C[C@H]3[C@@H](CNC3)C4CCOCC4,438BE836AEBE99C5_96AF224996659FB2_6034_UN,8.294736,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011000010101100010101000000101011100100110010100110001011011011010111101111110,ALHRJQWEKUMDKJ-WMZOPIPTSA-N
FC2=C(C=C1OC=CC1=C2)NCCC3CCCN(C)C3,009EB21BD0823817_EA7C71CC22D7CD4B_6041_UN,7.902936,00000000000000000000000000000000000000000010000000000000010000000000000000010000001101110001010011101100110110010001101011100100110001110110001011011011110110101111110,ODRHGKJJFSWRGM-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2OC3(CC2)CCCC3)F)CC4,0E5FA9575951167F_12633DD657A8EA5D_6041_UN,6.9737387,00000000000000000001000000000000000000000010000000000000010000000010000000010001101101110011010110001000010110011001101011100000110011110110001010011011110111101111110,OWUWHUROEDQVIB-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@H]2CO[C@H]3CNC[C@@H]23)F)CC4,0070D80DE7032BBB_F914125B3B360F63_6041_DP,7.4333334,00000000000000000001000000000000000000000010000000000100010000000000000000010001101101110011010111001100110111010001101011100000110111110110001010011011110111101111110,ILCSECALFTZVSM-WDSOQIARSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CC4CCCC(C3)C4,5606929A4417BB36_F52C6C83EEDEA081_6041_UN,8.24213,00000000000000000000000000000000000000000010000000001000000000000100000000010000101100010010011010001100010100000000001011101100110001110100001001011001010110101111010,DNSFBZUKRFGVKY-UHFFFAOYSA-N
CN(C)[C@@H]1COC[C@H]1OC2=CC(=C(C)C=C2C3CNCC3)Cl,6CD70DBC4BF3B0E5_B702C2E04D6C2C8A_6035_UN,7.9105506,00000000000000000000000000000000000000000000000000000000010000100000000010100000001101110111010111001001100111010100101011100011010011100110011110011111110011111111110,AXVHWMQQVMVVAT-VUOSCMKMSA-N
CN(C)CC1=C(C=CC(=C1)NC3CCOC(C2=CN=C[N]2C)C3)F,4C6361000C5C6CBF_EC12528D30ED525A_7022_UN,7.6200185,00000000000000000000000000000000000000000010000000000000010000100100000000110101000101110011010111101000100111010001001011100100110011110110011011011111110111101111110,FYNGLERSSUNCET-UHFFFAOYSA-N
FC2=C1C=NC=CC1=CC(=C2)NC3CN(C)C4(C3)CCOCC4,D7B176B325280B51_6D9DB9AF7FB0C946_6041_UN,8.108423,00000000000000000000000000000000000000000010000000000000010000000110000000010001100101110001010011101100110111011001101011100100110011110110001001011001010011101111110,YNXNUECGYDLXJR-UHFFFAOYSA-N
CSCC2(C=CC1=C(O)C(=C(C=C1)Cl)I)CCOCC2,789D1BABB3026682_1457A66F3E28107A_7019_UN,8.029694,00000000000000000000000000010000000000000000000000000000010000000010000000000000000000111000010000110001000111001101001000000001110010100111000111010010110101011011110,OYRRSWROTPUWCQ-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(C3=C(N=CC(=C3)C)F)=O,5E4BA0250F13EA8D_EBF54823BC01BE0F_6038_UN,8.366859,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010011100001111000010100100000011001000000110000100100001011010011011110101111110,GSODCJJCBUUUNH-UHFFFAOYSA-N
CSCC2(C=CC1=C(O)C(=C(C=C1)F)F)CCOCC2,FFE0391E28C1720E_6C786779C0A2364E_7019_UN,8.02969,00000000000000000000000000000000000000000010000000000000010000000010000000000000000000111000010000110000000111001101001000000001110010100111000111010010110101011011110,RTJVUISTNYDICP-UHFFFAOYSA-N
CC1=CC(=C(C=C1)F)NC24CC(OC23CCNCC3)(C)C4,65AAD08EF8F3C64F_93873B474A73798C_7022_DP,8.144007,00000000000100000000000000000000000000000010000000000000010000000010000000000000001100110011000111101000110110011001001011000000110111110110001011010111110011101111110,HTMLDKYYZDZLTI-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC3CC2(CCN2)C3)Cl)C4CC4,024F0028C97026F4_62EEC8AD35D818DC_7022_DP,7.8754816,00000000100100000000001000000000000000000000000000000000000000100010000000000000001000010011000000001001110110011000001001000000110101110110001010010011010110101111010,QMIRRMOJESKSIC-UHFFFAOYSA-N
COC1=C(C=CC(=C1)C(F)(F)F)NCC23CC(OC2)CCC3,5BF1FC36F701F057_9F82D44714CC7BA4_7022_UN,8.145785,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100000011010111001000011101001100001000000011110011110110000111010011110111111111110,RCHKSQLCXLBVPF-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCCC3CCCNCC3,30A5CF1DFC4B8F5F_335340651DD2BCCF_6041_DP,7.9021864,00000000000000000001000000000000000000100000000000000000000000000100000000000100001000100011000000101100110010010000001011000100110101010110011011010111010110101111010,NPGJOUZXIGNKMF-UHFFFAOYSA-N
CC1=C(C=CC(=C1)OCC2CC2)NC[C@H]3C4CCC([C@@H]3C(F)(F)F)CC4,F7D79573339778F5_FCD3AAF075E57AE3_7022_UN,7.378354,00000000000000000000001000000000000000000010000000000000000000000000000000000000001000000001000000001000011111001100001000000011110001110010000111010011110111101111110,XWRVNNZYLUMPEB-BPCFOJMASA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CC34CC4,628F9B831A26081E_93715E62C1790D2B_6041_UN,7.5679903,00000000000000000000001000000000000000100010000000000000000000000110000000000100001000010011000000101100010110001000000001000100110001110100001011010111010110101111010,ICUVYNVQDWCMEA-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CCCCCN2)F,7786D16C230FE386_B9A254EF9EB0C7E7_7022_DP,7.547388,00000000000000000001000000000000000000000010000000000010000000000000000000100001001001110011010000001000100100010001001001100000110101110110001010011111010110101111010,TWGZFGCAFKPILL-UHFFFAOYSA-N
CCCOC2=C1N=CC=C(C1=CC=C2)NCC(N3CC(C)OC(C3)C)C4=C(C=CC=C4F)F,8018CC623E22FFD8_C2FD456326BCDBAF_6041_UN,8.527481,00000000000000000000000000000000000000000010000000000000010000000100000000010001101001110001000100101100010111010111001011100111110011110110011111011111110111111111110,QXIYANDNSLJXOL-UHFFFAOYSA-N
CN1C(CCCC1)C=CC3=CC(=C2OCOC2=C3)C4=CN=CC(=C4)F,8F259414E67BD78B_5DD68E0F3C7A4107_7019_UN,8.492289,00000000000000000000000000001000000000000010000000000000010000100100000010010000000101110000010010111100010111010101101011110100110000100110001011011010110011111111110,ARUCFANZCHKALM-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCN(CC2)C3CCOC3)F)CC4,C84D0F274BDA5C31_6BF82641AAA34ECD_6041_UN,7.424319,00000000000000000001000000000000000000000010000000000000010000100000000000010001100101110010010111101000100111010001101011100000110011110110001011011011010111101111110,PFDYHYVVTLKEIL-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CCC3)C4=CC=C(C=C4)F,44C68F71AD7CBC07_8EF70CF4823B7680_6041_UN,7.720517,00000000000100000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001001011011010110101111010,HGFXXISFXIOSCP-IBGZPJMESA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CC3CCC2N(C)C3)F)CC4,2A50446F7CFB64F9_EF8B91353BDD0CE9_6041_UN,7.709759,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010000101000010110010001101011100000110001110110001011011111010110101111010,CUCFRRVRUIAKBY-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC34CCC(CC3)CO4,0E8E8FC0AD300CA0_801206D9AECDD5CB_6041_UN,7.9644794,00000000000000000000000000000000000000000010000000001000010000000110000000010000101100010011011110101100010101001000001011101100110011110110001001011001110111101111110,SXGRVUPSILAKHS-UHFFFAOYSA-N
CC1=NC(=C(C=N1)NC[C@H]2[C@@H](OCC2)C3=CC=C(C=C3)F)C4CC4,29D04B18C9972EAD_F3ADDFC45CC32E0B_6041_UN,8.132209,00000000000000000000001000000000000000100010000000000000010000100100000000000101101100010011000011101000000101000000001011000100110011110110001011010011110111101111110,UKXKGEGCNVATGT-KXBFYZLASA-N
CCNC5CCC1=C(C4=C(N1CC(CC)C2=CC3=C(C=C2)CCCC3)C=CC(=C4)Cl)C5,783171C1BD7BF23F_576316DCB727C66E_6034_UN,7.8724875,00000000000000000000000000000000000000000000000000000000000000000100000000010000001101010010000010001101110110010010101001100100110001100110001011011101010110101111010,RZZFNELWKJSQHW-UHFFFAOYSA-N
N(C1C3CC2CC(CC1C2)C3)C(C4=C(C=CC(=C4)C5=C[NH]N=C5C)F)=O,7F5A807223CAF861_DE3B27FCE69507FA_6038_UN,7.9890814,00000000000000000000000000000000000000000010000000001000000000100100010000000000100100010010101010000100010100100000010011001100100101100100001011000011001010101111110,YKWRLKVXZREXAJ-UHFFFAOYSA-N
N(C1C2CCC1CCC2)C(=O)CCC3=CC(=C(C=C3)Br)Cl,63D93575777E2F79_1E12134D0C51FDD3_6038_UN,7.388347,00000000000000000001000000000000000000000000001000000000000000000000000000000000000000010011100010000001110100110000011000000000110011100000000011010011001110100111110,DYAXWZMUJOIPEF-UHFFFAOYSA-N
N(C1C2CCC1CCC2)C(=O)CCC3=CC(=C(C=C3)Cl)F,BB8432A52FBFC8F4_751635D15AC8FFC0_6038_UN,7.388335,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000010011100010000001110100110000011000000000110011100000000011010011001110100111110,QESMCCJVJROTQD-UHFFFAOYSA-N
N(C1C2CCC1CCC2)C(=O)CCC3=CC(=C(C=C3)Cl)Cl,F0644865A5BB41E8_644B8E58CFA2B49B_6038_UN,7.388329,00000000000000000001000000000000000000000000000000000000000000000000000000000000000000010011100010000001110100110000011000000000110011100000000011010011001110100111110,WDGJNBFPXCYQMT-UHFFFAOYSA-N
N1CCCC2=C1N=C(C=C2)CC5=C(C3=C(SC4=C3CCN(C)C4)N=C5)C6=CC=C(C=C6)C,45095EB59239F814_F4A5CEE8555B68BE_2201_DP,8.359203,00000000000000000000000000000000000010100000000100000000000000100100000000010100011101101011010010101100110000010001101011100100110000010110001011011111010110101111010,GAMPYWZMLITLBR-UHFFFAOYSA-N
FC1=CC=C(C=C1)CC2=NC4=C(C(=N2)NCC3CCC(CC)(C)O3)C(=CS4)C5=CC=C(C=C5)F,14158019E83C9336_4BDC4D5DEA68BC90_6041_UN,8.580371,00000000000000000000000000000000000010100010000100000000010000100110000000000100111100011011000110101100010110011011101011000100110011110100001001010101110111101111110,JGLAURNBMXWJGZ-UHFFFAOYSA-N
FC2=C1CCCC1=CC(=C2)NC[C@H]4[C@H](C3=NC=C[N]3C)OCCC4,CE488761941966A1_0A8E379961E76958_6041_UN,7.1870418,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101010011010111101100010101000000001011100100110011110110001011011011110111101111110,SZAXWPZUZRCHNS-KBXCAEBGSA-N
CN(C)CC1=C(C=CC(=C1)NCC2=C(C=NC=C2)OCC3CCOC3)F,73C69B68ADF5E252_71DB91584669538C_7022_UN,7.8319983,00000000000000000000000000000000000000000010000000000000010000000100000000100000001101110101010111101000000101000101001011100111110011110110001111011111110111111111110,FARPVYWGACQWFN-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CN(C2=O)CC3(CNCC3)C4CCOCC4,F021CF978EA047FF_0F88D413847EFEE4_6034_UN,8.364955,00000000000000000000000000000000000000000010000000000000010000100110000000010000101101110011100010101100110101111100011011100101110010100110001111011011011111110111110,HUQWYRNXWPSWTB-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C(C)(C)C3=C(C=C(C=C3)F)F)=O,0B171619F60FAD41_682BB327BF106645_6038_UN,8.051059,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010001100010001000110110111000011000000000110010100100000011010111111111111111110,BRSZXOIRKQDWRI-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CCC2CCN(C)C2)C=CC(=C3)Br)C4,3A4D7677E3E4AF87_E99865AAA9CB6D6E_6034_UN,7.516123,00000000000000000000000000000000000000000000001000000000000000000110000000110000000101110000010010001100010110011001101011100100110000100110011011011100010110101111010,XJXRRWITVXYVHL-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,3854DCE4DB73032B_7F7A946934EBB7E4_6041_DP,8.197279,00000000000000000001000000000000000000100010000000000000000000100100000000010101100101110011010010101000110110010001101011100100110101110100001001011111010010101111010,KITBPMPFSNZYMW-ZNOYZCKDSA-N
O(CC2(CC1CO1)CCOCC2)CCC3CCN(C)CC3,79F20BABE5CE128E_7D5B4FA15CEC2172_6039_UN,7.431151,00000000000000001000001000000000000000000000000000000000010000000010000000010000000001100000010000101000000001011001101011100010110010000110000001111000110101111101110,VUMORGLBKHXTNE-UHFFFAOYSA-N
N([C@@H]1C2CCC(C1)CC2)C(=O)[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,D5C5C0C266704791_ECF94ACC59779546_6038_UN,7.32759,00000000000000000000000000000000000000000010000000000000010000100000000000000000000100010111100011000000110101110000011000000000110011100100000011010011111011110111110,YQXJYSVZCVIXFB-HCBRGZNVSA-N
N([C@@H]1C2CCC(C1)CC2)C(=O)[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)Cl)F,15B83832614A83AB_8F6CABEE5C926CC3_6038_UN,7.3275766,00000000000000000000000000000000000000000010000000000000010000100000000000000000000100010111100011000001110101110000011000000000110011100100000011010011111011110111110,JPZDSJJGBKIHSF-HCBRGZNVSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CCOCC2)C3=CC=CS3)F)CC4,03C9A4DC13B2E0A2_3F501B94133CB9DA_6041_UN,8.106537,00000000000000000001000000000000000010000010000000000000010000100010000000010001111101111011010010101000000111011001101011100100110011110110001011011011010111101111110,AWLRWIOEUOHFJC-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CCN(C)C3CCCCC3)C4CCNCC4,B5F3B3930BD4A9E7_B40DAC4882B301A2_6034_UN,7.861301,00000000000000000000000000000000000000000010000000000000000000100100000000010001001101110001010010101100110110010001101011100100110001100110001001011001010110101111010,DZUHWTRQMIFRGO-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C(F)F)Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,C68031A3C8FB95DE_2D239EBABD255EFF_7022_UN,8.54659,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101001000100010000001011101100110001110110001011011011010110101111010,PLNBQJVOZZTYPF-KUHUBIRLSA-N
CC1=C(C(=C(C=C1)NCC2(CCNC2)C3CC3)F)C#N,0CA32B5E26893B0B_23B06F7B404C9DB8_6041_DP,8.692563,00000000000000000000001000000000000000000110000000000100000000100010000000000000101100110011000010001000100100011000001001000000110101110110001010010011010110101111010,BPYWIPUPRIXGEN-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)N[C@H]3[C@@]4(C3)C5=C(CCC4)C=CC=C5,F2AC3292C870BAA8_2AC0E4B683601B26_6041_UN,8.518425,00000000000000000000001000000000000000000010000000001000000000000110000000010000100100010011011010000100110100011000001011101100110001110100001011011001000010101111010,IKXWVLWXZPSHIA-QUCCMNQESA-N
CN1C2CCC(C1)CC2CNC(=O)CCCCC3=CC4=C(C=C3)OCO4,3E7327B7BBBF3738_D8567514D43971D3_6038_UN,8.374424,00000000000000000000000000001000000000000000000000000000010000000000000010010000101101100011110010101100110011110101111011110000110010000110001011111001111111111111110,KWHFXXMNTQWJRO-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC3=C(C=C(CN2CCN(C)CC2)C=C3)F)C4OCCO4,3F957DDC5D4608C2_F6C613B2E7B5A5B6_6041_UN,7.6772404,00000000000000000000000000000000000000000010000000000000010000100000000010010001000101110000010010101000000101010001101011110100110011110110001011011011010111111111110,MWOBMCWBOKBOSJ-UHFFFAOYSA-N
O(CC1C(CNCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Cl)C#N)Br,B9D2C5AE494552E5_34A6329C778ADA24_6035_UN,8.244408,00000000000000000000000000000000000000000100001000000000000000100000000000000000001000110001000000101001100101010100001001000111110000100110001111010011110101100111110,XAFNJLAVRDUICH-UHFFFAOYSA-N
O(CC1C(CNCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Br)C#N)Br,0A793E38774BF936_8C2EDF2AEAB8F83D_6035_UN,8.244411,00000000000000000000000000000000000000000100001000000000000000100000000000000000001000110001000000101000100101010100001001000111110000100110001111010011110101100111110,XGUSGZCHKYLVFT-UHFFFAOYSA-N
O(CC1C(CNCC1)C2=CC=CC=C2)C3=C(C=C(C=C3F)C#N)Br,EE9F718BFFD8A1F8_76FD205AC1D56085_6035_UN,8.244403,00000000000000000000000000000000000000000110001000000000000000100000000000000000001000110001000000101000100101010100001001000111110000100110001111010011110101100111110,RPWKTCJRLYUVAM-UHFFFAOYSA-N
N1CCC5(CC1)CCC2=C(C=CC(=C2)NC3=CC(=C(C=C3)N4CCCCC4)F)O5,EFB8E5940168FE70_F5C3E8CB1CAEFA5B_6041_DP,8.206153,00000000000000000000000000000000000000000010000000000000010000100010000000010000001001110001000001101100110100011100001011100100110111110110001011011011110011100111110,WJPGULHIFGDSJQ-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)N[C@@H](C)C2CCOCC2)F)CC3,5C7E0FB4F1D1AC59_6A0D1A46A07724EE_6041_UN,7.4308014,00000000000000000001000000000000000000000010000000000000010000000000000000010001100001110011010000101000000111010001101011100000110011110110001011011111010111101111110,BJBKIUQSZMXTQB-INIZCTEOSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC4C[C@H]3CCC[C@H](N3C)C4,0DC91E95C34CC67B_3EEE4C5E0E2C9CF0_6041_UN,7.9333925,00000000000000000000000000000000000000000010000000001000000000000100000000010000100101010001011010100100110110010000101011101100110001110100001001011101000010101111010,WDZBXFIYLOLICT-GOOCMWNKSA-N
CN6CCC1=C(C2=C([NH]1)C=CC(=C2)N[C@@H]4CCN(C3CC3)[C@H]4C5=CC(=C(C=C5)F)F)C6,DDE8CDB7E0115DF1_788FE724CFE2127E_6041_UN,8.116059,00000000000000000000001000000000000000000010000000000000000000100100000000010001100101110011010010101100110100010001101011100100110101110110001011011011010010101111010,XAXCBAKBOPAPSZ-RPBOFIJWSA-N
CC(C)C2=C1N=C(C=C(C1=CC=C2)C)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,C02C3416D2CB3B9A_55CD08502F12D24E_6041_DP,8.268145,00000000000000000000000000000000000000100010000000000100000000100100000000100100101000110011000000101100110100010000001011000100110101110110011001010111010110101111010,VNAPXLSRYMNSNF-WMZHIEFXSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(C)CCC=C3)C4CCNCC4,2AB5BC954ED05763_97203D16AE4DF4AB_6034_UN,8.361757,00000000000000000000000000000000000000000010000000000000000000100110000000010000001101110001000010111100110110011001101011100100110000100110001001011001010110101111010,XCBBBBYZSWMWSN-UHFFFAOYSA-N
N3CCCC(CC=CC1=C(Cl)[N](C(=N1)N(C)C)C2=CC=C(C=C2)C)CC3,CD35BE1E371569AD_4B37A2E99D25767F_7019_DP,7.532528,00000000000000000001000001000000000000000000000000000000000000100100000000110101001101110011010010011001101100010000001011100100110001110110011010011111010110101111010,INYWEIHDZANOAT-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3CNCC4(O3)CCC4,FF0A884CFDEB3EEE_21BED60D13FE6C0F_6041_DP,7.168178,00000000000100000000000000000000000000100000000000001100010000100110000000010101101101100011011110101000010010001000001011101100110111010110001011011111110111101111110,SKTJGHJSRNXZRZ-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4)F,A9CEE0E189A055D0_FC6D3FC9776C4A43_6041_DP,7.6994257,00000000000000000000000000000000000000000010000000000000000000000000000000000000101001110011010000101100110110010001101001100100110101110110001011011011010110101111010,OLDCXKMFXUPZCE-UHFFFAOYSA-N
FC2=CC(=C1OCCC1=C2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4,9A02CC08424149ED_05CC72767031C95E_6041_UN,8.22871,00000000000000000000000000000000000000000010000000000000010000100000000000010000101101110011010110101100010111010101101011100100110011110110001011011011110111101111110,CUVAFXJLQIGHPX-PXNSSMCTSA-N
CC1=C(C(=NO1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C,AEA02C21C325AF5C_103A4D6C38818B78_6041_DP,8.922466,00000000000000000000000000000000000000100010000000000100010000100100000100000100101100110011001111101010100110010000001011001100110101110110001011010111110110101111110,AIRQKYLCIINZEY-GOEBONIOSA-N
CN(C)CC1=C(C=CC(=C1)NCC3OCC2(CCNCC2)C3)F,6B7038BD5333B0E4_77215D9E47FA297D_7022_DP,7.2870584,00000000000000000000000000000000000000000010000000000000010000000010000000100000001101110011010110101000110101011001001011100000110111110110001011011111110111101111110,BGAHAJLBCOQTLB-UHFFFAOYSA-N
NCC4(OC1=C(C=C2C(=C1)CNCC2)F)CC3=C(C=CC=C3)C4,64237DBDE91C741D_70E01FB85326F111_6035_UN,8.038756,00000000000000000000000000000000000000000010000000000000000000000010000000000000001010110011000110101100110100011100001001000111110110100110001111010011110101100111110,ZVVPGQLVUUCWST-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)F)NCC2(CCSC2)N3CCOCC3)F,77F96E51F3CFC61C_F208B7DC24BFFB13_7022_UN,7.8700337,00000000000000000000000000000000000010000010000000000000010000100010000000010001001101111011000110101000000101011000001011100000110011110110001011011011010111101111110,ZBJAAJSHJSLCJH-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2C3=C(CCC2)C(=CC=C3)F)C4CCCC4,08AFD5C1FDCA335F_C0B9515173924B19_6041_UN,8.129604,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011011010000100110100010000001011101100110001110100001011011011000010101111010,LCWIEFLAKIKCNL-UHFFFAOYSA-N
N(CC1C2CCC(C1)CC2)C(=O)CC3=C(C=CC(=C3)F)F,22606B12E23A2D74_721CFFE367BEC347_6038_UN,7.2788486,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000001000110100110000011000000000110010100000000011010011011110100111110,KOZHEFIRUXSVLF-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(CC3)C4=CCOCC4,5F3B4C0507890688_E5A0B8A96D7CBDEC_6041_UN,7.67368,00000000000000000000001000000000000000100000000000100000010000100110000000001100001000100011000000111100010011001000001011000100110011010110011011010111010111101111110,FINURHBGJRMVAB-UHFFFAOYSA-N
N(CC12CC(C1)CCO2)C(=O)C4=C3C=C(C=CC3=NC(=C4)C5CC5)F,4C0E9F69FC22B0DF_CE25A4F32514433F_6038_UN,8.002207,00000000000100000000001000000000000000000010000000000000010000100110000000000000001000010011100100101100010101101000011011000100110010100110001001010001111111110111110,HREIDGWPEVOKPE-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)N=CC=C2)NC3=C(C=C(C=C3Cl)C56CC4CC(CC(C4)C5)C6)Cl,A80998C62DF1F58A_53DE6FA5357215DB_7022_UN,8.19462,00000000000000000000000000000000000000000000000000000000000000100110000000000000100000010000000000100101010100001000000001000100100001110100001011000011000010101111010,AOCMIYQULGIYKY-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@H]2C3CCC([C@@H]2C(F)(F)F)CC3)Cl)C4CC4,AEB2AE9D9B62BF9D_FF5F577D92BEAE32_7022_UN,7.949769,00000000000000000000001000000000000000000010000000000000000000100000000000000000001000010001000000001001011110001000001000000000110001110000000011010011010110101111010,ATKGEYNERKACND-ZNNPOINPSA-N
CN1C2CCC(C1)CC2CNC(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)F,E0ED8C66E60615E2_80D52DA7FCADBF9E_6038_UN,7.6967535,00000000000100000000000000000000000000000010000000000000000000100010000000010000101001110011110000101001010110111001111001100000110000100110001011011011011110101111110,RQLWRBOHCUUHKG-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC=C2NCCC3CN(C(C)C)CC3,D73E480F7350FE1D_DA1BDE4935744E7F_6041_UN,9.024141,00000000000000000000000000000000000000000010000000000100000000000100000000110000101101110001000010001100110110010000101011100100110101110110001010011111010110101111010,DPPPWKUABPXVOJ-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)Cl,C792DFEC87E42A36_4F3077AF279BC6B8_6038_UN,7.696744,00000000000100000000000000000000000000000000000000000000000000100010000000010000101001110011110000101001010110111001111001100000110000100110001011011011011110101111110,NHRBIGHZEIUIPV-UHFFFAOYSA-N
C[N]1C=CC2=C1N=CC(=C2)NCC(N3CC(C)OC(C3)C)C4=C(C=CC=C4F)F,58A678661644CB63_47EB3ED22E8DEEF4_6041_UN,8.588939,00000000000000000000000000000000000000100010000000000000010000000100000000010101001101110001010110101100010110010001000011100100110011110110011011001111110111101111110,DKQFZTZXIHROSV-UHFFFAOYSA-N
NCCC(OC1=CC(=CC=C1)C2CNCC2)C3=CC(=C(C=C3)Cl)Cl,17C9AB8B516FDA19_BAB38E6C1BE731BB_6035_UN,8.430029,00000000000000000000000000000000000000000000000000000000000000100000000000000000001110110011000011001001100100010100001001000111010110100110001111010011110101100111110,URDCHOMBTKXXFJ-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1)F)N2C[C@H]3[C@@H](CNC3)C4CCOCC4,63A3236CA7A8A2C3_D6806B57BA7DFC33_6034_UN,8.274229,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011000010101100010101000000101011100100110010100110001011011011010111101111110,BRSXEARTCUSPDY-WMZOPIPTSA-N
CC2=CC1=C(C=C(C=C1)Br)N2C[C@H]3[C@@H](CNC3)C4CCOCC4,40DE2BA9E65BB1E1_2753A187C76EF6DD_6034_UN,8.274115,00000000000000000000000000000000000000000000001000000000010000100100000000010000101101110011000010101100010101000000101011100100110010100110001011011011010111101111110,MBJWCBZHNGHLKG-WMZOPIPTSA-N
CN(C)CC1=C(C=C(C=C1)NC2CC3(CC2)CCC3)F,5B9C812B9EACDE35_61FCAE667E5C5EE3_7022_UN,7.7383184,00000000000100000000000000000000000000000010000000000000000000000010000000100000000001110011010010001000110100011001001000100000110001110000001010011111010110101111010,ODOBGQUCJNQTAV-UHFFFAOYSA-N
N5CCOC4(CCN(CC1=NC=C(N=C1)N[C@@H]2CCN(C)[C@H]2C3=CC=C(C=C3)F)C4)C5,1101DFA6EAA64EF5_4E0D650068B1BC65_6041_DP,8.513066,00000000000000000000000000000000000000100010000000000000010000100110000000010101101101110011010111101000110111011001101011100100110111110110001001011011110111101111110,PQFNYXRXUJPSFB-PTCKQWLISA-N
FC1=C(C(=CC=C1)C2CC2)NC4CC(C3=CC=N[N]3C)OCC4,D41756730576BB75_FD43EC94524A3C4D_6041_UN,8.039323,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011011111100000100111010000001011101100110011110100001011011011110011101111110,WZZYMXAQUHBZHH-UHFFFAOYSA-N
CN1C2CCC(C1)CC2COCC(F)C3CCOCC3,D4C160657E978328_57CDD3FE8AEE0AC1_6039_UN,7.2936473,00000000000000000000000000000000000000000010000000000000010000000000000000010000000001100000010001101000010111010001101011100010110010100110000001011000010111111101110,GJSWLJWREVGXEO-UHFFFAOYSA-N
C1CCC(NC1)C3=NC2=C(C=CC=C2)N3CC4CC4(C)C5=NC=C(C=C5)F,0B3B8C09B4304260_3660B72C9A9C0ECD_6034_UN,8.587454,00000000000000000000001000000000000000100010000000000000000000100110000000010101001101010011000010101100110110011001101011100100110000100110001011011011010110101111010,ZCBLHRZRJDRCEU-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2CCOCC2)NC3=C[N](C[Si](C)(C)C)N=C3,9350E43996B02306_A36699DFEACDC05D_6041_UN,6.9220433,00000000000000000000100000001010000000000000000000001000010000100100000000110001100100100001011010101000000001011001001011101100110011010110011001011101010111101111110,BGLRVVJYBUZYCB-UHFFFAOYSA-N
CC1=CC(=C(C=C1)C)[C@@H]2CCCC[C@H]2OCC4=NC3=C(C(=CC(=C3)F)F)[NH]4,FD5DD523C0BABA62_08DB65B15E246708_6039_UN,8.696381,00000000000000000000000000000000000000100010000000000000000000100100000000000101000100010000000110000100110111010000001011000111110010100100001111010111110111001111110,GTGKAUIJEGIVGD-OXJNMPFZSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC5=CC(=C([N]4C=C(C)C=N4)C=C5)F,C42DD4B46EC86695_6809410B109C037B_6041_DP,8.1736555,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011001010100000110100010000001011101100010101110100001011011011000010101111010,AJSPUOKBUIKAIY-KSMMKXTCSA-N
CC1=C(C=C(C(=C1)NC2(CCCCC2)C3CC3)Cl)C4CC4,C4DF4530DEDE828B_2EF9F93788059456_7022_UN,7.8259273,00000000000000000000001000000000000000000000000000000000000000100010000000000000000000010011000000000001100110011000001000000000110001110000000011010011000010101111010,DLUURCJIPYSOMV-UHFFFAOYSA-N
O(CC1CCN1C2CCOCC2)CC3=CC=C([Si](C)(C)C)C=C3,97DEAA2FF8835A6C_D92D097E93710ED8_6039_UN,7.635969,00000000100100000000100000000010000000000000000000000000010000100000000000110000000001100000010101101000000001011000001011100010110011000110010001011110010111111111110,GAHQIRDWQKFKCZ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=NC=N2)NC4C[C@H]3CCC[C@H](N3C)C4,FAA80597044BCBF7_002EC8DE0989A84D_6041_UN,8.316363,00000000000000000000000000000000000000100010000000000000000000000100000000010100100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,XOMFLAUWMFNZGG-AGUYFDCRSA-N
CC1=C(C=C(C(=C1)NCC2CCCC(C)CC2)Cl)C3CC3,4AE45739BB95AEAA_30D143B289C5C11A_7022_UN,7.486636,00000000000000000001001000000000000000000000000000000000000000100000000000000000001000010011000000001001000110000001101000000000110001110000000010010111010110101111010,ZASZOXMZJVXZAV-UHFFFAOYSA-N
N(C1C4C2CC5C3CC(C1C23)C45)C(C6=CC(=CC(=C6)CC)F)=O,6F0FF6273DD77211_2301563832946055_6038_UN,8.28593,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000010001100010000100010100100010010000000000110001100000000001000001001110101111110,FPBWFQGPHXFUFN-UHFFFAOYSA-N
FC2=C(C=C1C=C[NH]C1=C2)NCC3CCCCN(C)C3,5C27A0991C97F3B5_1B3B131CE84A35FD_6041_UN,8.2994375,00000000000000000001000000000000000000000010000000000000000000000100000000010000101101110011010010001100010110010001101011100100110101110110001010011011010110101111010,SWYICKMFHSLNEJ-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=C1)NCCCC3=NC2=C(CCCN2)C=C3,4767A59CC71CB3E4_C0B20683A2AB66D7_6041_DP,7.3585005,00000000000000000000100000000010000000100000000000000000000000000100000000100100001000100011010000101100110000011000001011000100100101010110011011011111010110101111010,DIINXPBVFSGVQL-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CC2=CCSC2(C)C)C=CC(=C3)Cl)C4,885F3454EF06B3A9_B609CD8CF21DFB48_6034_UN,7.936124,00000000000000000000000000000000000010000000000000100000000000000110000000111000011101011010000010011101110110011010101011100100110001100110011011011111010110101111010,DPDCRQMNVRVJIP-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NCC5=NC4=C(C=CC(=C4)F)O5,47A41935098B7E95_187C09F0980C2280_6041_DP,8.213476,00000000000000000001000001000000000000100010000000000000010000000100000000000101101101010011110110101100111100110000111011100100110111110100001001011001110110101111110,PTPNLONVCNEFSF-QDMKHBRRSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC34C(C)(C(CC3)CC4)C,6BF7E98F6EAA92B2_FF2488B37D98F334_6041_UN,8.116314,00000000000000000000000000000000000000100010000000001000000000100110000000110101101100010011011010101000010110001000101011101100110001110100011011011111010110101111010,INLYGAQJFIPYQE-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2CCOC3=C2C=C(C=C3)F)C4CCCC4,A689474FFF60FDC3_8489D6CF007B51B4_6041_UN,8.67882,00000000000000000000000000000000000000100010000000001000010000100100000000010101100100010010011011100100110101010100001011101100010011110100001011011011110011101111110,NILOUFRRHFZNGX-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2CCC(CC2)C3=CC=C(C=C3)F)C4CCCC4,77F2658A76C0F71F_807D5D0EAA500284_6041_UN,7.857097,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010010011010000000100100010000001011101100110001110100001011011011000010101111010,YJEFTZGZELWDES-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NCC3C(CCCC3)C4CC4,8FDD552F959C2F78_DCA651A3DE0B355B_6041_UN,8.081994,00000000000000000000001000000000000000000010000000000000000000100100000000000000101000010011000000101100010100000000001001000100110001110100001011010011010110101111010,RKVGRQVZZYNVTH-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3CC(OCC3)C4=CC=C(C=C4)F,64D05B587C3C3BD5_EF4F948B8EA9F040_6041_UN,7.901901,00000000000000000000001000000000000000000010000000001000010000100100000000010001100100010011011011100000100101010000001011101100110011110100001011011011110011101111110,VMAHRVLIOOZFFL-UHFFFAOYSA-N
CC1=C(N(C(=N1)C2CNCCC2)CC(CC3=CC(=CC=C3)Br)C#N)C,5319B087EB95C77B_4A3EAF95285CEC75_6034_UN,8.14149,00000000000000000000000000000000000000100100001000000000000000100100000000010101101101110011000010101000100110010000101011100100110000100110001011011111010110101111010,OCSGUIVDEUOLKP-UHFFFAOYSA-N
CC4CC1=C(C=NC(=N1)N[C@@H]2CCN(C)[C@H]2C3=CC(=C(C=C3)F)F)C(C)O4,9799A658DA7CDB0F_C4D5DE92473122DC_6041_UN,9.113359,00000000000000000000000001000000000000000010000000000000010000100100000000010101100101110011010011101100111110010001101011100100000011110100011011011111110011101111110,OQCIACKCYKIERY-NUEMCUDVSA-N
CC4=CC1=C(C=C(C=C1C)NCC2CN(CCO2)C3CC3)[NH]4,E4F8E183BF442837_6D15B708D99C8D9C_6041_UN,7.7744946,00000000000000000000001000000000000000000000000000000100010000100100000000010000101101100011000110101100010001010000001011100100110111010110001001011101110111101111110,ZGNIZGRWSPCFOR-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2CCC3(CC2)CC3)F,DE1EEA1C5F6ECF40_EC638A9C731327A8_7022_UN,7.945698,00000000000000000000001000000000000000000010000000000000000000000010000000100000000001110010010000001000110100011001001000100000110001110000001011011111010110101111010,VMGLDPCULAZGJE-UHFFFAOYSA-N
C[N]1C=C(N=C1)CCC4=C(C2=C(SC3=C2CCC(C(C)(C)C)C3)N=C4)C5=CC(=CC=C5)F,84E33B23B41CA421_97E679F7B7D28DAA_2201_UN,8.396146,00000000000000000000000000000000000010000010000100000000000000100110000000110101010101011000010010100100010110011000101011100100110000100100011011011110000110101111010,PZWOTDCVDPGEKB-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NCC3=CC2=C(NCCC2)C=C3,5217F622B74D2361_6670769C5565A91F_6041_DP,7.8122807,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100011010000101100110000011000001011000100100101010110011011011101010110101111010,BAUISYQORLQOLR-UHFFFAOYSA-N
CC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3CC3)C=CC=C4Br)C,E3D53DB7A3D1C7F6_69F6793DA8969B4A_6034_UN,8.947057,00000000000000000000001000000000000000000000001000000000000000100100000000010000101101110011000010001100010110000000100011100100110000100110001010011111010110101111010,KCYNGFLDTMDRAU-GJZGRUSLSA-N
N2CCC(OC1=C(C=C(C=C1Cl)C#N)Br)CC2C3=CC=CC=C3,FBEF90B6B556793A_97B91E26D40D6FDF_6035_DP,8.031871,00000000000000000000000000000000000000000100001000000000000000100000000000000000001000010001000001101001100100010100001001000111110010100100001111010011110011100111110,SWXLAOXZUDGZNK-UHFFFAOYSA-N
N2CCC(OC1=C(C=C(C=C1F)C#N)Br)CC2C3=CC=CC=C3,EEFB5518B03217F9_D5E20CE06252D57E_6035_DP,8.031862,00000000000000000000000000000000000000000110001000000000000000100000000000000000001000010001000001101000100100010100001001000111110010100100001111010011110011100111110,IBJWOUZILLJAJI-UHFFFAOYSA-N
CN5CCCN(CC1=C(C=C(C=C1)NC2=CC4=C(C=C2)OC3(CCCC3)O4)F)CC5,09F27D6D8653AEEE_7A2A0C7997466C93_6041_UN,7.765735,00000000000000000001000000000000000000000010000000000000010000000000000010010001100101110000010011001100010110011101101011110100110011110110001011011011110111111111110,FVPVJMROJRXMOV-UHFFFAOYSA-N
N2CCC(OC1=C(C=C(C=C1Br)C#N)Br)CC2C3=CC=CC=C3,C9E93F3B736C865E_2F31F390493F4DC6_6035_DP,8.031863,00000000000000000000000000000000000000000100001000000000000000100000000000000000001000010001000001101000100100010100001001000111110010100100001111010011110011100111110,RRCGGWLBAWRRNC-UHFFFAOYSA-N
N2CCC(OC1=C(C=C(C=C1Cl)C#N)Cl)CC2C3=CC=CC=C3,3F33EDCDF10DDE91_2F5853D4A35DDBAC_6003_DP,8.03184,00000000000000000000000000000000000000000100000000000000000000100000000000000000001000010001000001101001100100010100001001000111110010100100001111010011110011100111110,UMUMAHKXDSZOJH-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CC3(C)COCCN3CC4=CC=CC=C4)C5=CCNCC5)F,21B16E4ED8727C4F_6CE231603C23A502_6034_UN,8.564068,00000000000000000000000000000000000000000010000000100000010000100110000000011001001101110001000111111100110111011001101011100100110010100110001011011011010111101111110,GTNKQDGMXAGXGZ-UHFFFAOYSA-N
ClC1=CC=C(C=C1)C2=CN(C(=N2)C3NCCC3)CC4[C@@H]5CNC[C@H]45,79E7A5E30BB0DD2A_2C15912D9783B003_6034_UN,8.924983,00000000000000000000001000000000000000100000000000000000000000100100000000010101001101110011000010101001110100010000001011100100110100100110001011011011010110100111010,LXTZUBYHEFORRW-RYTJFDOTSA-N
ClC1=CC=C(C=C1)C2=C[N](C(=N2)C3NCCC3)CC4[C@@H]5CNC[C@H]45,79E7A5E30BB0DD2A_D6988C2D3F172AC4_6034_DP,8.924957,00000000000000000000001000000000000000100000000000000000000000100100000000010101001101110011000010101001110100010000001011100100110100100110001011011011010110100111010,LXTZUBYHEFORRW-RYTJFDOTSA-N
FC1=CC2=C(C=C1)N=CC(=C2)NC3CCN(C)C34CCCNC4,F226ED96861479F0_6FFF9B98A93C4D98_6041_DP,8.46688,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,SJLOWOBUWOSCRS-UHFFFAOYSA-N
CC4=CC1=C(C=C(C=C1C)NC3(CC2=C(C=C(C=C2)F)F)CCOCC3)[NH]4,096A8735950BBFDC_DDEB84F70B673EA9_6041_UN,7.9375863,00000000000000000000000000000000000000000010000000000100010000000110000000000000100100110010000011100100110101011000001011000100110111110110001011010111010111101111110,OUMDHFJOOJMCRS-UHFFFAOYSA-N
CCN3CCC1=C(C(=CC(=C1)NC(CC)C2CCCO2)F)C3,362126638EB99487_5D7D2F087D939711_6041_UN,7.793074,00000000000000000000000000000000000000000010000000000000010000000000000000010000000101110011000110101100110111010010101011100000110011110110001011011101110111101111110,DTAFNAHXHHMOGP-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CC(=N2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C,F148FB64E55F39FC_7C818DF61502BC79_6041_DP,8.0975685,00000000000000000000000000000000000000100010000000000100000000100100000000000100101000110011000000101100110100010000001011000100110101110110001001010111010110101111010,LNYFVKBXGUCTBO-GHTZIAJQSA-N
CN3CCOC(COCC1CC2(CO1)CCOCC2)C3,CB89AD095F1DCD36_432A958D6FDBF7E1_6039_UN,6.99946,00000000000000000000000000000000000000000000000000000000010000000010000010010000000101100000010111101000010011011001101011100010110010000110100001111000110101111101110,XRQJOSFBEADNHG-UHFFFAOYSA-N
NC1=CN(C2=C1C=CC(=C2)Br)C[C@H]3[C@@H](CNC3)C4CCOCC4,3F8D94412DDECD6B_D9766A1E47E9850B_6034_UN,8.770371,00000000000000000000000000000000000000000000001000000000010000100100000000010001101111110011000010101100010101000000001011100100110111110110001001011011010111100111110,LLMALVZAPDJWLN-BBRMVZONSA-N
FC1=CC2=C(C=C1)C(=CC=N2)NC4C[C@H]3CCC[C@H](N3C)C4,7FFD10476FEA899B_7677DFB9258FD9F2_6041_UN,8.253988,00000000000000000000000000000000000000000010000000000000000000000100000000010000100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,KXZFNJDJKKTDDM-GOOCMWNKSA-N
FC2=C(C=C1C(=CN(C1=C2)CC3CCNC3CC)CC#N)F,667134595A4F9274_D03A08BC3F978A58_6034_UN,8.54964,00000000000000000000000000000000000000000110000000000000000000000100000000010000101101010011000010001100110110010010001011100100110000100110001010011011010110101111010,CBDOTCFXQKDOPJ-UHFFFAOYSA-N
C2(=C1OC=CC1=CC(=C2)F)NCC3C(CC)CCCC3,1ABDC81459940E97_2A392FDEB3573E71_7022_UN,7.9117575,00000000000000000000000000000000000000000010000000000000010000000000000000000000001100010011000110001100010110000010101000000100110001110100000001010011110110101111110,PKYJKRJLXKXAOO-UHFFFAOYSA-N
N3CCC1=C(C=CC(=C1)NCC2(CN(C)C)CCCC2)C3,391B4C0E69B1D200_19DF79609B725157_6041_DP,7.0786653,00000000000000000000000000000000000000000000000000000000000000000010000000100000101001100011010010101100110010011001001001100000110101010110001011011101010110101111010,JIEMUOZUMGBYIY-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=C1)NCC3CCC2(CCNCC2)CC3,BE5FD56807838A90_7DBD122749C4EE13_6041_DP,7.3375406,00000000000000000000100000000010000000000000000000000000000000000010000000100000001000100011010000101000110000011000001001000000110101010110011011011111010110101111010,HGLVYNMYXJKNHS-UHFFFAOYSA-N
O(C3CCN(CC1=CC=CC=C1)C2(CC2)C3)CCC4CC(C)(C)OC4,4DC9179AC84BE27A_313DAC06D7800D97_6039_UN,8.206595,00000000000000000000001000000000000000000000000000000000010000000010000000110000000101100000000011101000010011011001101011100011110010000110000101011100110111111111110,IMNLGSRESUMALH-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NCC3(C2=CC=CC(=C2C)C)CC3)F)C4,4C52DE63A74C9A68_2FA0128FE088D075_6041_UN,7.978036,00000000000000000000001000000000000000000010000000000000000000100010000000010000001001110011000000101100010110011010101001100100110001110110011011011111010110101111010,DJCSDQDMBWLVRD-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC(C3CNC3)F,F1092FD1F916E5DB_5503D0E836CD8539_6041_DP,8.258201,00000000100100000000000000000000000000100010000000000000000000000100000000000100001000110011000000101100010110000000000011000100010101110110001011000111010110101111010,KIPMVSHMTADZDJ-UHFFFAOYSA-N
ClCC1=CN(C(=N1)C2=CC=CS2)CC34CCC(C3(C)C)CC4,718A26198A41D24A_C238E44452D3090B_6034_UN,8.346327,00000000000000000000000000000000000010100000000000000000000000100110000000110101010101001000000010001001010010011000101011100100110000100110001010011110010110101111010,RLPZBTWEIDKDRU-UHFFFAOYSA-N
C2(=C1OC=CC1=CC=C2F)NCC3CCCCC3(C)C,2761E1FC775EF3A2_31F3E2B4D6E789E7_7022_UN,7.593611,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010011000110001100010110001001101000000100110001110100000011010111110110101111110,QUZQKLYJYYJPRB-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3=CC=CC=C3)C(=CC(=C4)F)F)C5,C2F0EA3BD2FA44F6_5FC968BAF4FD1D56_6034_UN,7.964898,00000000000000000000000000000000000000000010000000000000000000100110000000110000101101110011000010001100010100011001101011100100110000100110001011011111010110101111010,PZVJTVYJGQZXBU-UWJYYQICSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3(CC3)C4=CC(=C(C=C4)F)F,B982F029F1C56823_8CC02B786397F7EB_6041_UN,8.170781,00000000000000000000001000000000000000100010000000000000000000100110000000010100100101110010010010101000100110011001101011100100010001110100001011011011010010101111010,GPZUZTXQFQWEBY-KRWDZBQOSA-N
C([C@]12C[C@H]1COC23CCC3)=CC4=C[N](C)N=C4C5=CC=C(C=C5)F,F5C9B38184743776_B0D10E307F97BC48_7019_UN,7.4573784,00000000000100000000001000000000000000000010000000001000010000100110000000010000100100010000011010110000010101001000001011101100110010100100001011011010110011101111110,MDCARVUYPTYKGP-LPHOPBHVSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC(N3CCCC3)C4=CC=CS4,25C90CDABC011B7C_D7CB4E2C78DE44E5_6041_UN,8.187053,00000000000000000000000000000000000010100000000000000000000000000100000000010101011101101001000010101100010010010000001011100100110001010110011011011111010110101111010,ZKGBBEBLXKRRLP-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2N=CC(=CC2=CC=N3)Br)C4,BA640E46EF73A3A4_DCB1B8E4060E163C_6035_UN,8.434692,00000000000000000000000000000000000000000000001000000000000000000100000000100001000001110000110111101100010100100101011011100111110000100100001101011110110111101111110,SQKNRIFMZQBGND-MAQMMGONSA-N
C[C@@H](OCC(OC)C1CCCOC1)C2=C(C=C(C=C2F)F)F,ABD53B005F3B7FF6_139C334C1CE245B2_6039_UN,7.9510956,00000000000000000000000000000000000000000010000000000000010000000000000010000000000000110100010000100000000111000000101000000010110010100110000011110110110101011011110,RYRQHKIDUZRNEI-RWWNRMGGSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC(C)C3CCCC3,8B1C1FD230A656CA_5109547E502045B7_6041_UN,7.959157,00000000000000000000000000000000000000000010000000001000000000000100000000010000101100010001011010001100010110000001101011101100110001110100001000011101010110101111010,UFIAQSZRMDZHHV-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)COC2)[S](C3=CC4=C(C=C3)C=NC=C4)(=O)=O,67D2739647C36D99_7FA18B52EDC4DA95_6029_UN,8.558706,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100101000001010101110011001001000010011001100111000001110001011101001010111110111110,DBHAXFGFMIHVCZ-UHFFFAOYSA-N
FC2=C(C(=C1N=CC(=C(C1=C2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5)C#N)F)F,443AF2E6E7A3A646_512CEC0CAF4E43C7_6041_UN,8.010311,00000000000000000000001000000000000000000110000000000000000000000110000000100000101000010011000000101100010100001001101001000100110001110100001011010111010110101111010,VJCMXBLSLLDIAD-UHFFFAOYSA-N
N(C1C2CCC1CCC2)C(=O)CC3=C[NH]C4=C3C=C(C=C4)F,167AB53318A4FBE3_7CD3E3843A7400CB_6038_UN,7.7360706,00000000000000000001000000000000000000000010000000000000000000000100000000000000000100010011100010000100110100110000011001000100110111100100001001010001001110100111110,FFHSZEVYUQKSBW-UHFFFAOYSA-N
CN1C4CCC1CC(NC(=O)C2(CCC2)C3=CC(=C(C=C3)Cl)F)C4,8362B75DEFD4234C_2A49D78AEF8E7582_6038_UN,7.7832255,00000000000100000001000000000000000000000010000000000000000000100010000000010000100101010011110010100001110110111000111001100000110001100100001011011011001010101111110,OCBCCOYKPBGLKX-UHFFFAOYSA-N
CN1C4CCC1CC(NC(=O)C2(CCC2)C3=CC(=C(C=C3)Cl)Cl)C4,7F3F77F00F30FD5F_E5AC8D8234B80CA4_6038_UN,7.7832065,00000000000100000001000000000000000000000000000000000000000000100010000000010000100101010011110010100001110110111000111001100000110001100100001011011011001010101111110,NWJQCSVKBGCFCL-UHFFFAOYSA-N
CCCC(NC(=O)CC1CC2CCC1O2)C3=CC(=C(C=C3)Cl)Cl,4803D609A8082DAA_07387CE85D4EFC62_6038_UN,8.003001,00000000000000000000000000000000000000000000000000000000010000000000000000000000000100010011100010000001110100110011011000000000110010100100000011010011101111111111110,LNVINMJLZSBQNL-UHFFFAOYSA-N
CC5(C)CCC1=C(C2=C([NH]1)C=CC(=C2)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F)C5,B7469D2A19993B0B_3F18B3B3F5D510BB_6041_UN,7.437937,00000000000000000000000000000000000000000010000000000000010000100110000000100000001100010011000011001100110101011001101011000100110111110110001011010111110111101111110,WPHNMECPGMRBIH-XDHUDOTRSA-N
FC1=CC2=C(C=C1)C(=CN2CC=CCC(C)C)C3=CCNCC3,E860A3E6AEC86631_8C3AA659977DAE61_6034_UN,9.177579,00000000000000000000000000000000000000000010000000100000000000100100000000111000001101110001000010111100110100010001001011100100110000100110001001011101010110101111010,QIGUFYFFHMJYLM-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2C3(C2)CCOCC3)Cl)C4CC4,513FD417E32B57FA_5B7152DDCA9FCEBA_7022_UN,7.7457123,00000000000000000000001000000000000000000000000000000000010000100010000000000000000000110011000000100001110111011000001000000000110011110110000011010011010011101111110,XKCXWHXIYKABJH-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1C[C@@H]2CC(C)(CN2)C)C=CC(=C3)Cl)C4,F6EBD2D39EB07D92_57FFA270C9D34A8F_6034_UN,8.013826,00000000000000000000000000000000000000000000000000000000000000000110000000110001001101010011000010001101110110011011001011100100110101100110011011011101010110101111010,FIFVPRBUWWVPLC-LYKKTTPLSA-N
FC2=C1C=NC=CC1=C(C=C2)NCC3CCCCN(C)C3,B23C376443969F71_6B0A7B649FCBDF31_6041_UN,8.450711,00000000000000000001000000000000000000000010000000000000000000000100000000010000101001110011010000101100010110010001101011100100110001110110001001011001010110101111010,ZATYGXGYEZGJMN-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NCC3C(C3)C4CCCC4)C,D174C8BB91B414D9_B8E2244C4FD09ACA_6041_UN,8.285683,00000000000000000000001000000000000000000010000000000000000000100100000000000000101000010011000010101100010110000000001001000100110001110100001011010111010110101111010,ARSNJVGWEIUQRA-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NC[C@H]3[C@H](C2=NC=C[N]2C)OCCC3,D44A24AC1BEBCBFA_4B3B3C548899C7EC_7022_UN,8.185853,00000000000000000000000000000000000000100010010000000000010000100100000000010101001101010011010111111000000101000000001011100100110010100110001011011011110111101111110,ZCNANAQMONZXGM-WMLDXEAASA-N
C1(=CC2=C(C=C1)[NH]C3=C2CCCC3)NC4=CC=C(CC[Si](C)(C)C)C=C4,EBD6407FBE058C8B_0ACDCD8FF5BC84C3_6041_UN,7.6989574,00000000000000000000100000000010000000000000000000000000000000000100000000100000000100100011010010000100110000011001101001000100110101010100011011011101010110101111010,PFTRWPHQDWARJL-UHFFFAOYSA-N
C(C2C1CC3CC(C1)CC2C3)=CC5=CC=C(C4=CC=C(CC)C=C4)O5,10A5CBC671B6E478_BAEF5BC31D663317_7019_UN,8.524606,00000000000000000000000000000000000000000000000000000000010000100000000000000000000100000000000010010100010000000010000000000100100000000100000001000000100100001011110,ZOUCSRCNGQTBQS-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)C=CC2=C(C=N[N]2C)C3CC3)OC(OC4)C5=CSC=C5,0CF4F385B8E27967_E62DCF25A94089CB_7019_UN,8.426877,00000000000000000000001000000000000010000010000000001000010000100100000000010000100100011100011010110100010101000100000011111100000000100100001011011010110011111111110,TVIWNIWBUOLBHU-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N=CN=C2NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,78A0A8A9B506D60D_906D30E10A0E0CF9_6041_UN,8.324816,00000000000000000000001000000000000000100010000000001000000000100100000000010101101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,YGCQCSNYGMOAKP-VLIAUNLRSA-N
CCNC5CCC1=C(C4=C(N1C[C@@H](C)C2=CC3=C(C=C2)OCCO3)C=CC(=C4)Cl)C5,3CCB707ABE539755_0493D6FCCF9A4B3B_6034_UN,7.910616,00000000000000000000000000000000000000000000000000000000010000000100000010010000001101010010000010101101110111010111001011100100110011100110001011011101110111111111110,XIQDCZCSMUULRE-VTBWFHPJSA-N
ClC1=C(C=CC(=C1)NCC2=NC=CN2CC4[C@@H]3C[C@@H](C3(C)C)CC4)Br,9F81055D1D3DE6C2_527081BB49DE2C26_6034_UN,8.124505,00000000000100000000000000000000000000100000001000000000000000000110000000110101001101010001000010001001010110011000101011100100110001110110001011011111010110101111010,IQUXZPMDPONFKK-DSUHRAPHSA-N
FC1=C(C=CC(=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)C#C,3C8A6FAE2428BA63_E42BDF1411A5B579_6041_UN,7.6412134,00000000000000000100001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,QSARIDCSOBBMSA-IERDGZPVSA-N
N(CC1CC2CCC(C1)O2)C(C3=N[N](C)C(=C3)C4=CC=C(C=C4)F)=O,366CA221DDA6FD27_CE076EC9112E75AB_6038_UN,7.940686,00000000000000000001000000000000000000000010000000001000010000100100000000010001101100010010111111101000010100100000011011101100110010100100001011011011111111111111110,CWSNRCWCYNQQCH-UHFFFAOYSA-N
C1(=CN=C(C=C1)C2OCCO2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,8846E057B7376CC9_BE221C5B2A7AE7F3_6041_UN,7.6771274,00000000000000000000000000000000000000000010000000000000010000100100000010010001000101110000010110101000000101010001101011110100110011110110001011011011010111111111110,QUOAFWNWDBTYLG-UHFFFAOYSA-N
C1CC(NC1)C2=NC(=CN2CC3CCCN3C)C4=CC=CS4,BE5C1B74ECC182B9_EE5525776AE28AAF_6034_UN,7.857464,00000000000000000000000000000000000010100000000000000000000000100100000000010101011101101011010010001000100010010001101011100100110000000110001010011011010110101110010,ZEJMTCQKOAZNQA-UHFFFAOYSA-N
BrC1=CC=C(C=C1)N2C=CN(C2=O)C[C@H]4N[C@H]3CCO[C@H]3C4,9C1EB9150FC109B2_9D0452372416894C_6034_UN,8.399011,00000000000000000000000000000000000001000000001000000000010000100100000000010101000101010011000111001100111101110100011011100101110011110110001110011011111111110111110,UFRYWRCVCWKCGK-QEJZJMRPSA-N
ClC1=CC=C(C=C1)N2C=CN(C2=O)C[C@H]4N[C@H]3CCO[C@H]3C4,CA4F903534213AEC_E1A05806CEAA97C8_6034_UN,8.399012,00000000000000000000000000000000000001000000000000000000010000100100000000010101000101010011000111001101111101110100011011100101110011110110001110011011111111110111110,BSCFKLCTBCIKRA-QEJZJMRPSA-N
FC1=C(C=C(C=C1)CC#N)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,1E77D23FC100587C_AE577D6227376708_6041_DP,7.115886,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110100111010,TVJGEPOPJRZNJF-FUHWJXTLSA-N
CC1=C(C=CC(=C1)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,FCFDDC55A134BFA6_9D04D6427B727652_6041_UN,7.7788887,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000110010000001011101100110001110110001011011111010110101111010,JLMBRWBIFGANKT-QRWLVFNGSA-N
O(CC2CCOC1(CCC1)C2)CCC3N(C)CCCC3,A2071561A772265C_A2A4063A1E7370DF_6039_UN,6.778609,00000000000100000000000000000000000000000000000000000000010000000010000000010000000001100000010001101000010011011001101011100010110010000110000001011010110111111101110,SRBBOQOFDQWXTP-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCCCC3)C4=CC=C(C=C4)F,E693ECB88E5DF926_87D140613CA5ECE4_6041_UN,7.5780582,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100110001110100001011011011000010101111010,RLLYWMPBTVCBGB-UHFFFAOYSA-N
FC2=C(C=C1OC=CC1=C2)NCC4=C(CN(C)C3CCCCC3)C=CC=C4,5527B38428AE4709_DBAC2D5B0B8E7B95_6041_UN,8.28417,00000000000000000000000000000000000000000010000000000000010000000000000000000000001101110001010011001100010110010001101000100100110001110110001011011011110110101111110,COCQMOKZACWIBS-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=N3)N[C@H]4C6=C(OC5(C4)CCC5)C=CC(=C6)F,6B65DBDF481BDEC0_40296B842D76BEB8_6041_DP,8.05513,00000000000100000001000001000000000000000010000000000000010000000110000000000100100101010011010011100100111100011100101011100100110111110100001011011001100011101111110,IDZNYHOYCLVLFH-SFNKJDCFSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4CC(OCC4)C5=CC=C(C=C5)F,40E9015BC83AC4EC_10F48B6056CEA352_6041_DP,8.374416,00000000000000000001000000000000000000100010000000000000010000100100000000000101100101010011010011100000110101010000101011100100110111110100001001011001110011101111110,HPCGPTBCGGJOOF-QLKRIMAFSA-N
CC1=C(C=CC=C1Cl)NCC2=NC=C[N]2CC3CNCC34CNC4,CD524BACE2AEC3CF_D4D95529084DE8F3_6034_DP,8.300704,00000000100100000000000000000000000000100000000000000100000000000110000000010101101101110011000010001001010110011000000011100100110101110110001010001011010110101111010,GAPXOLZTRBMWIA-UHFFFAOYSA-N
FC2=C1SC=C(C1=CC=C2)NCC3C(CC)CCCC3,0078E4A8AF719470_5D550751E90E75E1_6041_UN,8.024692,00000000000000000000000000000000000010000010000000000000000000000000000000000000011100011011000010001100010110000010101000000100110001110100000001010011010110101111010,UNNZTEURNRIFSD-UHFFFAOYSA-N
CC1=C(C4=C(N1CC2=C(ON=C2Br)C3CC3)C=CC=C4)C5CCNCC5,5A157BFF885557AF_F5DD9EDAF7890B6F_6034_UN,8.581711,00000000000000000000001000000000000000000000001000000000010000100100000100010000101101110001001011101110110110010000101011101100110000100110001011011011110110101111110,XMJGVSPCKKJGMO-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2(CC2)C3CCCC3)Cl)C4CC4,E3EBDB6675F49FB4_A55634918F1A62D6_7022_UN,7.7814684,00000000000000000000001000000000000000000000000000000000000000100010000000000000000000010011000010000001100110011000001000000000110001110000000010010011000010101111010,AEVLVDHAHKIUOX-UHFFFAOYSA-N
O[C@H](CCl)C1=CC=C(C=C1)NCCC3CCN(C2CCN(C)CC2)CC3,EA5F70FA05B0217C_87D5139A9CCF7FF3_6041_UN,7.9674597,00000000000000000000000000000000000000000000000000000000000000100000000000010000101001100001010000101001100000010001101011100000110111110111001001011001110111101111110,MVYRKVNXCHYBKU-OAQYLSRUSA-N
C1(=C(C=CC=C1)C2CCO2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,C9C4D9FB6C9170F6_0BC96F9A10A1AB4A_6041_UN,8.694199,00000000100100000000000000000000000000000010000000000000010000100000000000010001100101110011010011001000100111010001101011100100000011110110001011011011110011101111110,IMUHTBCOFXZLBX-ITIDOPETSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC3=CC(=CC=C3)C4CNCCO4,749F85E8CD33A20A_DC115F0F22A86D1D_6035_UN,8.374501,00000000000000000000001000000000000000000010000000000000010000100010000000000000001010110011000101101000100101011100001011000111110110100110001101010011110101110111110,NFCVJWSWNDSKKD-UHFFFAOYSA-N
CC1=C(N=C(N1CC3CCCN(CC2=CC=C(C=C2)I)C3)C4CCCN4)C5=CC=CC=C5,C868D70028A2D6D4_5A0E94786E2F2612_6034_UN,8.417162,00000000000000000000000000010000000000100000000000000000000000100100000000010101101101110011000010101000100100010000101011100100110000100110001011011011010110101111010,HGNPXBIRLRHELT-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)CCC#N,F8D99A1C7619B3F3_66BD3BF833CCCA4E_6041_DP,7.832162,00000000000000000000000000000000000000000110000000000100000000100100000000010101101101110011010010001000000110010000001011100100110101110110001010011011010110101111010,SASUXYBVOWSWSB-DZGCQCFKSA-N
COC1=CC2=C(C=C1)N(C=C2Br)C[C@H]3[C@@H](CNC3)C4CCOCC4,092D1C3F63BC7ACE_4DAB69B90ED724EF_6034_UN,8.216138,00000000000000000000000000000000000000000000001000000000010000100100000000010000101101110011010010101100010101000100001011100111110010100110001101011011110111111111110,JUBFDBIFMJGIDO-YOEHRIQHSA-N
CN(C)CC1CCCCC1OC2=C(C=C(C=C2)Br)C3=CC=NO3,D997111C050F2BC8_00A08ACBD469F1C8_6035_UN,7.9202666,00000000000000000000000000000000000000000000001000000000010000100100000100100000000101110100011011001010000110000101001011101111110010100100001111011110110101111111110,FPNJBUVLDOYCFU-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC4CC3(CCNCC3)C4,C60D18B392499356_650A6210DC2C3196_6041_DP,7.6245866,00000000000100000000000000000000000000100010000000000000000000000110000000000100001000110011000000101100110110011000001011000100110101110110001011010111010110101111010,NUTNVTDXOPHIFU-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)N[C@@H](CC)C3=CC(=C(C=C3)C)F,E9D3D645B094EDC9_60A77F36846418E7_6041_UN,7.9356565,00000000000000000000000000000000000000100010000000000000000000100100000000010100100101110000010010101000100110010011101011100100010001110100011011011111010110101111010,OCTLOILZMHKJPG-OALUTQOASA-N
FC1=C(C=C(C=N1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,19D76EA6C1428FE9_FF6D7087D4B76505_6041_DP,7.444393,00000000000000000000000000000000000000000110000000000100000000100100000000000001101000110011000000101000100100010000001011000100110101110110001011010011010110100111010,BKOGBZLSYPSRRR-WMLDXEAASA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=N3)CC4(CCCN(C)C4)C,9C85D7DD78B46EA1_12FE63AB5D0945FE_6034_UN,7.747059,00000000000000000000000000000000000000100000000000000000000000100110000000010100101101100011010010101100110010011001101011100100110000000110001001011101010110101111010,KEJMBZIIPUHFLG-UHFFFAOYSA-N
CN1C(CCC1)CC=CC3=CC=C(C2=C(F)C=CC=N2)O3,D48EF549A0BB8DB5_0550C569EE14ABD3_7019_UN,8.406735,00000000000000000000000000000000000000000010000000000000010000100100000000010000000101110000010110111000000110010001101011100100110000100100001010011010110110101111110,XEFCXFDMQASIRC-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NCC34CC(C)(CC3)CO4,EA6D57D525B6FFE6_0EF60C7D2B3299FE_6041_UN,7.51296,00000000000000000000000001000000000000000010000000000000010000000110000000010101001101010011010110101100011111001001101011100100110011110110001011011111110111101111110,IKBBOEFUTMQCJF-UHFFFAOYSA-N
C1(=C2C(=NC=C1)[NH]C=C2C3CC3)NC(CC)CC4=CC=C(C=C4)F,3836B774B4F9EB65_E3200F007078A9B9_6041_UN,8.402072,00000000000000000000001000000000000000100010000000000100000000100100000000000100100100010001000010100100110100010010100011000100000101110100001001010001000110101111010,JNKORSILCBDSCU-UHFFFAOYSA-N
C(C1(CCC1)C2CCCCO2)=CC4=C(N3CCN(C)CC3)C=CC=C4Cl,E97E9829D95AC384_063D50A23A5EC17C_7019_UN,7.3990474,00000000000100000000000000000000000000000000000000000000010000100010000000010001000001110000010000111001000101011001101011100000110011110110001011011010110011101111110,VORKCXOPMOJXOB-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N=CC(=C2)NC4C[C@H]3CCC[C@H](N3C)C4,31B6F490F4259D33_5445708A0F2C7421_6041_UN,8.335062,00000000000000000000000000000000000000000010000000000000000000000100000000010001100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,CCQJYNVRCJOUCH-ZXFUBFMLSA-N
C(C1=NOC(=C1)CC2CC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,8589A0A952D13026_93CD290761841817_7019_UN,8.523103,00000000000000000000001000000000000000000010000000000000010000000100000100000000000101010000011011010010000110010000101011101100010011110100001010011010100110101111110,HXZKURYJPWIXTJ-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC[C@@H]3C[C@H](CO3)C4=CC=CC=C4,77F7490E1700094E_AA32C48ACB129A1D_6041_UN,8.30817,00000000000000000000000000000000000000000010000000001000010000100100000000010000101100010011011110001100010101000000000011101100110011110110001001001001110111101111110,URLFYLGLCDHKJF-WBVHZDCISA-N
N(C1C2CC(C1)C3CC23)C(C4=CC(=CC(=C4)CC)F)=O,D0F696A3B0712222_42BF08DDAA772204_6038_UN,8.413524,00000000000000000001001000000000000000000010000000000000000000000000000000000000000000010011100010000000110100110010010000000000110001100000000001000001001110101111110,CFBMLQKAPCNYEL-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC3CC(C2=CC=N[N]2C)OCC3)F,0FDE44AF1CC0672E_8BF33A2306703B9B_7022_UN,8.0420885,00000000000000000000000000000000000000000010000000001000010000100100000000110000100101110010011111101000100111010001001011101100110011110110011011011111110111101111110,WNFQEQOIQCXECW-UHFFFAOYSA-N
FC1=C(C(=CC=C1)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,B3DAF41341A315E8_5595CD08BAC8E5D8_6041_UN,8.168078,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,JFPKZGMMECSLDK-YJYMSZOUSA-N
CCN4CCC1=C(C(=CC(=C1)NC3(CC2=CC=C(C=C2)F)CCCCC3)F)C4,57F94E812280DB36_4AA1866501C7B691_6041_UN,7.7598753,00000000000000000000000000000000000000000010000000000000000000000010000000010000000001110011000000101100110110011010101001100100110001110110001011011001010110101111010,VMDBLSGQUKEROQ-UHFFFAOYSA-N
CC1(C)OCC2=C1N=C(C(=C2)C#N)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,5F47F8D35BF82C91_6AA9B99A5F8767BF_6041_DP,6.8994546,00000000000000000000000000000000000000100110000000000100010000100110000000100100101100110011000111101100110111011000101011000100110101110110001011010111110111101111110,UKXMRNDHVOTJOW-PKOBYXMFSA-N
FC1=CC2=C(C=C1)[NH]C(=C2)NC3CCN(C)C34CCCNC4,AF85AD224CED55BB_9F5DB8679A347535_6041_DP,8.240498,00000000000000000000000000000000000000100011000000000100000000000110000000010101101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,VRLSYRWDAXPRID-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC(CC)NCC3=C(C=C(C=C3)Cl)Cl)C4CCNCC4,140699C058D98ABD_11410F6B812D7D46_6034_UN,8.709504,00000000000000000000000000000000000000000010000000000000000000100100000000010001001101110001000010101101110110010010101011100100110100100110001011011011010110101111010,CHZKWAXIRYVAGW-UHFFFAOYSA-N
CO[C@@H]1C[C@H](NC1)C2=NC=CN2CCC4CC3=C(C=CC=C3)CN4,2550876B4729DA46_7C4404964D2139C3_6034_UN,8.617705,00000000000000000000000000000000000000100000000000000000000000100100000000010101101101000011010111101100110000010000101011100111110110000110001111011011110111101111110,OULPVNAIMWZEFU-RWZMTBSZSA-N
CN(C)CC1=C(C=CC(=C1)NC3CCOC2(CCCC2)C3)F,D8520BF0A0DF2248_300C9969ACAEC036_7022_UN,7.2834983,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110011010011101000110101011001001000100000110011110110001011011111110111101111110,KFXHDVBVPLWADF-UHFFFAOYSA-N
N(CC1CC2CC1C=C2)C(=O)C3CC(F)(C3)C4=CC=C(C=C4)F,61047AE6B256656B_4CBF29D7A686E690_6038_UN,7.307555,00000000000100000000000000000000000000000010000000000000000000100010000000000000001000010011100010011000010100101000010000000000110000100000000001000001011110100111110,JBXNRFLRYYERJN-UHFFFAOYSA-N
C[N]1N=C(N=C1N[C@H]2[C@@H](CCC2)C3=CC=C(C=C3)F)C4CCC4,1BF7848B44651814_A8514CD6D218FB81_6041_UN,8.024978,00000000000100000000000001000000000000100010000000001000000000100100000000010101100100010011011010000000101100010000001011101100010001110100001010011011000010101111010,WGWPVIABKNBRIF-JKSUJKDBSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CC3(NCC2)CC3)F,D4C1A07118FE8F3A_D1BA8E76307F303C_6041_DP,7.3531494,00000000000000000000001000000000000000000010000000000000000000000010000000100000001001110011010000101000110100011001001001100000110101110110001011011111010110101111010,SZSQHDXVKUXTBK-UHFFFAOYSA-N
CC(C)(C#N)C1=C(C(=CC=C1)NCC23CC2CNC3)F,40C0B2ABBD9C65A3_9A88A90BFD1798A5_6041_DP,8.04188,00000000000000000000001000000000000000000110000000000100000000000010000000100000101100110011000010101000010100001000000001000000110101110110001011000111010110101111010,WJNWPULWQYSEAX-UHFFFAOYSA-N
[NH]1C=CC2=C1C(=CC=C2)SC(C4=CC3=C(NCCO3)C=C4)=O,AFE52D54F081CE39_1E9AB5BFF891E69E_6038_DP,9.169761,00000000000000000000000000000000000000000000000000000000010100001100000000000000011100001001000110101100110001010100001011000100000110010110001011010001111011110111110,PKFCKBYETKRIOB-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CC3=C(C(C)CC2)C=CC=C3)Cl)C4CC4,048D61139C31D132_17345ECA3791FBBE_7022_UN,7.7005334,00000000000000000001001000000000000000000000000000000000000000100000000000000000001000010011000000001101010110000001101000000100110001110000000011010111010110101111010,SCNSFWIRWWIYHI-UHFFFAOYSA-N
NCCC(OC2=CC=C([C@@H]1[C@H](C)CCNC1)C=C2)C3=CC(=C(C=C3)Cl)Cl,33138CFEA39F35E6_0862F8951AAA8F39_6035_UN,8.2488,00000000000000000000000000000000000000000000000000000000000000100000000000000000001010110001000001101001100100010101101001000111110110100110001111010011110101101111110,BXRJHGYHEREJAQ-JSUXSXOPSA-N
FC2=C1C=CC=C(C1=CC=C2)NCC3CCCCN(C)C3,ABAAC617DFFE0255_EBB3E658D8AFB33F_6041_UN,8.082212,00000000000000000001000000000000000000000010000000000000000000000000000000010000101001110011010000001100010110010001101001100100110001110110001001011001010110101111010,PICRDJRPNZJKEK-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC3(CCCC3)C4=CC5=C(C=C4)OCCO5,DF159A86823F808E_BA5C2C41C7CFAB4E_6041_UN,8.023798,00000000000000000000000001000000000000000010000000000000010000100110000010010101001101010011010010101100011111001100001011100100110011110110001011011011110111111111110,CNAYFROUTUSSDT-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NCC2CC3(NCC2)CC3,071386EDA590907B_12BBA2C5DDD4CBDC_7022_DP,7.5227947,00000000000000000000101000000010000000000000000000000000000000000010000000100000001000100011010000101000110000011000001001000000110101010110011001011101010110101111010,LRPRGNGUDWQQIW-UHFFFAOYSA-N
N(C1C2CC3CC1CC(C2)(F)C3)C(=O)[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)Cl)F,FC96BC767B700065_5D6500DCF6175429_6038_UN,7.146522,00000000000000000000000000000000000000000010000000000000010000100010000000000000000100010111100011000101010101101000011000000000100011100100000011010011111011110111110,KYSYBXAFVUSFEH-KZNMNQQMSA-N
CC1=N[N](C(=C1)C)C2=CC(=CC=C2)NC35CC4CC(C3)CC(C4(F)F)C5,BB0EDCE8E193AFBB_98F3822BB407F832_7022_UN,8.044943,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010001001010000100110100011000000011101100100001110100001011001111000010101111010,LSZJTAWYXUTBCW-UHFFFAOYSA-N
N(C1C2CC3CC1CC(C2)(F)C3)C(=O)[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)F)F,9D78E4A283B00FB4_3EF0E1FEF3F2ADAC_6038_UN,7.1465106,00000000000000000000000000000000000000000010000000000000010000100010000000000000000100010111100011000100010101101000011000000000100011100100000011010011111011110111110,WMUVTOKGEUFWKV-KZNMNQQMSA-N
CSCC2(C=CC1=C(O)C=C(C(=C1)F)Br)CCOCC2,F9EE94BF52FFA70C_516A5F4B5AB6027A_7019_UN,8.496848,00000000000000000000000000000000000000000010001000000000010000000010000000000000000000111000010000110000000111001101001000000001110010100111000111010010110101011011110,QTQVHRSHEPTZFS-UHFFFAOYSA-N
CSCC2(C=CC1=C(O)C=C(C(=C1)Cl)Br)CCOCC2,B4CA84FE19E1B660_42D97C0375F2F2A7_7019_UN,8.496833,00000000000000000000000000000000000000000000001000000000010000000010000000000000000000111000010000110001000111001101001000000001110010100111000111010010110101011011110,WLJWYOBGDCJWEL-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4(CCC4)C5=C(C=CC=C5F)F,F8D22C65AFE040E7_17E1CDB52E506078_6041_DP,8.222511,00000000000100000001000001000000000000100010000000000000000000100110000000000100100101010011010010100000111100011000101011100100110101110100001011011011000010101111010,KHHOTGVLKAJKBM-MUJYYYPQSA-N
CSCC2(C=CC1=C(O)C=C(C(=C1)Cl)F)CCOCC2,74F902C3B921B4EC_356E410E021E404C_7019_UN,8.496827,00000000000000000000000000000000000000000010000000000000010000000010000000000000000000111000010000110001000111001101001000000001110010100111000111010010110101011011110,OPNMXFOPGJTWLY-UHFFFAOYSA-N
CSCC2(C=CC1=C(O)C=C(C(=C1)F)F)CCOCC2,101E12306AD69D4F_6ABF984648E08FE1_7019_UN,8.496846,00000000000000000000000000000000000000000010000000000000010000000010000000000000000000111000010000110000000111001101001000000001110010100111000111010010110101011011110,JVQZQGMTLNIQPK-UHFFFAOYSA-N
CC1=CC(=C(C=C1)C)[C@@H]2CCCC[C@H]2OCC3=CC(=NO3)C4CCNCC4,6ED220E67868694A_A5C7462CC6B1C5CE_6039_DP,8.41144,00000000000000000000000000000000000000000000000000000000010000100100000110000000001100100001001011101010100011010000001011001111110010000110001111010111110111111111110,KOIPMKFYEOGZTG-NZQKXSOJSA-N
C[N]1N=C(C=C1NC(C2CCCO2)C3=CC=C(C=C3)F)C4CCCC4,E918DAB734609045_B957235B07D96842_6041_UN,7.936116,00000000000000000000000000000000000000100010000000001000010000100100000000010101100100010011011110000000000101000000001011101100010011110100001010011011110011101111110,OJCJAGCKKBYCSP-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(=O)CCCC4=C(C=CC(=C4)F)F,956C227DC0110E84_0A1C82B077EE2D3E_6038_UN,8.374516,00000000000000000001001000000000000000000010000000000000000000000000000000000000001000010011100010001000110100110000011000000000110010100000000011010011011110100111110,LQJGQGOXFZPBBC-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2CCOCC2C)F)CC3,1F397898ACAD24A4_FB6BE090B75D1F40_6041_UN,7.3285003,00000000000000000001000000000000000000000010000000000000010000000000000000010001100001110010010001101000100111010001101011100000110011110110001011011111010111101111110,FHWNHOFGTSVFQY-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CC3(CCC2)CC3)Cl)C4CC4,609E446BCB144434_5A6D5F7A022C3EA9_7022_UN,7.2478447,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010011000000001001010110001000001000000000110001110000000011010011010110101111010,DSYOTNSBVHAOGK-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2=NC(=CS2)C=CC3=C(C=N[N]3C)C4CCC4,414E50C766FC2591_B0ABBF7C06E0A23F_7019_UN,8.176697,00000000000100000000000000000000000010000010000100001000000000100100000000010000110100011000011010010000000100000000001011101100000000100100001010011010000010101111010,LOAQHFZATKVGTK-UHFFFAOYSA-N
C2(=C1C=CC=CC1=C(C=C2)Cl)NCC3(C)CCC4(CC3)CC4,132454C6DB6F9E61_5A59BBF293C46D50_7022_UN,7.84131,00000000000000000000001000000000000000000000000000000000000000000010000000000000001000010011000000001101010100001001101000000100110001110000000001010001010110101111010,NSASTHCXADTNON-UHFFFAOYSA-N
COC(OC)C1=CC(=C(C=C1)F)NCC23CC(C)(CC2)CO3,70A6DD72DAF22936_21B07552B6A5E1E4_6041_UN,7.391652,00000000000000000000000000000000000000000010000000000000010000000010000000000000001100010011010110101000010111001001101000010010110011110110010011110111110111111111110,XTDTZGRICJPXEF-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CCCNC(C)(C)C)C3=CCNCC3)F,3FF0C72173DF2C07_BE23493837F67152_6034_UN,8.210745,00000000000000000000000000000000000000000010000000100000000000100110000000111000101101110011000010111100110110011000101011100100110100100110011011011111010110101111010,BEMUMMCYQNSBKL-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CCC3=C(C(=CC=C3)Br)Cl,455F3CDDF2CCB69C_876844CFF13126C1_6038_UN,7.4720826,00000000000000000000000000000000000000000000001000000000000000000000000000000000001000010011100010001001110100110000011000000000110010100000000011010011011110100111110,ZZWGFXAMKMSCDC-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(C)CCCC4=C3C=CC=C4)C5=CCNCC5,A07F309221029A72_2325559C63717E22_6034_UN,8.246576,00000000000000000000000000000000000000000010000000100000000000100110000000011000001101110001000010111100110110011001101011100100110000100110001011011001010110101111010,AUFJUXUUBHLOSH-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CCC3=C(C(=CC=C3)F)F,DE394404B014369D_F61F2B125F4B6FE0_6038_UN,7.4720783,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001000110100110000011000000000110010100000000011010011011110100111110,HYQPQESZZYZDIT-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CCC3=C(C(=CC=C3)F)Br,F0F70E690A0467A4_4AEE8EC413FE5DEC_6038_UN,7.4720774,00000000000000000000000000000000000000000010001000000000000000000000000000000000001000010011100010001000110100110000011000000000110010100000000011010011011110100111110,ALDOQWYPCWEKJW-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CCC3=C(C(=CC=C3)Cl)Cl,36CC6EDAB27DAC87_C08B8FEFBE8191CC_6038_UN,7.472085,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010011100010001001110100110000011000000000110010100000000011010011011110100111110,UGKYQGLHANZIEH-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC[C@H]3[C@@H](C3)C4CCOCC4,7197C9054AE5B899_31CC8D0DEF6B4A55_6041_UN,7.9691734,00000000000000000000001000000000000000000010000000000000010000100100000000100000101000110011000000101100010101000000001011000100110011110110011011010111010111101111110,KTSZISZCKGXEPS-WMZOPIPTSA-N
N(CC1C2CCC(C1)C2)C(=O)CCC3=C(C(=CC=C3)Br)F,79B59BE859C2691F_6290CD54B3761C97_6038_UN,7.4720764,00000000000000000000000000000000000000000010001000000000000000000000000000000000001000010011100010001000110100110000011000000000110010100000000011010011011110100111110,STWGPMGVIZRXEK-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC3OC2(CCC(C)(CC2)C)CC3,08BE8F539ABB7944_16BD240355C72588_7022_UN,7.5647774,00000000000000000000000000000000000000000000000000000000010000000010000000100000001100010011000110001001010110001001101000000000110011110100010011010111110111101111110,KMCTTZUVPNKHJV-UHFFFAOYSA-N
CC1=C(C=CC=C1F)NCC3OC2(CCC(C)(CC2)C)CC3,FEF21F9EC027C4EA_F89CF33109164190_6041_UN,7.5647764,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010011000110001000010110001001101000000000110011110100010011010111110111101111110,FCQMFZTWHDTRAF-UHFFFAOYSA-N
CC1=C(C=CC=C1Br)NCC3OC2(CCC(C)(CC2)C)CC3,3068A0EF0CFBD5B9_CABE761FFC89B1BA_7022_UN,7.5647635,00000000000000000000000000000000000000000000001000000000010000000010000000100000001100010011000110001000010110001001101000000000110011110100010011010111110111101111110,BZFHMRAPKOBNLM-UHFFFAOYSA-N
FC2=C1N=CC=C(C1=CC=C2)NC3CN(C)C4(C3)CCOCC4,538F8C0389A5BD91_5C9A24619245B07F_6041_UN,8.052447,00000000000000000000000000000000000000000010000000000000010000000110000000010001100101110001010011101100110111011001101011100100110011110110001001011001010011101111110,VUDGGDWSDYEIJX-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NCC3=C(C=CC(=C3)C4OCCO4)F,87A678C6488D64F6_0EFEEA39C6E7B3F6_6041_DP,7.304855,00000000000000000000000000000000000000100010000000000000010000100100000010010101101101010011010010101000100111010000001011110100110111110110001011011011010111111111110,FHWFTCZMGUZNJW-UHFFFAOYSA-N
FC2=C(C=C1C=COC1=C2)NC3CCN(C)C4CCCC34,DA6B118AECCC544A_0742A1D85DCCE212_6041_UN,8.479538,00000000000000000000000000000000000000000010000000000000010000000000000000010000100101110011010010101100110110010001101011100100110001110100001011011011110010101111110,FSFUCPJURKHUIC-UHFFFAOYSA-N
C1(=CC(=CS1)C2OCCO2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,0E475FCCAA44FFC8_9AB63373CFABC477_6041_UN,7.4603004,00000000000000000000000000000000000010000010000100000000010000100000000010010001010101111000010010101000000101010001101011110100110011110110001011011011010111111111110,WEEBQZRWUPNYRE-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)Cl)Cl)Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,6055082B636BC31D_B729EFAE63ADFD3B_7022_UN,8.854757,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,ORHUJEQIUYPCPN-HOTGVXAUSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCC=CCCC3,0250AA9ADAB7F647_C7BD5A8689D6025A_6041_UN,7.925829,00000000000000000000000000000000000000100010000000000000000000000100000000000100001000010011000000111100010110000000001001000100110001110100001011010111010110101111010,YOITZTLBDSTKIH-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)F)Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,F471C2A2C748A63A_28AE2E623DBFFAF7_7022_UN,8.8547125,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,WAAKKIIDJJHMJC-HOTGVXAUSA-N
FC1=CC2=C(C=C1)C(=CC=N2)NCC3N(C)CC4(CC3)CCC4,541B65166D4A7227_16D1879A0FD6D5B9_6041_UN,7.929292,00000000000100000000000000000000000000000010000000000000000000000110000000010001101001110011010000101100010110011001101011100100110001110110001001011011010110101111010,GPAWPPISZUXANL-UHFFFAOYSA-N
BrC1=CN=C(N(C1=O)C[C@@H]2CNCC[C@H]2C3=CC=CC=C3)C4CCC4,F20B6D17908CB70C_CB1EC32E37B39AF6_6034_UN,8.37613,00000000000100000000000000000000000000100000001000000000000000100100000000010100101001110011100001101000100100110100011011100101110000100110001111011011011110100111110,MVVZXGOQAVBLBW-IRXDYDNUSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3(CCCCC3)C4CC4,34B75D930B4B2A60_CC7811A233348BB0_6041_UN,8.201562,00000000000000000000001001000000000000000010000000000000000000100110000000010101000101010011010010000100111100011000001011100100110001110100001011011011000010101111010,PXXYXCCDQDMTDG-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3=CC=C(C=C3)C46CC5CC(CC(C4)C5)C6,5BFB3FBC03B6A631_64A7CE99F8334E6F_6041_UN,7.977438,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010000011010000100010100001000000011101100100001110100001001001001000010101111010,DSKWSIVKYIPRTB-UHFFFAOYSA-N
CCOC(CC1=CC(=CC=C1)NCC2(CCNCC2)C3=C(C=NC=C3)F)OCC,9BB269A6A9AAD634_07213B00DDAFB8A5_6041_DP,8.217199,00000000000000000000000000000000000000000010000000000000000000100110000000000000001000110011000000101000100111011010001011010110110111110110001011010111010111111111110,ARXPIPRNTLIRHX-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=CC=C2)NCCC4CCN(C3CCN(C)CC3)CC4,B73EF6109EF2398D_441EEAF6E78DE83B_6041_UN,7.668017,00000000000000000000000000000000000000000000000000000110000000100100000000010001101101100001010010101100110010010001101011100100110101010110001011011111010110101111010,OYCJZXCGMIHRMC-UHFFFAOYSA-N
CC(C)(C#N)C1=C(C(=CC=C1)NCC3CC2(CNC2)C3)F,440412F3B7AE2A07_029B6730C63978DB_6041_DP,7.7698174,00000000100100000000000000000000000000000110000000000000000000000010000000100000001000110010000000001000010100001000000001000000100101110110001010000111010110101111010,IUANOAWFEDDFSK-UHFFFAOYSA-N
CC1=CC(=C(C=C1)F)NC23CCC(CC2)(C(F)F)CC3,B1088D4CD4E34B3C_B0B3D7EC71E37382_7022_UN,8.549569,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010010000000000000110100011000001000000000110001110000000011010011000010101111010,DZMFIEGBCBKDLA-UHFFFAOYSA-N
FC1=CC3=C(C=C1)N(C2=C(CNCC2)C3=O)CC4(CN)CC=CC4,607055733A69E9DE_B1BD52A081998A10_6034_UN,8.170476,00000000000000000000000000000000000000000010000000000000000000000110000000010000101011110011000011111100110100011100001011100101110100100110001111011001111110100111110,PRDVVBKACQJTHR-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NCCN(C)CC2OCCC2,124CAF32F73C03B0_2E279E0D6B167605_7022_UN,7.4277115,00000000000000000000000000000000000000000010010000000000010000000000000000000001001101110001010110011000100111010001101000100000110010100110001000011001110101101111110,GRZZNENDEYCIRW-UHFFFAOYSA-N
FC1=CC(=CN=C1)C2=C5C(=CC(=C2)C=CC4=C3CSCCC3=N[N]4C)OCO5,076C51FB949A7C61_21972DACC1100B40_7019_UN,7.9883223,00000000000000000000000000001000000010000010000000001000010000100100000010010000100100111000011010110100010111010100001011111100110000100110001011011010110011111111110,ZUWVFAWDFWRWQZ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2OC3(CCC2)CCC3)F)CC4,700AC50A22BDDA8A_210B2CCF4BACCBA7_6041_UN,6.9574814,00000000000100000001000000000000000000000010000000000000010000000010000000010001101001110011010100101000010110011001101011100000110011110110001011011011110111101111110,ZDKAAVJULDQKAR-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2C3(COCC2)CCCC3,C1A06ED983069A01_6FDBFA554466A38B_6041_UN,7.3044186,00000000000000000000100000000010000000000000000000000000010000000110000000100001001000100011010010101000010001001000001011000000110011010110011011011111010111101111110,PZDDCGUXUZWWJL-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC3CC2(CCN2)C3)F,FF89A2BF6C6B810C_DD79E3E5030027AC_7022_DP,7.169278,00000000100100000000000000000000000000000010000000000000000000000010000000100000001001110011010000001000110100011001001001100000110101110110001010011111010110101111010,PUYQKUMENLVMFG-UHFFFAOYSA-N
N3CCOC(CC=CC1=C([N](N=C1C)C2=C(C=C(C=C2)F)F)C)C3,475826D8902141E7_07B19BED20FC09C3_7019_DP,8.4770155,00000000000000000000000000000000000000000010000000001000010000100100000000010000101100110011001110111000100101010000001011101100110011110110001011011111110111101111110,YMPFWTKLOXXXJZ-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C([N]1CC2C(CN2)(C)C)C=CC(=C3)Cl)C4,0C66D51851E1D853_B4565C49C6DA023B_6034_DP,8.030636,00000000100100000000000000000000000000000000000000000000000000000110000000110001001101010011000010001101110110011011101011100100110101100110011011011111010110101111010,FNLDJNCYCRAOQB-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)C#N)NCC2CCNC(C2)(C)C)F,C385BC53A517BA0D_C211635267A01BB2_6041_DP,8.198061,00000000000000000000000000000000000000000110000000000000000000000010000000100000101000010011000000101000100110011001101001000000110101110110001011010111010110101111010,SLTOQUQAHFPEOL-UHFFFAOYSA-N
CC5=CC1=C(N=C(N=C1N[C@@H]2CCN(C)[C@H]2C3=CC(=C(C=C3)F)F)C4CC4)S5,5881314646415F61_276E91ED48478063_6041_UN,8.866348,00000000000000000000001000000000000010100010000100000000000000100100000000010101110101111011010010101100110110010001101011100100000001110100001011011111010010101111010,NVYVFKURYKTOBX-MSOLQXFVSA-N
CC5(C)CCC1=C(C4=C(N1CC3(CC2=CC=C(C=C2)F)CCNC3)C=CC(=C4)Br)C5,5282CCF5BDD91286_CCB6B8043D63050B_6034_UN,8.024201,00000000000000000000000000000000000000000010001000000000000000000110000000110000101101110011000010001100110100011001101011100100110000100110001011011101010110101111010,RDGQORYIZNFJPC-UHFFFAOYSA-N
FC1=C(C=C(C=C1)CC=C)NC2CCN(C)C23CCCNC3,159A4BD8CEDC5B2C_3ABFDE01CB2663F4_6041_DP,7.960055,00000000000000000000000000000000001000000010000000000100000000000010000000010001101101110011010010111000110110011001101011100000110101110110001011011011010110101111010,LUWUHIIDIJYRCY-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC[C@H]2[C@H](CCCC2)N3CCOCC3)F,D842D7BD3B2ED9E5_D30119487E5028B7_7022_UN,7.3851223,00000000000000000000000000000000000000000010000000000000010000100000000000110000101001110011010100101000000101010001001011100000110011110110001011011111010111101111110,BAOVJCNFSAWPGQ-JXFKEZNVSA-N
C1(=CC=C(C=C1)CC2CC2)NC[C@@H]3C[C@@H](CN3CC4=NC=C[N]4C)F,B95C4121AE3FA15A_BF1BF7778575BFCE_7022_UN,8.576117,00000000000000000000001000000000000000100010000000000000000000000100000000010101001101110011010010001000000100010000100011100100110001110110001010011011010110101111010,LDLYTVJJKCJTIN-HKUYNNGSSA-N
O(CC1CCCC2=C1C=CC=C2)CC3=CC4=C(C=C3)NC(=O)O4,907699A3057189B8_E34D2D65654ABFCF_6039_UN,8.91416,00000000000000000000000100000000000000000000000000000000010000000100000000000000000100100000000110000100011001100100011011010111110000000110000111110001111111010111110,FZJPJCXLKHGNEB-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC4OC3(CCC(C)(CC3)C)CC4,6E38CE4985627D4C_7F69CDCB8624ABC7_6041_UN,7.5922127,00000000000000000000000000000000000000000010000000001000010000000110000000110000101100010011011110001100010100001001101011101100110011110100011001011101110111101111110,SVXUFZNSQAMCLG-UHFFFAOYSA-N
N(CC1C(CCCC1)C2CC2)C(=O)C3=CC=C(C=C3)C4=CC(=C(C(=C4)F)F)F,3F9124736DE29277_FAADF8B7CA2317ED_6038_UN,7.808756,00000000000000000000001000000000000000000010000000000000000000100000000000000000001000010011100000001000000100100000011000000100110000100000000011010011011110100111110,FSJXDYYBOXYWMW-UHFFFAOYSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC3=C([N](N=C3C)C4=CC=C(C=C4)F)Cl,5B251818639FE46C_D896F80B23B6DA0D_7019_UN,8.577324,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010000001010010001000100000000000011101100110001110100001010011010000110101111010,XHHZLBIKSBSJEP-KDOFPFPSSA-N
C[Si](C)(C)C1=C(N=C(C=C1)NCC2CC3(NC2)CCC3)F,C3D3A36A87C7462F_8C9D91F63EAF4969_6041_DP,7.779902,00000000000100000000100000000010000000100010000000000100000000000110000000100100101100110011010010101000110100011000001011000000110101110110011010011111010110101111010,BCSKZMSXXMFEFE-UHFFFAOYSA-N
C2(=C1C=CC=CC1=CC=C2Cl)NC3CCN(C)C4CCCC34,CE59BEA32A4AFAA9_994A5ECAB30F4A03_7022_UN,8.243351,00000000000000000000000000000000000000000000000000000000000000000000000000010000100001110011010010101101110110010001101001100100110001110100001011011011010010101111010,NZURDSYKUQECNT-UHFFFAOYSA-N
FC1=CC(=CC(=C1)N[C@@]34[C@@H]2OC(C)(O[C@@H]2[C@@H](CC3)C4)C)C[N]5C=CN=C5,C19DFDB9122E6A5B_AF71F3336C4CC6CF_6041_UN,8.282811,00000000000000000000000000000000000000000010000000000000010000000110000010110101000101010011000111001100110100011000001011110100010001110100001001011101110111111111110,HRUGKCGZKBREQH-IVGZAAIESA-N
O(C(=O)CC1=C[NH]C2=C1C=C(C=C2)F)CC3CC4CCC3C=C4,AB626028F61B9FC4_D6CD7066B874DA41_6031_UN,8.167373,00000000000000000000000000000000000000000010000000000000000000000100000000000000000100010011000010010100010101000000001001010110110010100100000001010001011111010111110,IJCNMLUDLBKYLI-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(C3=CC=C([N]3C)C4=CC=C(C=C4)F)=O,E3CA763133D1420E_2E48E1F7BF01C6E6_6038_UN,7.963309,00000000000000000000000000000000000000000010000000000000000000100100000000010001001101010011110110001000010100100000011001100100110000100100001011011011011110101111110,SRZSKZWQCCQVAN-UHFFFAOYSA-N
CC(OCCCC1CCOCC1)CC2CCCCN2C,BC07106E1483DCD3_5C5A0B8E8D827E63_6039_UN,7.5364127,00000000000000000000000000000000000000000000000000000000010000000000000000010000000001100000010001101000000011010001101011100010110010000110000001011110110111111101110,KVKJFGMXALGEIY-UHFFFAOYSA-N
N(C[C@@H]1CCO[C@H]1C=C)C(=O)C2(CCCC2)C3=CC(=CC(=C3)F)F,323A55C0C530D8E8_3222CB56658D3171_6038_UN,7.523801,00000000000000000000000000000000001000000010000000000000010000100010000000000000001100010011100011011000000101101000011000000000110010100110000000010011111111110111110,KCWAFYRFJQMJHM-GUYCJALGSA-N
FC1=C(C=C(C=C1)C3=C2C=CC=CC2=C(N=N3)NC[C@H]4CNCC(O4)(C)C)F,0428670DD6F1D10D_F0EC757C5C16FDE5_6041_DP,8.221187,00000000000000000000000000000000000000100010000000001100010000100110000000100101101000110010001100101100010110001001000011001100100111110110001011000111110111101111110,WEIBUBVFOIHGJM-CQSZACIVSA-N
C1(=C[N](N=C1)CC2CCOC2)NCC(N3CCN(C)CC3)C4=CC=C(C=C4)F,A58693825CBE70B7_CA6156D33B2D3631_6041_UN,7.8775244,00000000000000000000000000000000000000000010000000001000010000000100000000010001101101110001011011101000000101010001101011101100110011110110001001011001010111101111110,RJRXDEXKDVWRQJ-UHFFFAOYSA-N
O(C(=O)CC1=C[NH]C2=C1C=C(C=C2)Br)CC3CC4CCC3C=C4,FBB608EDF65AACC8_962D991F3BF221BE_6031_UN,8.167288,00000000000000000000000000000000000000000000001000000000000000000100000000000000000100010011000010010100010101000000001001010110110010100100000001010001011111010111110,JWMIQVPFQCBCEQ-UHFFFAOYSA-N
O(C(=O)CC1=C[NH]C2=C1C=C(C=C2)Cl)CC3CC4CCC3C=C4,1DC98B468B7EB789_727CF2B1A5E259EB_6031_UN,8.167286,00000000000000000000000000000000000000000000000000000000000000000100000000000000000100010011000010010101010101000000001001010110110010100100000001010001011111010111110,JTRHAVGTYXVYEP-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC(C)C2COCCC2)F)CC3,8B55368E158D975E_BD30E4F32AE780B0_6041_UN,7.463194,00000000000000000001000000000000000000000010000000000000010000000000000000010001100001110011010001101000000111010001101011100000110011110110001011011111010111101111110,IVPLHCSZZDYRQF-UHFFFAOYSA-N
CC(C)CC1=C(C=CC=N1)N[C@@H]2CCN(C)[C@H]2C3=CC(=C(C=C3)F)F,1C6400034EDEF235_5982F46107A84970_6041_UN,8.700003,00000000000000000000000000000000000000000010000000000000000000100100000000110001100101110011010010101000100110010001101011100100000001110100011011011111010110101111010,HINADKQPVSHTCG-QUCCMNQESA-N
FC1=C(C(=C(C=C1)F)CC#N)NCC2(COCCNC2)F,542F3FE92A61CEA9_43B1005D8308A8F4_6041_DP,8.092865,00000000000000000001000000000000000000000110000000000100010000000010000000000000101000110011000101001000100101011000001011000000110111110110001010010011010111100111110,YIZQMLXOYRTUQN-UHFFFAOYSA-N
CCN3CCC1=C(C(=CC(=C1)NC2C(CC)CN(C2)C)F)C3,6E1412B46FA94916_5B1198488773B5A8_6041_UN,7.6961937,00000000000000000000000000000000000000000010000000000000000000000000000000010001100101110011010010101100110110010011101011100000110001110110011011011111010110101111010,KWGFDSDSKSALAY-UHFFFAOYSA-N
C2(=C1OCCCC(C1=CC=C2)=O)NC4=C3CCN(C)C3=CC=C4,3272298128E2E657_FF2BB4C2C8428FFE_6041_UN,9.085941,00000000000000000001000000000000000000000000000000000000010000000000000000010000100101100111010110001100010011010101101011100101000011010110001111011001111011111111110,JHZWMGJELNKUHI-UHFFFAOYSA-N
C1(=CN=C(O1)C2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,663679774E8BCE3E_A31D682E891791FE_6041_UN,8.449427,00000000000000000000000000000000000000000010000000000000010000100100000000010001100101110011110110101000100111110001111011100100110011110110001011011011010011111111110,HGVSMVPUDJNJMT-AEFFLSMTSA-N
FC1=C(C(=CC=C1)NC2CCN(C)C23CCCNC3)C=C,5DE3994F7FFE0CA6_A436D471EF13A7FB_6041_DP,7.6946797,00000000000000000000000000000000001000000010000000000100000000000010000000010001101101110011010010111000110110011001101011100000110101110110001011011011010010101111010,LTVGIBGRPINWME-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(CC2)C3CCC3)Cl)C4CC4,682B51B296C8B4B1_4379409213B5027B_7022_UN,7.8342023,00000000000100000000001000000000000000000000000000000000000000100010000000000000001000010011000000001001000110001000001000000000110001110000000010010011010110101111010,MUTLOXWCRGPCII-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NCC4=C(C=CC(=C4)C5CC5)F,521BAD9D96DB8D45_9C156E4D23E34BE6_6041_DP,7.9420576,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110001010010101000010110000000000011100100110101110110001011011011010110101111010,RRDNMRNNGDXBFU-NYTJIUQPSA-N
CC2=C1SC(=NC1=CC=C2F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,EF822316A0B17B23_2E9BBD341AD9923B_6041_UN,8.32833,00000000000000000000001000000000000010000010000100000000000000100100000000010101111101011011010010101100011100010000001011100100110001110110001011011111010110101111010,OXQVJMVYKGKRAS-KUHUBIRLSA-N
FC2=C(C=C1C=CC=CC1=N2)NCC3N(C)CC4(CC3)CC4,6543D76E59605C4F_BAB1ADA7467A2FEC_6041_UN,7.966922,00000000000000000000001000000000000000000010000000000000000000000110000000010001001001110011010000101100010110011001101011100100110001110110001011011011010110101111010,RTXUVYXNXUCVCC-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CC3(CC2=CC=C(C=C2)F)CCNC3)C(=CC(=C4)F)F)C5,D98C99F3BA0A3DFB_38B5B28A2E711A72_6034_UN,8.328075,00000000000000000000000000000000000000000010000000000000000000000110000000110000101101110011000010001100110100011001101011100100110000100110001011011101010110101111010,SAYMOZRCLSVBQA-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC[C@@H]3C[C@H](F)CN3CC4=CC=CS4,CDB4AEA97D56687C_38DAE23EF93269C6_6041_UN,8.466044,00000000000000000000000000000000000010100010000000001000000000100100000000010101111101111011011010001000000110010000000011101100110001110110001010001111010110101111010,FPIMAFOYDBUTAL-IRXDYDNUSA-N
C[N]1C=C(Cl)C(=N1)C=CC2=C(C=CC=C2C3CC3)C4CC4,923F1E8CE899C620_0CD70741754D69D4_7019_UN,8.330558,00000000000000000000001000000000000000000000000000001000000000100100000000010000100100010000011010010001000100000000001011101100000000100100001010011010000010101111010,OLAZEUMDNAJSJF-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCCC(C)C3,5F1C016AAC8B0D5A_EF264F9F0E59C1F5_6041_UN,8.010327,00000000000000000000000000000000000000100010000000000000000000000100000000000100001000010011000000101100010110000001101001000100110001110100011011010111010110101111010,VTEPQNBNSRPHLZ-UHFFFAOYSA-N
CN(C)CC[N]1C=CC2=C1C=C(C=C2)NCC3(CCNCC3)C4=C(C=NC=C4)F,C467287798B40685_67CA039696409EFF_6041_DP,8.002069,00000000000000000000000000000000000000000010000000000000000000100110000000110001101101110011010010101100110100011001101011100100110101110110001011011111010110101111010,XVWQBEWLBUZVKC-UHFFFAOYSA-N
COC1=CC(=C(C=C1)NC2C3OCC4CC2CC34)C(F)(F)F,199EE9FF2CCB42CE_81D651EB43C8A664_7022_UN,8.389987,00000000000000000001000000000000000000000010000000000000010000000000000000000000000100000011010110000100011101001100000000000011110001110100000111000011110011111111110,BDOSEMCAUZZGBT-UHFFFAOYSA-N
COC1=C(N=CC(=C1)NC2C5C3CC6C4CC(C2C34)C56)C(F)(F)F,89A7D1897C593A2C_9212F534D0C8A07D_7022_UN,9.013464,00000000000000000001000000000000000000000010000000000000000000000100000000000001000000000001010111100100011100001100000001000011110001110100001111000011100011101111110,HHDGPMYQLRHJLR-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NCC(CC)(CC)C4=CC=C(C=C4)F,D510FA82D0A93832_91ADA41B94D777A6_6041_DP,7.9892893,00000000000000000000001000000000000000100010000000000000000000000110000000000101101101110011010010101000010110001010100011100100110101110110011001001101010110101111010,HLPULGOXOXOXMG-HTZLVSCSSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4(CCC4)C5=C(C=C(C=C5)F)F,1C7C7E927F2EF271_EAD0444EA84F615B_6041_DP,8.191775,00000000000100000001000001000000000000100010000000000000000000100110000000000100100101010011010010100000111100011000101011100100110101110100001011011011000010101111010,PRZUNAGKLQWULE-BJWYYQGGSA-N
N(CC1C2CCC(C1)C2)C(=O)CC3=C(C=C(C=C3)F)F,1A8EB023C4381751_A430F3BD8FED5F57_6038_UN,7.2685385,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001000110100110000011000000000110010100000000011010011011110100111110,MRIJKSIUNDPKMI-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NCCC4CCN(C3CCN(C)CC3)CC4,946757DA0E114D9A_600912871420AFC7_6041_UN,7.6591516,00000000000000000000000000000000000000100011000000000000000000100100000000010100101101110011010010101100110100010001101011100100110101110110001001011001010110101111010,JHWKEUQNXKWBGJ-UHFFFAOYSA-N
BrC2=C1N(C3=C(C1=CC=C2)CSCC3)CC4CC4(C5(C)CC5)C,E3F8D546B71CE701_AE85391687AC6A98_6034_UN,8.272228,00000000000000000000001000000000000010000000001000000000000000100110000000010000000101111000000010101100010110011001101011100100110000100110000011011110010110101111010,SEHBUESDCGCXQA-UHFFFAOYSA-N
N4CCC1=C(C(=CC=C1)NC2=CC(=C(C=C2)N3CCCCCCC3)F)C4,0E7662241D734052_8E0A772CD2956766_6041_DP,7.793224,00000000000000000000000000000000000000000010000000000100000000100000000000010000101001110011000000101100110100010000001011100100110101110110001011011011010010100111010,OCYQBZFOLDPSDL-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC3C2CC(C(OC)C2)C3)C4OCCO4,50AC3FFC1EFF966B_9C2BC18616ADA97B_6041_UN,7.1681323,00000000000000000000000000000000000000000010000000000000010000100000000010000000000100010011010010000000110111010000101010010011110011110110000111110011110011111111110,QUWABXSLCQRXKN-UHFFFAOYSA-N
N5CC1=C(C=C(C=C1)NC3=C(N2CCN(C)CC2)C=CC(=C3)F)C4(CC4)C5,C2E4491EE8A9EDA3_4157BF305EBE2DDB_6041_DP,7.326088,00000000000000000000001000000000000000000010000000000000000000100010000000010001001001110011010000101100010100011001101011100100110101110110001011011011010010101111010,GUGZYGVWAOHFFQ-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CC4(C)CCN(CC3=CC=CC=C3)CC4)C5=CCNCC5)F,C793CF066DE6FF5C_A8749D5E758B6773_6034_UN,8.592893,00000000000000000000000000000000000000000010000000100000000000100110000000011000001101110001000010111100110100011001101011100100110000100110001011011011010110101111010,SGYLHGHEBXYAOO-UHFFFAOYSA-N
FC2=C(C=C1C=NC=CC1=C2)NCC3CCCCN(C)C3,1D750751CBF14029_6E45CD07283E4B56_6041_UN,8.377573,00000000000000000001000000000000000000000010000000000000000000000100000000010000101001110011010000101100010110010001101011100100110001110110001011011011010110101111010,ZCFPOMNQCYWCGL-UHFFFAOYSA-N
N2C6CCOC1=C(C(=CC=C1)C23C(N(C4=C3C=C(Cl)C=C4)CC5=CC=CC=C5)=O)C6,0946BBE3357207BE_BD34ECF374474E55_2238_UN,8.609373,00000000000000000001000000000000000000000000000000000000010000000010000000010001100101010011100111101101110101111100011011100101110010110110001111011011111111110111110,OABQHNIWZYBGHG-UHFFFAOYSA-N
CC2=C1N=C(C=C(C1=CC=C2)C)NCC3N(C)CC4(CC3)CCC4,D815B0EAE66847A5_6AE0876E50DD598E_6041_UN,7.8472104,00000000000100000000000000000000000000100000000000000000000000000110000000010101001001100011010000101100010010011001101011100100110001010110011001011111010110101111010,YMYMXAVHEMTLJN-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=NC=C3)NC4=C(C=CC=C4)C5=C(C=CC=C5F)F,9AC9D37F45D9842B_0F2B96709DE3F0B3_6041_DP,8.11611,00000000000000000000001001000000000000100010000000000000000000100100000000000100101101110001010010101000011110000000000011100100110101110110001011001011010010101111010,VUTCLMVFVRLHDF-YLQYIJTPSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCCN2)F)CC3,656CB239C7F6FFA4_51EA8AF7501445C8_6041_DP,7.677723,00000000000000000001000000000000000000000010000000000010000000000000000000010001101101110011010010001000100110010001101011100000110101110110001010011011010110101111010,NIOHXRFBNGYDPB-UHFFFAOYSA-N
CSCC3(C=CC1=C(O)C=C(C=C1)N2CCCC2)CCOCC3,0C4AC21E485B082E_9DC12DBD3EB02BAB_7019_UN,7.9898453,00000000000000000000000000000000000000000000000000000000010000100010000000010000000101101000010011111000000011011101001011100001110011010111000111011010110111111111110,YZXAUGLMDILOAH-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@H]3[C@H](C2=NC=C[N]2C)OCCC3)Cl)C4CC4,F060E5B81CB16873_BCA1B170B7FF30C6_7022_UN,8.5652685,00000000000000000000001000000000000000100000000000000000010000100100000000010101100101010011010110100001100111010000001011100100100011110100001011011111110011101111110,NBGOCSCLKFDZSO-SJLPKXTDSA-N
CCNC5CCC1=C(C4=C(N1CC(N2CCNCC2)C3=CC=C(C=C3)Cl)C=CC(=C4)Cl)C5,EE0D40BE67A31E3C_9A1A524A70FAD3A7_6034_UN,8.378805,00000000000000000000000000000000000000000000000000000000000000000100000000010001001101110011000010101101110110010010001011100100110101100110001011011001010110101111010,XHMXSMPCFGDOJD-UHFFFAOYSA-N
CN3C1CC2=C(CC1)C=C(C=C2C34C(N(C5=C4C=C(Cl)C=C5)CC6=CC=CC=C6)=O)Br,130D48DC1D1D58A8_60348FBF0B785ACD_2238_UN,8.413412,00000000000000000000000000000000000000000000001000000000000000000010000000010001100101010000110110101101010110111000111011100101110000110100001111011010011110101111110,SMWBIUFPOHXIPB-UHFFFAOYSA-N
CCNC5CCC1=C(C4=C(N1CC(N2CCNCC2)C3=CC=C(C=C3)F)C=CC(=C4)Cl)C5,866B1A62B56D4859_EB866CE5C13CF395_6034_UN,8.378782,00000000000000000000000000000000000000000010000000000000000000000100000000010001001101110011000010101101110110010010001011100100110101100110001011011001010110101111010,XFIGGKVPYKXVKI-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=C1)NC2=C[N](N=C2)CC3=NN=C4CCCC[N]34,6FDF2DD54715363F_D58462BFE47506A9_6041_UN,7.8170695,00000000000000000000100000000010000000100000000000001000000000000100000000110101100101100001011010101100010000011000001011101100111001010110011011011111010110101111010,VFFGXJCUWNLKTG-UHFFFAOYSA-N
CN(C)CC1=CN(C2=C1C=CC(=C2)F)C[C@H]3[C@@H](CNC3)C4CCOCC4,BECE0C1C3E7C55BE_E8E05F4B2F5B6BC2_6034_UN,7.9403744,00000000000000000000000000000000000000000010000000000000010000100100000000110000101101110011010010101100010101000001001011100100110010100110001001011111010111101111110,DLCBRLQMTWYHEZ-JXFKEZNVSA-N
COC1=C(C=C(C=C1)NC2C3OCC4CC2CC34)C(F)(F)F,DF90BD4764033BB0_411609B9FF78E879_7022_UN,8.32859,00000000000000000001000000000000000000000010000000000000010000000000000000000000000100000011010110000100011101001100000000000011110001110100000111000011110011111111110,HEIMQOJGCVIIMI-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CC3(CN2)CCC3,15F932D1AB7DFEB2_56B28A7FDF30D682_6041_DP,7.3752027,00000000000100000000100000000010000000000000000000000010000000000110000000100001001100100011010010101000110000011000001011000000110101010110011010011111010110101111010,JCWUEUSLUGXWQH-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NCCC3CCN(C2CCN(C)CC2)CC3,E1C2944DF5DD0568_B80C781D99E552F4_7022_UN,8.42371,00000000000000000000000000000000000000000010010000000000000000100000000000010000101001110001010000111000100100010001101011100000110001100110001001011001010110101111010,RVWYJQCIZDTIQP-UHFFFAOYSA-N
C[N]1N=C(C=C1NCC2=C(C=CC(=C2)C3CC3)F)C4CCCC4,4B72DBC6B951D00B_714E3E25FD05C5ED_6041_UN,7.7755885,00000000000000000000001000000000000000100010000000001000000000100100000000010101101100010000011010001000000110000000001011101100010001110100001010011011010110101111010,KAIOUXIASMQUPU-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC=C2NCC3C(CCC)CCC3,D052527ECB979509_D64E5F00FFFFFBAF_6041_UN,8.751501,00000000000000000000000000000000000000000010000000000100000000000100000000000000101100010011000010001100010110000011001001000100110101110100001010010011010110101111010,IQJAOPKYXYZKPE-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(C4=N[N](C)C(=C4)C5=CC=C(C=C5)F)=O,3358ADF2604FBB2F_E3D4C5A9F1085662_6038_UN,8.474941,00000000000000000001001000000000000000000010000000001000000000100100000000010001101100010011111111001000010100100000010011101100110000100100001011001011011110101111110,AJWPQSRXTBFZCW-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CC3)C4=C(C=CC=C4F)F,DEA957DB458182A1_E96AC7D2B4CF4771_6041_UN,8.096278,00000000000000000000001000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100010001110110001011011011010110101111010,YCXILQCDSARCLF-KRWDZBQOSA-N
N(CC1C2CC(C1)C3CC23)C(C4=C(N=CC(=C4)OC)F)=O,C96B90814D639D26_2CD507F0797E8C68_6038_UN,8.430852,00000000000000000001001000000000000000000010000000000000000000000100000000000000101000010011110111101000010100100100010001000011110000100100001111000011111111111111110,RJHFMODJKMKYIE-UHFFFAOYSA-N
CC1=C(SC(=N1)C2OCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,27A6A2E8AB225C5D_D9289A32491B507E_6041_UN,7.9160852,00000000000000000000000000000000000010000010000100000000010000100100000010010001110101111011010110001000100111010001101011110100000011110110001010011111010011111111110,JZBVDSQFOYDQKT-CABCVRRESA-N
C(C1CCCCC12CCC2)=CC3=C(C=C(C)C=C3F)Cl,1A15BECF6DB26D5A_CA0D9F5B9E5574E9_7019_UN,8.729298,00000000000100000000000000000000000000000010000000000000000000000010000000000000000000010000000000010001010100001000001000000000110000100000000011010010000000001011010,MJOXPYXFNQAJFK-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C(C=C(C)C=C3F)F,4A78DCBEA608DBBF_5C1DB04D533E51F9_7019_UN,8.729293,00000000000100000000000000000000000000000010000000000000000000000010000000000000000000010000000000010000010100001000001000000000110000100000000011010010000000001011010,MVCZMAYMIXOZSM-UHFFFAOYSA-N
N2CCC(C(OC[C@H]1NC(O[C@@H]1C)(C)C)C2)C3=CC=C(C=C3)F,7F413CB7C7E193FA_A43A92F5C1842156_6039_DP,8.0553255,00000000000000000000000000000000000000000010000000000000010000100000000000100000001100110101100110101000100111111000111011000011110110100110011101010111110111111111110,KDXBQGWGIGPCOT-ZCHDIUTGSA-N
NCC(OC2=C1CNCCC1=C(C=C2)F)C3COCC3,D06179979B4C3E67_28352E5404474856_6035_UN,8.390902,00000000000000000000000000000000000000000010000000000000010000000000000000000000001110110101000111101100110101010100001011000011110110100110001111010001110101110111110,DSMMYRYDWHKPSL-UHFFFAOYSA-N
N5CC1=C(C=C(C=C1)NC2=C(ON=C2C)C=CC3=CC=C(C=C3)F)C4(CC4)C5,7E758108BEC62FBD_87FAB1D06F72FD80_6041_DP,8.017638,00000000000000000000001000000000000000000010000000000000010000000110000100000001101100110011001111111110010100001000000011001100110101110110001011010011110010101111110,WPFRATNUNCTWAZ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)OC=C2NCC3N(C)CC4(CC3)CCC4,3A5497E89F604942_40ABCB7E3D457E22_6041_UN,7.8825464,00000000000100000000000000000000000000000010000000000000010000000010000000010001001101110011010111101100010110011001101011100100110001110110001001011011110110101111110,HKZAMFBWOMNSDW-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3=CSC=C3)C=CC(=C4)Br)C5,BBF6D60B879BCF63_DB10B56A5057AD86_6034_UN,7.929349,00000000000000000000000000000000000010000000001000000000000000100110000000110000101101111011000010001100010100011001101011100100110000100110001011011111010110101111010,BMRBWHGIELSVSY-JXFKEZNVSA-N
CC1=C(C(=CC=C1)Cl)NCC3(C)CCOC2(CCC2)C3,51FAF5AB6D477EE8_F2CF29373BC6AF99_7022_UN,8.010296,00000000000100000000000000000000000000000000000000000000010000000010000000000000001000010011000000101001010111001001101000000000110011110110000011010111110111101111110,IUTUZKOBZHICBY-UHFFFAOYSA-N
CC1=C(C(=CC=C1)F)NCC3(C)CCOC2(CCC2)C3,BF76643633E41A2E_4DC1E3C5F21EF549_6041_UN,8.010291,00000000000100000000000000000000000000000010000000000000010000000010000000000000001000010011000000101000010111001001101000000000110011110110000011010111110111101111110,VFXQZGYVCANYDB-UHFFFAOYSA-N
N1CCC2(C1)CCN(CC2)C3=NC=C(N=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,C0F230C3494283B6_2BA9613F495F8E23_6041_DP,8.377783,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101110011010010101000110110011001101011100100110101110110001001011011010010101111010,XVEHFGKAFQZDCZ-KNQAVFIVSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC34CC(OC3)CCC4,92320C291158C7BF_6D63FB157B908CD4_6041_UN,8.056038,00000000000000000001000000000000000000000010000000001000010000000110000000010000100100010011011111000100110101011000001011101100110011110100001001011001110011101111110,XPAIZGKXMVUSBQ-UHFFFAOYSA-N
CN4CC[C@@H](NC([C@@H]1CC(CN1)C23CC(C2)C3)=O)[C@@H]4C5=CC(=C(C=C5)F)F,D84183D50158A0CC_7B0AE75F1D3EC7D4_6038_DP,7.9015923,00000000000100000000000000000000000000000010000000000010000000100010000000010001101101110011110110001000110110111001111011100000010101100110001010011011011010101111110,JBUPNPHTCOPGEQ-AUJVZZQFSA-N
CN4CC[C@@H](NC([C@@H]1CC(CN1)C23CC(C2)C3)=O)[C@@H]4C5=CC(=C(C=C5)Cl)F,2125DDD73AE71F20_3866D521BF1DFBF9_6038_DP,7.9015746,00000000000100000000000000000000000000000010000000000010000000100010000000010001101101110011110110001001110110111001111011100000010101100110001010011011011010101111110,IXHCQDNLTUIIBJ-AUJVZZQFSA-N
C1(=CC2=C(C=C1)C3CCC2O3)NC4=CC(=C(C=C4)N5CCCC5=O)F,441C26A9DC1C7FD4_FC6F5EBBA07476D0_6041_UN,7.6412406,00000000000000000000000000000000000000000010000000000000010000100000000000010000000101010000100010001100010100110000011011100101010011110100001111011011111011110111110,BRLVEBNFWRPZII-UHFFFAOYSA-N
CSCC3(C=CC2=C(C1CCNCC1)OC=N2)CCC3,5BB0B5C02E19A83F_C16469638B7C4EB3_7019_DP,8.124405,00000000000100000000000000000000000000000000000000000000010000100110000000000000001100101001010110111000100010111001011011000000110000000110001010010011110110101111110,DCJKCIJGBDMZEF-UHFFFAOYSA-N
NCC(COC2=C1CNCCC1=C(C=C2)F)C3CCC3,01921524BD69E2DC_7D7A5C155D530430_6035_UN,8.4265175,00000000000100000000000000000000000000000010000000000000000000000000000000000000001010110011000001101100110101010100001001000011110100100110001111010001110101100111110,RRVJZNOJSYNALI-UHFFFAOYSA-N
C1(=CC2=C(N=C1)[NH]C=C2C3CCC3)NCCC[Si](C)(C)C,44A1AA6E21C4D4EE_9934FCE9DFEDD7A8_6041_UN,7.325848,00000000000100000000100000000010000000100000000000000000000000100100000000100101001100100011010010101100110010011001101011000100000101010110011000011101010110101111010,BMJJMSYONUPWCN-UHFFFAOYSA-N
CN(C)[C@@H]1CCCC[C@@H]1COCC2OCCN(CC)C2,9F640AD56C147F19_3C2758C4E3F680A2_6039_UN,7.1581306,00000000000000000000000000000000000000000000000000000000010000000000000010110000000001100000010101101000000011010010101011100010110011000110011001011110110111111101110,UCOKFBHJCMYEGX-YTPLPTRZSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5)C,5DBDFA332B672AF0_7FE0675831AD0A7B_6041_UN,8.173041,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010110010000001011100100110001110110011011011111010110101111010,UYHOCLMUBNNWHT-OSPHWJPCSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC(C)CC3CCOC3,6D03A74643829577_83ECC8A5C05F379F_6041_UN,8.080097,00000000000000000000000000000000000000100000000000000000010000000100000000000100000100100001000010100100110011010001001011000100110011010110011011010111010111101111110,LTPNVVQCLCGPBG-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC4C[C@H]3CCC[C@H](N3C)C4,A4CABBF1334E6DA9_CB415FF4C582D8E0_6041_UN,7.7373195,00000000000000000000000000000000000000000010000000000000000000000100000000010001100001010001010000100100110110010000101011100100110001110100001011011111000010101111010,YPDTZYLDCMCUQJ-MQVJKMGUSA-N
FC1=C(C(=C(C=C1)C#N)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F)F,D3DFC0BEE282BF6B_B8AD3BA2A3092C57_6041_DP,7.9924374,00000000000000000000000000000000000000000110000000000010000000100000000000000001101000110011000000101000100100010000001001000100110101110110001011010011010010100111010,YJELMNYZYFEFBG-GDBMZVCRSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)C[C@H]3[C@@H](CNC3)C4CCOCC4)Cl,38EAA3E75310C30D_FB9E8CCEA641779D_6034_UN,7.6832647,00000000000000000000000000000000000010000000000100000000010000100100000000010110111101111011000010101001001111000000001111100100110111110110001011011011010111101111110,JSTGJEPFHBOMPI-HKUYNNGSSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2CC3(CC2)CCCCC3,277FDA1EDF3C00F1_3CFFB65E0340CFAC_6041_UN,7.533107,00000000000000000000100000000010000000000000000000000000000000000110000000100001000000100011010010100000110000011000001001000000110001010100011011011111000010101111010,FYYVZWCMIMRGET-UHFFFAOYSA-N
N3CCC1=C(C=C(S1)NCC2=CC(=C(C=C2)F)CN(C)C)C3,D823D77DCB5B3702_B33C60D8878A8A9A_6041_DP,7.3265343,00000000000000000000000000000000000010000010000100000000000000000000000000100000011101111001010010101100110100010001001011100100110101110110001011011111010110101111010,NIDRSEKXWPSKHX-UHFFFAOYSA-N
CC(=O)C1=C[NH]C2=C1C=C(C=C2)NC3C4CC5CC3CC(C4)(F)C5,32D9DF2239340604_AD4DB2344B088A0E_6041_UN,7.515425,00000000000000000000000000000000000000000010000000000000000000000110000000000000000100010010000011000100010100001000000001000100100101110100001001000001101010101111110,RWLKJNHVOMTRFD-UHFFFAOYSA-N
N(C1=CC=C(C=C1)N2CC3CCC(C2)O3)C(=O)C4CCC4C5=CC(=C(C=C5)Cl)Cl,9257777AFDD9D5E2_3B65B2ACE7F700B5_6038_UN,7.8287873,00000000000100000001000000000000000000000000000000000000010000100000000000010000000101110011100110101001010100100000011011100100110011110110001011011011111011110111110,FOQNMNAHUSNSEG-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC3(C2CCNCC2)CCOCC3,8718B4A95FDA54C3_DE0C2A147C8D0F59_6041_DP,7.851061,00000000000000000000000000000000000000000110000000000000010000100010000000000000001000110011000000101000100111011000001011000000110111110110001011010011010111101111110,WIOJTAFBXGOKDJ-UHFFFAOYSA-N
C2(=C1CCCCC1=CC=C2)NC3=CC(=C(C=C3)Cl)CN(C)C,FAA5420C809DCD0D_C8C075E36DC43ADD_7022_UN,8.004047,00000000000000000000000000000000000000000000000000000000000000000000000000100000000001110011010000001101010100000001001000100100110001110000001011011111010110101111010,FBBHAWOMUOBUJK-UHFFFAOYSA-N
N5CCC(CC3=C(C1=C(SC2=C1CCN(C)C2)N=C3)C4=CC=C(C=C4)C)CC5,1272D782CEBB885F_1A0E30CF3BB1A0B9_2201_DP,8.040273,00000000000000000000000000000000000010000000000100000000000000100100000000010000011101101001010010101100110000010001101011100100110000000110001011011111010110101111010,LNYUPLJVIAANGM-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC2=NC=CN2CC3CNC4(C3)CCOCC4,DE877C066706DEA9_BE82DE8B97D0AE69_6034_UN,8.264282,00000000000000000000000000000000000000100000000000000000010000000110000000010101101101110011000011101001110111011000001011100100110111110110001011011011010111101111110,LTLZVFZTZZDNEG-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)N[C@@H]2CNC[C@@H]2CC3=CC=CC=C3)F)C#N,C3AABFC3E601930B_C7EF92AD5B571081_6041_DP,7.6121674,00000000000000000000000000000000000000000110000000000110000000000000000000000001101100110011000010001000100100010000000001000100110101110110001011000011010110101111010,XTWREXIXRFBDHV-MAUKXSAKSA-N
CC1=CC2=C(C=C1)C(=CN2CC3(CC(F)C3)C4=CC=CC=C4)C5CCNCC5,0A98E56298A9458C_BD4C6AE5AF88CD4B_6034_UN,8.316282,00000000000100000000000000000000000000000010000000000000000000100110000000010000001101110001000010101100110100011000001011100100110000100110001001011001010110101111010,UVDMGKPDVKDULD-UHFFFAOYSA-N
C1(=C(C(=CC=C1Cl)Cl)Cl)NC[C@@H]2CCCN(C)[C@H]2C3=C[N](N=C3)C,EB2BB90E10D45BD9_544A6F1B0D02A320_7022_UN,8.748539,00000000000000000000000000000000000000000000000000001000000000100100000000010000101101110011011010101001000110010001101011101100110001110110001011011111010110101111010,FSPRLHXZCGSBEE-APPDUMDISA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCCC34C(C)(C(CC3)CC4)C,D155E837A4E57321_52EA54DF78191F7D_6041_UN,8.065052,00000000000000000000000000000000000000100010000000001000000000100110000000110101101100010001011010101000110110011000101011101100110001110100011011011111010110101111010,SBBROXVAAJTSEN-UHFFFAOYSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC5CCOC(C4=CN=C[N]4C)C5,592DD7B04055BAB9_1EC18C3945D54BEF_6041_UN,7.328022,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101110010010111100100110111010000001011100100110011110110001011011011110011111111110,RAWXASRZSQHEQU-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)C[C@H]3NC[C@H](C3)F)Cl,22C01AF95CF6A76D_606639102B8821AB_6034_UN,8.3801775,00000000000000000000000000000000000010000010000100000000000000000100000000010111011101011011000010001001101110010000000111100100110101110110001010001011010110101111010,UFYMBVPCXKINLT-STQMWFEESA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)C[C@H]3NC[C@H](C3)Cl)Cl,91EB3A3EE0DA07C1_8A65836AE7C23E9F_6034_UN,8.380176,00000000000000000000000000000000000010000000000100000000000000000100000000010111011101011011000010001001101110010000000111100100110101110110001010001011010110101111010,FELJNUBLMDKVDR-STQMWFEESA-N
C1(=CC2=C(C=C1)[N](N=C2)C3CCCCO3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,C0B3F20D370C212C_4B1F258CAC81C8CC_6041_UN,8.575779,00000000000000000000000000000000000000000010000000001000010000100100000000010001100101110011111110101100110111110001111011101100110011110110001011011011010011101111110,NGKGQGKGBHRSSO-FQXDTITESA-N
FC1=C(C2=C(C=C1)CCC2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,E78DF770ADA42B9E_2DACEEB9D85123FC_6041_UN,8.016616,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,GZFSFYOAPFROBS-ZHRRBRCNSA-N
CC1=C(C2=C([NH]1)C(=CC=C2)NCC3(CCCO3)C4CC4)C,991E9E1FB115AAD6_4136C0592CC54341_6041_UN,7.781635,00000000000000000000001000000000000000000000000000000010010000100110000000000001001100000011000110001100010001001000001011000100110111010110001010010111110111101111110,UWYSCUYVYLNHJQ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC23CC(C)(CO2)CCC3)F)[N]4C=CC=C4,663E7B443DCE62A2_04F043D4B0833B04_6041_UN,7.0762725,00000000000000000001000000000000000000000010000000000000010000100110000000010000001101010011000110001000010111001001101011100100110011110110001011011111110111101111110,PXKPZYCTLHESIU-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2(CC2)C3CCOCC3)F,3ED56669F5CD3952_60659CC5C59B6D48_7022_UN,7.7705703,00000000000000000000001000000000000000000010000000000000010000100010000000100000001001110011010000101000000101001001001000100000110011110110001011011111010111101111110,ZVZGYUXYPBDDIV-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2COCC2C)F)CC3,C147EC0E0419B828_79B39F5899C6B005_6041_UN,7.39418,00000000000000000001000000000000000000000010000000000000010000000000000000010001100101110011010111001000100111010001101011100000110001110110001010011111010111101111110,FWZFZCIOLQDKLQ-UHFFFAOYSA-N
CC1=C[N](C)C(=N1)NCC(N2CC(C)OC(C2)C)C3=C(C=CC=C3F)F,AE1276C53DBD5AC4_B4C134250D22071F_6041_UN,8.413385,00000000000000000000000001000000000000000010000000000000010000000100000000010101001101110001010110101000001110010001000011100100110011110110011011001111110111101111110,LTFVQSGJOMDSQO-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCC3)C4=CCOCC4,64726ED95CC9D943_85B0E74EF1595C54_6041_UN,7.878305,00000000000100000000000000000000000000000010000000101000010000100110000000011000101100110011011010111100010101001000001011101100110011110110001001011001010111101111110,XUKXZKSAHALRFZ-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC35CC4CC(CC(C3)C4)C5,E3DE2EEB736630F6_10F4BBA426DC0E6F_6041_UN,8.250974,00000000000000000000000001000000000000000010000000000000000000000110000000010101000101010001010010000100111100011000000011100100100001110100001011001011000010101111010,PGFMUQPLYUEENN-UHFFFAOYSA-N
CCN1C(CC2=C1C=C(C=C2)F)C3=NC=CN3CCN4CC(C)(C)SCC4,1E283D3FF7EAFC3B_8200A63DE062F41E_6034_UN,8.9402485,00000000000000000000000000000000000010100010000000000000000000100110000000110101010101111000000010101100010110011011101011100100110000110110011011011110010110101111010,IPRFBGSIESRICY-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NC[C@H]4[C@H](C3=NC=C[N]3C)OCC4,7667845AC2B5B903_FDFC89E2AC50F3AB_7022_UN,7.612598,00000000000000000000001000000000000000100010000000000000010000100100000000010101001101010011010111001000000101000000001011100100110011110110001010011011110111101111110,ISGPEAUFAPPMFS-WMLDXEAASA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NC[C@H]4[C@H](C3=NC=C[N]3C)OCC4,3E66904C97EFE2ED_093C7BEFE4135214_7022_UN,7.6125903,00000000000000000000001000000000000000100000000000000000010000100100000000010101001101010011010111001001000101000000001011100100110011110110001010011011110111101111110,ZBJUOQNPEQTQDL-WMLDXEAASA-N
CN5CC(C1=NN=C(C)N1C[C@H]2[C@@H](CNC2)C3=CC(=CC=C3)F)C4(CNC4)C5,B5A85B815C241AF2_E35F3A5826814580_6034_UN,7.399213,00000000100100000000000000000000000000100010000000001000000000100110000000010101101101110011011010001000010110001001100011101100110100100110001010001111010110101111010,QVETXQYHXJWZDY-SPIBDARASA-N
FC1=C(C2=C(C=C1)CCC2)NC3=CC=CC(=C3)CC4CCCN(C)C4,9C0690929975AC74_A63D06BB3F73CC4F_6041_UN,7.4417887,00000000000000000000000000000000000000000010000000000000000000000000000000010000000001110011010010101100010110010001101001100100110001110110001011011011010110101111010,XDSWGYZAVYNDNH-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)F)F)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,2661D9C2371BD9DB_3B4354F7621D3378_6038_DP,7.5538406,00000000000100000000000000000000000000000010000000000010000000100010000000000001001100010011100110001000110100111000010001000000110100100110001010000011011110100111110,KHWSUHRIOFRTMV-IQGLFJIHSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,2989D42ACE51221E_A1431EDE27D2A738_7022_UN,8.21818,00000000000000000000001000000000000000000010000000001000000000000110000000110000101100010011001010001100010100011001101011101100110001110110001011011111010110101111010,VJGNFZVTEXAAQH-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NCCC3CCN(C2CCN(C)CC2)CC3)C=C,D61AA530E49D33B3_0C2BBBED2247582F_6041_UN,8.011995,00000000000000000000000000000000001000000010000000000000000000100000000000010000101001110001010000111000100100010001101011100000110001110110001011011011010110101111010,NTHYVPDQEFDQNT-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)I)Cl)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,5313742265955245_8F673B11706CAF2B_6038_DP,7.5538445,00000000000100000000000000010000000000000000000000000010000000100010000000000001001100010011100110001001110100111000010001000000110100100110001010000011011110100111110,QHMTYTWMUWKWRR-IQGLFJIHSA-N
N(CC1=CC(=C(C=C1)F)Br)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,672FD965B26C49C7_4E70BDEE76C8D951_6038_DP,7.553839,00000000000100000000000000000000000000000010001000000010000000100010000000000001001100010011100110001000110100111000010001000000110100100110001010000011011110100111110,HGUQQONVKVHPPE-IQGLFJIHSA-N
N(CC1=CC(=C(C=C1)Br)F)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,360072C93672DDAB_2FF43F63C7E7A490_6038_DP,7.5538435,00000000000100000000000000000000000000000010001000000010000000100010000000000001001100010011100110001000110100111000010001000000110100100110001010000011011110100111110,JODTYKUKMYVYOL-IQGLFJIHSA-N
N(CC1=CC(=C(C=C1)Cl)F)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,61DCA9525A24B296_085B91BF7281A79A_6038_DP,7.553831,00000000000100000000000000000000000000000010000000000010000000100010000000000001001100010011100110001001110100111000010001000000110100100110001010000011011110100111110,VWCALGHWQMCVNC-IQGLFJIHSA-N
N(CC1=CC(=C(C=C1)Cl)Cl)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,3EABCC148D844D0F_1F65AC90FEB3AA8A_6038_DP,7.553834,00000000000100000000000000000000000000000000000000000010000000100010000000000001001100010011100110001001110100111000010001000000110100100110001010000011011110100111110,QWXSNMACDIYAFA-IQGLFJIHSA-N
N(CC1=CC(=C(C=C1)F)Cl)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,E8DD11CAB9646E31_679890F9274FEBC4_6038_DP,7.553824,00000000000100000000000000000000000000000010000000000010000000100010000000000001001100010011100110001001110100111000010001000000110100100110001010000011011110100111110,QJILNBVESNXHRA-IQGLFJIHSA-N
CN(C)CC1=CN(C2=C1C=CC(=C2)F)CC4CC3(CCCC3)CN4,EB091D967EEFAE37_06FAA43E7D28A173_6034_UN,7.49458,00000000000000000000000000000000000000000010000000000000000000000110000000110001101101110011010010001100110100011001001011100100110000100110001000011101010110101111010,LOPYEPCMACGFHF-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)Br)Br)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,CBAA268E357D411E_B0F45A2FFA28C784_6038_DP,7.55381,00000000000100000000000000000000000000000000001000000010000000100010000000000001001100010011100110001000110100111000010001000000110100100110001010000011011110100111110,PZQMSKSOUREBBN-IQGLFJIHSA-N
N1CCCC1C2=NC=C(C=N2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,20831F3E57EA9A7B_053C0EA31D263135_6041_DP,8.356323,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100010101110110001001011011010010101111010,LOTYNJFSKJACQU-BLAYRMRBSA-N
CC2=C1N=C(SC1=CC=C2F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,614FA78B1604C3ED_83DD64A017B7A6DF_6041_UN,8.51788,00000000000000000000001000000000000010000010000100000000000000100100000000010101111101011011010010101100011100010000001011100100110001110110001011011111010110101111010,XCHDMQCDZMJJRO-VLIAUNLRSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC23CCC(CC2)(F)CC3)F)CC4,FE14B37C70DB5226_E29A462100EECE29_6041_UN,7.583422,00000000000000000001000000000000000000000010000000000000000000000010000000010001100001110010010000001000110110011001101011100000110001110110001011011011010110101111010,AYYBVCSRPIKHRZ-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC3CC2(CCN(C)CC2)OC4=C3C=CC=C4)C5CC5,7168987F44742B84_7A3542DD1234A174_6041_UN,7.751265,00000000000000000000001000000000000000000010000000000000010000100010000000010000000001110001010001101100110100011101101011100100110011110110001011011011110011101111110,BKTIHJOCPIUQFO-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC3=C2CCCCC2=CN=C3,A71FCB84405C7BC3_1692B5804F65B74C_6041_UN,7.5917497,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100011010000100100010000001000001011000100110001010100011011011111000010101111010,FPSYRUDFOXQSIY-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NC(CC)C3CCCCO3)C,E9606869F63F6EDC_6626AA6108B1DA32_6041_UN,8.258617,00000000000000000000000000000000000000000000000000000100010000000100000000000000100100000011000110100100110011010010001011000100110111010100011011010111110111101111110,OJIDIOQHDDVXHV-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(C3=CC4=C(C=C3F)[NH]C(=N4)C)=O,30CEF75601C7E545_226C218F495F414B_6038_UN,8.054786,00000000000000000001000000000000000000100010000000000000010000000100000000000101001100010010100010101100010100100000011011000100110110100100001011010011111111111111110,DRLYLIVOTCYIQX-UHFFFAOYSA-N
C1(=NC(=CS1)C2CCCCCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,3FFA0B6BDA4A7527_F9235EAE8E18561C_6041_UN,8.172236,00000000000000000001000000000000000010000010000100000000000000100100000000010101110101111011010010001000101110010001101011100100110001110100001010011011010010101111010,BZQDGHMMVQSKNS-QUCCMNQESA-N
N4CCN(CC1=NN=C(C=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)CC4(C)C,9C55516ADED50A7F_DFD985AE302E861E_6041_DP,8.311067,00000000000000000000000000000000000000100010000000001100000000100110000000110101101001110011001000101000100110011001101011101100110101110110001001011111010110101111010,JDORYFARAUMVKS-GHTZIAJQSA-N
N5CCC4(CN(CC1=NC=C(N=C1)NC2(CC[Si](C)(C)CC2)C3=CC=CC=C3)C4)CC5,E6B936F2CDC02411_CCC22E9D573E4145_6041_DP,7.9954815,00000000100100000000100000000010000000100000000000000000000000100110000000110101101001100011010000101000110000011001101011100100110101010110001001011101010110101111010,VQHNFJVUPIMPJC-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC3CCNC4(C3)CCC4,45E199AB680AE40D_99AB23631B981F85_6041_DP,7.6854143,00000000000100000000000000000000000000100000000000001000000000100110000000010101101100000011011010101000110010011000001011101100110101010110001011011111010110101111010,HYONKJPEKNOUHV-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCCC3=CC=CC4=C3OC(C)(C)C4,CDD0BE1F7B8A4A8B_6EE864D49C0BDE12_6041_UN,7.952774,00000000000000000000000000000000000000100010000000001000010000100110000000110101101100010000011010101100110100011101001011101100100011110100011011011111110111101111110,ARVWROFDQIUKKP-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)F)NCC2CCCN(C)C2C3=CC=CS3)F,03B10255E293BA7A_2D7553FFEF21D9BF_6041_UN,8.126161,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101000000110010001101011100100110001110110001011011111010110101111010,ZDVAJICQMUXSRR-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)N[C@@H]4C6=C(OC5(C4)CCC5)C=CC(=C6)F,781D1F9A96836186_7AD85F911AC85B0E_6041_DP,8.288995,00000000000100000001000000000000000000100010000000000000010000000110000000000101100101010011010011100100110100011100101011100100110111110100001011011001100011101111110,SFSLLBANWAVCMK-DMUMMCEESA-N
FC2=C(C=C1OC=CC1=C2)NC4CCC3(CCN(C)CC3)CC4,B85106A50B2C8EE9_B5A167A03A15385F_6041_UN,7.6175017,00000000000000000000000000000000000000000010000000000000010000000010000000010000000101110010010011101100110100011001101011100100110001110110001011011011110010101111110,KUQCIISYRVUNEX-UHFFFAOYSA-N
FC2=CC(=C1OCCC1=C2)NCC(OC)C3CCOC3,15769618A50E5380_ACD8A0735D9EA7DD_6041_UN,7.059101,00000000000000000000000000000000000000000010000000000000010000000000000000000000001100110101010110001100010111000100101010000010110011110110000010110001110111111111110,QXAZUSMVJKKFSW-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=C[NH]2)NCCC4CCN(C3CCN(C)CC3)CC4,572B2589C4EE1775_4A41039A38D8D836_6041_UN,7.4185133,00000000000000000000000000000000000000000000000000000010000000100100000000010001101101100001010010101100110010010001101011100100110101010110001011011111010110101111010,XOITYXPCXMSBGD-UHFFFAOYSA-N
CC1(CCO1)C2=CC(=CS2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,84882F84A6F0F7F8_62ACA9F25D57CB00_6041_DP,7.6887164,00000000100100000000000000000000000010000010000000000100010000100010000000000000111100111011000010101000100101011001101011000100110111110110001001010011110111101111110,COILWPSENBNWSD-CMNDMHKISA-N
CN(C)C1=C2C(=CC=N1)C(=CC=C2)NC3CCCC(C3)C4=CC(=C(C=C4)F)F,6714751067D503E4_832143752BF8ADD1_6041_UN,7.8989587,00000000000000000000000000000000000000100010000000000000000000100100000000100100000001110011010000100100110100010000001001100100110001110100001011011111000010101111010,CLIUBKCPIMAOEO-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCC3(CC2)CC3)Cl)C4CC4,0B8A631772336C60_9BD660CCBCFF12B3_7022_UN,7.4502735,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010011000000001001010110001000001000000000110001110000000011010011010110101111010,JXCDRZPKMGNTRM-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=CC2=O)C[C@H]4N[C@H]3CCC[C@H]3C4,6CD14575B1D0AECD_42A9A56271FDF496_6034_UN,8.910256,00000000000000000000000000000000000000000000001000000000000000000100000000010001000101010011000011101100110100010100001011100101110000100100001101011001111110100111110,QOWKCNLHDNJWCR-WHOFXGATSA-N
FC2=C1CCCC1=CC(=C2)NC4CC(C3=CC=N[N]3C)OCC4,3386FA5107F4E611_F5D3671C5838BB18_6041_UN,7.2687416,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111100100110111010000001011101100110011110100001011011011110011101111110,ZKSSYAAJIHMGLE-UHFFFAOYSA-N
CC3=NC2=C([C@H]1CCCN[C@H]1CC2)N3CC(CC4=C(C=CC(=C4)Br)F)C#N,72781AC5BE6B10EF_3EBB6BD2CA0EC50F_6034_UN,7.619081,00000000000000000000000000000000000000100110001000000000000000000100000000010101101101010011000010101100110110010000101011100100110000100110001011011011010110101111010,OPLSQWUGMYHZTL-WGAGKFISSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4=CC(=C(C=C4)F)C5CC5,C8A8769AE8CFB4A7_6589E60053F5EC00_6041_DP,8.522099,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110001010010101000010110000000000011100100110101110110001011011011010010101111010,RPULWAWNODKPPJ-RTHVDDQRSA-N
C(C2CCCC1(CC1)C2)=CC3=C[N](C)N=C3C4=CC(=CC=C4)F,7DF7738F14365F4D_3A220B0E3533E8BE_7019_UN,7.5280437,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001011011010000010101111010,XQAPVNBMZINWSB-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC3C(C)(SCC3)C,E0031FB9A230A069_EB0FBE40AB52CC01_6041_UN,8.1265545,00000000000000000000000000000000000010000010000000000000000000000110000000100000111100011011000010101100010110001000101011000100110001110110011011010111010110101111010,KFJKNQGADNXPPH-UHFFFAOYSA-N
FC2=C1C=C[NH]C1=CC=C2NC4CC3=C(C=N[N]3C)CC4,C5D648C1498BA1AD_1D1540AEC0E5CE71_6041_UN,8.728265,00000000000000000000000000000000000000000010000000001000000000000100000000010000100100010010011010000100110110010000101011101100110101110100001011011011000010101111010,IFPRCTXYORAJFN-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2(C)CCCCCCC2)F,4DD6DF635D3C15FA_CC801E0ACBD70098_6041_UN,7.726006,00000000000000000000000000000000000000000010000000000000000000000010000000100000001001110011010000001100000110001001101000100000110001110010011010011111010110101111010,HOCNBAIDPJSBAB-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NCC3CCSCCC3,012D6960F9191DDF_ECCD41E6525EBDFB_6041_UN,7.8061275,00000000000000000001000000000000000010000010000000000000000000000100000000100000101000111011000000101100010100000000001011000100110001110110011011010111010110101111010,SYUWXIYEQUQWNB-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCCC(C)CC2)F)CC3,5E44C0F11AB5CA7D_7B2FF893879CBFD1_6041_UN,7.606428,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010000001000000110010001101011100000110001110110001010011111010110101111010,RWGJHONVYVMILE-UHFFFAOYSA-N
CCC5CCC1=C(C4=C(N1CCC2NC3=C(OC2)C=CC(=C3)F)C=CC(=C4)C)C5,56FA9ACDDE867186_850E597582CB2447_6034_UN,8.281148,00000000000000000000000000000000000000000010000000000000010000000100000000010000100101010011000110101100110111010110101011100100110000110110001011011101110111101111110,HMYUIBGHIOUCEI-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC3CNCC4(C3)CC4,33DCE35C462AADD1_34B0413698452A20_6041_DP,7.7638984,00000000000000000000001000000000000000100000000000001010000000100110000000010101101101100011011010101000110000011000000011101100110101010110001011011111010010101111010,LDBILQPLOGRPDB-UHFFFAOYSA-N
C([CH]2C[C]1(C[CH2]C1)C2)=CC3=C[N](C)N=C3C4=CC=C(C=C4)F,7E27FDCA61A7DFC4_51505A5BBA95C301_7019_UN,7.469008,00000000000100000000000000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001010011010000010101111010,IMEFKYXCOOKKIU-UHFFFAOYSA-N
N(CC2=NC1=C(C=CC=C1F)O2)C(C34CCC(N3)CC4)=O,3B405B81E8C57E08_3B0D12AB3CDEDCE8_6038_DP,8.217885,00000000000000000000000000000000000000000010000000000010010000000110000000000001001100010011100110001100110100111000011011000100110110100100001001010001111110110111110,YFPWIPJXYHZQON-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CCC2)C3=CCOCC3)F)CC4,79261371C4C77B64_3100FDDA6DEFF121_6041_UN,8.094453,00000000000100000001000000000000000000000010000000100000010000100010000000011001101001110011010000111000000111011001101011100000110011110110001011011011010111101111110,PGNXJCUDSQFQSP-UHFFFAOYSA-N
ClC1=CC2=C(C=C1)N(C(=CC2=O)C3CC3)C[C@H]5N[C@H]4CCO[C@H]4C5,06C52022EA1FFAAA_527C422FE5F2409D_6034_UN,8.785642,00000000000000000000001000000000000000000000000000000000010000100100000000010001000101010011000111101101110101010100001011100101110010100110001111011011111111110111110,PHEHPWPVPCEELX-RFUYNDQBSA-N
CC1=C(C=C(C(=C1)NC2C4CCC2CC3=C(C=CC=C3)C4)Cl)C5CC5,0EC0DE0DFE9E03F0_044E2DC77ACEFEB9_7022_UN,7.401436,00000000000000000001001000000000000000000000000000000000000000100000000000000000000000010011000010000101010110000000001000000100110001110000000011010011000010101111010,JKDGREZBLYSUCC-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC4CNC3(CCC3)C4)Cl,55A8EC7A0B5FFAB9_90B9BD07A075EB2B_6034_UN,7.1998963,00000000000100000000000000000000000010000000000100000000000000000110000000010110111101011011000010001001111100011000001111100100110101110110001010011011010110101111010,UJRJTHCPPYXCPE-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)N[CH]3CC[C]4(CC3)CC[CH2]CC4,3008BF6EE48E0E01_55AB6B9F9B6AAA92_6041_UN,8.334026,00000000000000000000000000000000000000000010000000000000000000000110000000000000100000010010000000100100110100011000001001000100110001110100001011010011000010101111010,JOWHOPYAFUJBOE-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC3C2CCCCC2NC3,EE3F1BE69996AED5_7B035D53BAA6FEE0_6041_DP,8.271651,00000000000000000000000000000000000000000110000000000100000000000000000000000000101100010011000010001100110110010000001001000000110101110110001011010011010110101111010,HTFRIHXTGRYOQE-UHFFFAOYSA-N
ClC2=C1N(C(C=CC1=CC=C2Br)=O)C[C@H]3[C@@H](CNC3)C4CCOCC4,39230E3D9FDFAC41_84DC59AB23CF6750_6034_UN,8.3937235,00000000000000000000000000000000000000000000001000000000010000100100000000010000101101110011100010101101010101100100011011100101110010100110001111011011011111110111110,FEZPVYQDKMGEEY-GJZGRUSLSA-N
CC3(C)CCCC(C=CC1=C[N](C)N=C1C2=C(C=CC(=C2)F)F)C3,79FB83B53C599FDA_E602C2ED1C9CB7D5_7019_UN,7.9569297,00000000000000000000000000000000000000000010000000001000000000100110000000110000100100010000011010010000000110001001101011101100110000100100011011011110000010101111010,YINRUHAQDPJAHZ-UHFFFAOYSA-N
C[N]1N=C(N=C1N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F)C4CCC4,96AA606A1288416D_20BF95CB4FA9CEB5_6041_DP,8.206751,00000000000100000000000001000000000000100010000000001010000000100100000000010101101100110011011010101000101100010000001011101100110101110110001011011011010010101111010,CEFRBFFBQWGDCQ-HZPDHXFCSA-N
O[C@H](CCl)C1=CC=C(C=C1)NCC23CC(C)(CO2)CCC3,CD10EEE898B1707F_B7BD72423DC7969C_6041_UN,8.021459,00000000000000000001000000000000000000000000000000000000010000000010000000000000001100000011000110001001110011001001101000000000110111110111000001010001110111111111110,CAXCQWKAALNEEF-KLAILNCOSA-N
BrC1=CC(=CC=C1)C2=CSC(=N2)C3=CC=CN3C[C@]45CNC[C@H]4CN(C)CC5,3ABC3E74659D11A9_845CAC09D5F0269A_6034_UN,8.095307,00000000000000000000000000000000000010000000001100000000000000100110000000010001111101111011010010101100010110011001101011100100110000100110001011011011010110101111010,RPKASUZMXKRDCZ-JTSKRJEESA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NC3=CN(C)C(C=C3)=O)C4,469F34A8D35C7CD2_E329E44BBCB9DBE1_6041_UN,8.758062,00000000000000000000000000000000000000000000000000000000000000000100000000010001100101100011110010101100110000110101111011100101110101010110001111011111011010101111110,KLBMPLQQPKVKIR-UHFFFAOYSA-N
FC1=CC=C(C=C1)C3=CC2=C(C=CC=C2)N3C[C@@]4(C)COC[C@H]5CCCN45,8F549C15CCF3A88B_0542C0C194677931_6034_UN,8.290655,00000000000000000000000000000000000000000010000000000000010000100110000000010001000101110000000111101100010111011001101011100100110000100110001011011010010111101111110,ZHYRRHWVNWHVTD-OFNKIYASSA-N
FC1=CC(=CC=C1)C2=CSC(=N2)C3=CC=CN3C[C@]45CNC[C@H]4CN(C)CC5,1D92D72EB30B7C7C_607DF3C8EB32838C_6034_UN,8.095314,00000000000000000000000000000000000010000010000100000000000000100110000000010001111101111011010010101100010110011001101011100100110000100110001011011011010110101111010,OBRLEKLTOIFTDG-JTSKRJEESA-N
CN(CC1=NN=C(C=C1)NC[C@H]2[C@@H](C2)C3=C(C=CC=C3F)F)C4[C@@H]5CNC[C@H]45,AF13761B9FBE5CCE_E33F91126CB21C47_6041_DP,7.870882,00000000000000000000001000000000000000100010000000001000000000100100000000000101101101110011011010101000010110010001000011101100110101110110001011001011010110101111010,VGDULMDSWNTCRO-OLCZDCNJSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NCC3CCCC(CC)C3,C9518DCF6BDE375A_B740027B7344546D_6041_UN,8.685418,00000000000000000000000000000000000000100011000000000000000000000100000000000100001100010011000010001100010110000010101001000100110101110100001001010001010110101111010,AYILPUYPUDKYKF-UHFFFAOYSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)C[C@]34CCCC[C@H]3CNC4,D6558A98F483F0AF_BE3C5610562A2C21_6034_DP,8.493897,00000000000000000000000000000000000010000000000100000000000000100110000000010110111101111011000010001101011100011011001111100100110001110110001011011111010110101111010,YSWJNGOCCPDGKT-DECKRMNZSA-N
FC2=C1CCCC1=C(C=C2)NCC3CCN(C)C3C4=CC=CS4,40887FC012E6BD37_230FF0FE25E47AFA_6041_UN,7.8671813,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010001100010110010001101011100100110001110110001010011011010110101111010,FBBLCTORNAXFHB-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCCOC2CCOCC2)Cl)C3CC3,95F65DEA4CFBFEE9_14423BDA173D4432_7022_UN,8.098438,00000000000000000000001000000000000000000000000000000000010000100000000000000000001000110100000100101001100111010000001000000011110011110110000111010011110111111111110,OGYYJRVPUIQUDU-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)F,9A4C7C00670CA51C_77AB86737BC00B8A_6041_UN,8.806427,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,UGMHEXZVRBQKHH-YJYMSZOUSA-N
CC1=C(C=C(C=C1)F)NCC3(C2CCNCC2)CCOCC3,3C9F4FE8EE052A10_99FED1422B4E37AF_7022_DP,8.258241,00000000000000000000000000000000000000000010000000000000010000100010000000000000001000110011000000101000100111011000001011000000110111110110001011010011010111101111110,BDIIQYFMOLOCAJ-UHFFFAOYSA-N
CC1=C(C=C(C=C1)Cl)NCC3(C2CCNCC2)CCOCC3,09E2BEA6B7DFE071_75FD3CA829FC089D_7022_DP,8.258241,00000000000000000000000000000000000000000000000000000000010000100010000000000000001000110011000000101001100111011000001011000000110111110110001011010011010111101111110,CTBPISRJBXKJTR-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC3CCNC(C3)(C)C,CFE583D8CA24156D_2D1BC0C4A87ED7A0_7022_DP,7.6520624,00000000000000000000000000000000000000000010000000001000000000000110000000110000101100010011001010101000100110011001101011101100110101110110001011011111010110101111010,GITALWRMIXRTAF-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N(C=C2C3CCNCC3)CCN4CC(C(C)C)C4,07D3A07889BD8443_FE801A5860517E31_6034_UN,8.998251,00000000100100000000000000000000000000000010000000000000000000100100000000110001001101110001000010101100110100010000101011100100110000100110001001011101010110101111010,CRUSMMZTOLDZOE-UHFFFAOYSA-N
CN1CCCC1C2=CC=C(C=C2)NC4=CC3=C(C=C[N]3CC)C=C4,F8DFDA30417F0E28_9208CDA344061025_6041_UN,8.597333,00000000000000000000000000000000000000000000000000000000000000100100000000010000100101100000010010001100010010010011101011100100010001010110001001011111010110101111010,CGNRGKASXFXBDU-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2N(C)CC3(CC2)CCC3)F,C7EDF9920DF82CBC_1E919E8080427C75_7022_UN,7.5919995,00000000000100000000000000000000000000000010000000000000000000000010000000110001001001110011010000101000010110011001101001100000110001110110011011011111010110101111010,IGGPTIJTUJLVPU-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CCC3)C4=C(C=CC=N4)F,C6BA1811387402D2_CF7BEA296E4832BA_6041_UN,7.94172,00000000000100000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,UJJPTDVXNTXIHX-KRWDZBQOSA-N
C[Si](C)(C)C1=C(C=CC=C1)NCC3CC2(CCNCC2)C3,3EB65D607703B2E5_32D076D73ACE8420_6041_DP,7.3326354,00000000000100000000100000000010000000000000000000000000000000000010000000100000001000100011010000101000110000011000001001000000110101010110011011011111010110101111010,NNSQKGZOHQPUAO-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCCCN2C)F)CC3,A61FE1FC324AC474_0668110AFD341EFA_6041_UN,7.325478,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010000101000000110010001101011100000110001110110001011011111010110101111010,WRDFXQRRMVYWJQ-UHFFFAOYSA-N
N4CCC1=C(C=C(C(N1CC2(F)CNCC2C3=CC=CC=C3)=O)C#N)C4,74974B4E5652B987_FBDBA513656C52B8_6034_DP,8.224987,00000000000000000000000000000000000000000110000000000000000000100110000000010000101101110011100011101100110100111100011011100101110100100110001111011011011110100111110,JSYDPZCDEQZSQI-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC4C(C)(C4)C5=C(C=CC(=C5)F)F,B563193FE988FFC2_70D3F3610E3A66E2_6041_DP,8.225538,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011001100011100100110101110110001011001111010010101111010,YPVXWLYUHCWCLR-PXIGHNNKSA-N
O(C(CBr)C1CCOC1)C4=CC2=C([N](C)C3=C2CCCC3)C=C4,5C927D09BFF66649_571B158F0C68A1D1_6035_UN,7.830534,00000000000000000000000000000000000000000000001000000000010000000100000000010000000101100100010010000100010011010100101011100111110010100110000111011000110111111111110,UOHJQXHBQDMHGY-UHFFFAOYSA-N
N1CC2CCC1CN2C3=NC(=NC=C3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,C52AC424D3146522_07C2491432FBAD98_6041_DP,8.298171,00000000000000000000000001000000000000100010000000000000000000100100000000010101101101110011010010101000111110010001101011100100110101110110001011011011010010101111010,AWQSXNKREITUOS-KUIQPFCPSA-N
FC2=C1[NH]C=CC1=CC(=C2)NC4C[C@H]3CCC[C@H](N3C)C4,A6A4115A7DB80961_1940E359EBF4B9C3_6041_UN,8.028184,00000000000000000000000000000000000000000010000000000000000000000100000000010000100101010001010010100100110110010000101011100100110101110100001001011001000010101111010,RQRNIQGDFAMKNX-GOOCMWNKSA-N
CC1=C(C=C(C(=C1)NC3CCCC2(CCC2)C3)Cl)C4CC4,A99D89E6B5417A71_91D8F979C9FB2C39_7022_UN,7.7346826,00000000000100000000001000000000000000000000000000000000000000100010000000000000000000010011000000000001110110011000001000000000110001110000000011010011000010101111010,LJEUFNPKDWQIJU-UHFFFAOYSA-N
C1(=CC(=C(C=C1)Cl)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,E0AB5F9270E2B845_DD21C724CEF6442E_7022_UN,8.72855,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,WSNLFQKORRULIX-HOTGVXAUSA-N
C1(=CC(=C(C=C1)F)Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,A7820B00A23D4648_8A6A6673705F33FD_7022_UN,8.728537,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,UZCKITFVCGVDJI-HOTGVXAUSA-N
C(C2CCC1(CC1)CC2)=CC3=C(Cl)[N](C(=N3)N(C)C)C4=CC=C(C=C4)F,2AC78D01F2DA9F1B_D60178DB6E59B446_7019_UN,7.338346,00000000000000000000001001000000000000000010000000000000000000100110000000110101000101110000010010010001011100001000001011100100110001110100001011011110000010101111010,FXCZVUKATJZDTL-UHFFFAOYSA-N
N(C1=CC=C(C=C1)N2CC3CCC(C2)O3)C(=O)[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)Cl)F,8B51D0F068FFA702_73FC7045072870D1_6038_UN,7.677538,00000000000000000001000000000000000000000010000000000000010000100000000000010000000101110111100111101001010101100000011011100100110011110110001011111011111011110111110,IJFUABUNNHCCLF-OKYOFGHESA-N
N(C1=CC=C(C=C1)N2CC3CCC(C2)O3)C(=O)[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)F)F,C9F09BA3477DF8DC_1069916702CD8954_6038_UN,7.677509,00000000000000000001000000000000000000000010000000000000010000100000000000010000000101110111100111101000010101100000011011100100110011110110001011111011111011110111110,FHQSODVEQGNOAV-OKYOFGHESA-N
C1(=CC(=C(C=C1)F)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,93A3B94E680ABBD8_8FC021277EF690D0_7022_UN,8.728495,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,AKQVKXNZJBWSBG-HOTGVXAUSA-N
CC1OC(CN(C1)CC2=CC=C(C=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F)C,712748D31A52B1E9_D2B4A7BBBB2BD075_6041_UN,8.343204,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011010110101000100110010001101011100100100011110110011001011111110111101111110,FUVBOCNUMMVODS-COOLUFGBSA-N
C1(=CC(=C(C=C1)Cl)Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,2CB429FE7A3D3A92_A2440D1B80A6ED44_7022_UN,8.728484,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,UHNHGKLGFUYSCL-HOTGVXAUSA-N
C1(=CC2=C(N=C1)C(=CC=C2)F)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,CF995C068C295608_680E2A385CBEED29_7022_UN,7.8646746,00000000000000000000000000000000000000000010000000001000010000100100000000010001101101110001011110101100010111010001101011101100110011110110001001011111110111101111110,JLCGIHBZQHNSMV-HKUYNNGSSA-N
ClC1=CC3=C(C=C1)C(=O)C2=C(CCCC2)N3C[C@H]5[C@H]4CNC[C@H]4OC5,36896B607F46F6CC_4C5030B1E9F6E5AF_6034_UN,9.005492,00000000000000000000000000000000000000000000000000000000010000000100000000010000001101110001000111101101010101010100001011100101110010100110001111011001111111110111110,CUXKWSKUGBQAOW-SMNXXWJPSA-N
O(C1CCC3(CC1N2CCCC2)OCCO3)CC4=CC=C([Si](C)(C)C)C=C4,48219DEA6C86786C_0C2F175F6AAE5A20_6039_UN,7.796151,00000000000000000000100000000010000000000000000000000000010000100000000010110000000101100000010111001000010001011000001011110011110011000110010101111110110111111111110,XLOVFGCADJPXFL-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NCC2CCCC3=C2N=CC=C3,3647A610DE93F591_220DC65210912932_6041_UN,7.769404,00000000000000000000100000000010000000000000000000000000000000000100000000100000101000100011010000101100010000001000001001000100110001010100011011011101010110101111010,UTASBFYIMKIJRK-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC2=NC=C[N]2C[C@@H]3CNCC(O3)(C)C,9A15668E19446E72_F3EB5D97B3CC3CDF_6034_DP,8.279405,00000000000000000000000000000000000000100000000000000000010000000110000000110101101101110011000110101001000110011001000011100100110111110110011011001111110111101111110,KXTNPGAOULQIBF-AWEZNQCLSA-N
NC1=C[N](C2=C1C=CC(=C2)Br)CC3C(CCN3)C4CC4,4FFC318EF9EB30DA_D7C32FAE639F7D60_6034_DP,8.645739,00000000000000000000001000000000000000000000001000000000000000100100000000010001101111010011000010001100110100010000001011100100110101110110001000011011010110100111010,ZFEKAQZUUNRVTR-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC35CC4CC(CC(C3)C4)C5,396A5B1BB875F859_E222CC412E5E0DE0_6041_UN,7.685587,00000000000000000000000000000000000000100010000000001000000000100110000000010101100100010001011010100100110100011000000011101100100001110100001011001011000010101111010,XMBNPNSGIPRNCQ-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)[N](C=C2C3CC3)C[C@@]45CCN(C)C[C@H]4CNC5,74B970D173235952_199D954898266A03_6034_DP,7.880609,00000000000000000000001000000000000000000000001000000000000000100110000000010000101101110011010010101100010110011001101011100100110000100110001001011001010110101111010,VWMITWRQQVDRCV-QRWLVFNGSA-N
FC1=CC2=C(C=C1)C(=NN=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,F268AD3E77B58CFD_65A4EE8690B614C0_6041_UN,8.447464,00000000000000000000001000000000000000100010000000001000000000100100000000010101101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,YNWAVXSIDDRUJI-VLIAUNLRSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC(CC)CCC3CCCCC3,9801413605B27DD7_400277A6D24782DE_6041_UN,7.795154,00000000000000000000000000000000000000000010000000000000000000000100000000000000100000010010000000100100110110010010101001000100110001110100001011010111000110101111010,OVNREOQOTRNYDW-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC3CC2(CCNCC2)C3)F,833489875E2623FE_5B2671575B19C087_7022_DP,7.4676476,00000000000100000000000000000000000000000010000000000000000000000010000000100000001001110011010000101000110100011001001001100000110101110110001011011111010110101111010,XAQDOJUSIMSOHP-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[CH]3C[C]4(C3)C[C](F)(F)C4)Cl,A5AE5F87046E4EEC_31953DA0790C0F58_6034_UN,8.00355,00000000000100000000000000000000000010000010000100000000000000000110000000010110010101011011000010001001011100001000000111100100100001110100001010001011010110101111010,WKQXCDUEVNEQSR-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CCC(CC)CC)C3=CCNCC3,03D89ACC41C9E815_F011CCB9ED7F58CB_6034_UN,8.652405,00000000000000000000000000000000000000000010000000100000000000100100000000011000001101110001000010111100110110010010101011100100110000100110001001011101010110101111010,ZPQNNFMKZPYCTD-UHFFFAOYSA-N
CN(CC1CC1)C2=NC(=CN=C2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,ECEF0E97D84404E5_A7C6601B3339D975_6041_UN,8.524271,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101110011010010101000100110010001101011100100010001110110001011011111010110101111010,JSOXQCRVMMRAGN-XLIONFOSSA-N
FC1=CC3=C(C(=C1)NCC2C(CC)CCCC2)[NH]C=C3,D3B53556E418A929_B6DC8011BB5B6E8E_6041_UN,8.793016,00000000000000000000000000000000000000000010000000000010000000000100000000000001001100010011000010001100010110000010101001000100110101110100001001010011010110101111010,VDYJAYHNGCPMBH-UHFFFAOYSA-N
N(C1C2CCC(CC1)O2)C(=O)C[N]3C=CC4=C3C=CC(=C4)F,EB1ACD471D0D99D5_FE31DE7875ECB8C1_6038_UN,7.730789,00000000000000000001000000000000000000000010000000000000010000000100000000010001000101010011100110101100110100110000011011100100110011100100001001011001111111110111110,ZJFOMIBIEMDXNU-UHFFFAOYSA-N
CCC1=NC(=C[N]1CC2CC2)NC4CCCN(CC3=C(C=CC=C3F)F)C4,403B06BCD8C09927_2C14B1BF60E00E2F_6041_UN,8.260142,00000000000000000000001000000000000000100010000000000000000000000100000000010101100101110011000010101000100110010010001011100100110001110110001011011011010110101111010,LQMVLOLCHHOFOR-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2CCC=CCCC2,3F71E21494EE24D8_1BAB6CC3C21D9257_6041_UN,8.301102,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100011010000111100000000001000001001000000110001010100011010011111010110101111010,PZHMAASJVBTKFB-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NCC3(C)CCC4(CC3)CC4)C,1251BD1DE846D782_011C5FDB5121CF42_6041_UN,7.8241286,00000000000000000000001000000000000000000000000000000100000000000110000000000000101100000011000010001100010000001001101001000100110101010100011011010111010110101111010,LVWODOWEPTUCFZ-UHFFFAOYSA-N
CC1=C[N](N=C1)CC2=C(C=C(C=C2)NCC3(C)C4CCC(C3)O4)F,BA5A924F74572D44_9866D9E00469A4A0_6041_UN,7.581667,00000000000000000000000000000000000000000010000000001000010000000110000000010000101100010011001011001000010110011001101011101100110011110110001011011111110111101111110,TYHXFCPDNHZQRC-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NC[C@]23CC[C@H]2CCCN3,6711E6BA35AE6640_BA6F19C0B5B76543_6041_DP,8.0825815,00000000000100000100100000000010000000000000000000000010000000000110000000100001001000100011010000101100110000011000001011000000110101010110011001011101010110101111010,MFBVIGBHEQVZKE-SJLPKXTDSA-N
CC1=C[N](N=C1)CC2=C(C=C(C=C2)NCC3CCCN(C)C3C4=CC=CS4)F,9A40D1F1983817D1_0D3D1B97CC379945_6041_UN,8.335965,00000000000000000000000000000000000010000010000000001000000000100100000000010000111101111011011010101000000110010001101011101100110001110110001011011111010110101111010,BKAFGKWVRKLPKD-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)SC=C2)NCC3CCCN(C)C3C4=CC=CS4,BEDA00BB6824B0EB_1C215A7D107D416A_6041_UN,8.502264,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,JGPUJLPBAVUJAG-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC4=CC(=C(C(=C4)F)N5CCOCC5)F,8683DF7363C45E8B_6857EA14C7F38A00_6041_DP,8.199598,00000000000000000001000000000000000000100010000000000000010000100100000000010101100101110011010110101000110101010000101011100100110111110110001011011011010011101111110,UXGJVLJJLIAGTL-SCAQPMJSSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCCCC3)C4=CC(=CC=C4)F,2878A688AF47FC4A_A795195CC559F57C_6041_UN,7.2744064,00000000000000000000000000000000000000000010000000001000000000100110000000010000101100010011011010001100010100001000001011101100110001110100001001011001010110101111010,QYSCBLLCDXOCCE-UHFFFAOYSA-N
C1(=C(C=CC2=C1OCO2)F)NC3=CC=C(C=C3)N4CC5CCC(C4)O5,F3CA14F5A2A8E383_850979B1CD12D7C9_7022_UN,8.047869,00000000000000000001000000001000000000000010000000000000010000100000000010010000000101110001000111101100010101000100001011110100110011110110001011111011110011110111110,IYFRIYNJBIAJBR-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=CC(=C(C=C3)Br)F,64F5C1E5C30CD57B_C2C3D7F36641895D_6038_UN,7.46072,00000000000000000000000000000000000000000010001000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,AOXTWRCKLNNYIC-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=CC(=C(C=C3)F)F,ABEE60637DF71EAA_8FDF137F1301CB21_6038_UN,7.4607134,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,PBSWJRGUFCMBFZ-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=CC(=C(C=C3)Br)Cl,D470A2FA7BAD7557_16EB06591BA1BC98_6038_UN,7.4607153,00000000000000000000000000000000000000000000001000000000000000000000000000000000001000010011100000011001110100110000011000000000110010100000000011010011011110100111110,DBYWOIVAYONGLE-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=CC(=C(C=C3)F)Br,A146E0EA93D9F23D_CB31A42BA77F4F48_6038_UN,7.4607077,00000000000000000000000000000000000000000010001000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,PYDLSXLJGGISPI-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=CC(=C(C=C3)F)Cl,B8C3A502580D996E_C2821D8778A82862_6038_UN,7.4607105,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011001110100110000011000000000110010100000000011010011011110100111110,ZFSPIFXRDGBXFA-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2N(C)CC3(CC2)CCC3,B14BDEF1368E9014_FCABBB824CBC1D69_6041_UN,7.8949933,00000000000100000100100000000010000000000000000000000000000000000110000000110001001001100011010000101000010010011001101011100000110001010110011011011111010110101111010,CPZRXORVDSSKGJ-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=CC(=C(C=C3)Br)Br,C8B82B9441B878D0_504E6C4551134AA7_6038_UN,7.460699,00000000000000000000000000000000000000000000001000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,XICKFRSPVPJQMR-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=CC(=C(C=C3)Cl)F,7E7C91B04B516A68_A78ECFF9CD604D5D_6038_UN,7.4606957,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011001110100110000011000000000110010100000000011010011011110100111110,AKGBWRZAMXCGCU-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=CC(=C(C=C3)Cl)Cl,BAA100910D4A6D7E_076C8B2721961CD5_6038_UN,7.4606996,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010011100000011001110100110000011000000000110010100000000011010011011110100111110,VFPSLCGFZDTCRW-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=CC(=C(C=C3)I)Br,25E6245CE48EAE14_D5FCD0B063BC04FC_6038_UN,7.4606876,00000000000000000000000000010000000000000000001000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,VWCOHMHXFSQTRQ-UHFFFAOYSA-N
N(C1C2C1C3CCC2C3)C(C5=C(C4=CC=CC(=C4[NH]5)CC)F)=O,9DF6085F8415EFE3_11D90B532CE7EAA9_6038_UN,7.9697256,00000000000000000001001000000000000000000010000000000010000000000100000000000001000100010011100110000100010100100010011001000100010101100100001011010011001110101111110,JBRZUIUYFXCFHC-UHFFFAOYSA-N
OC(CF)C1=CC(=CC=C1)NCC2N(C)CC3(CC2)CC3,DC60F83960F34C5C_0E498BF09DBA71BB_6041_UN,8.244996,00000000000000000000001000000000000000000010000000000000000000000010000000010001001001100011010000101000110010011001101001100000110111110111001001011011110111101111110,INBZLWFAIAHPGZ-UHFFFAOYSA-N
N4CC(C)(COCC3CC1(CC2(C1)OCCO2)CO3)C4,38BC3C10D9A452E9_AB2EDE82356B008B_6039_DP,7.7740183,00000000100100000000000000000000000000000000000000000000010000000010000010000000001100100010000011001000010011001001001011010010110010000110100000110001110101111100110,BVAADDLWASROMV-UHFFFAOYSA-N
C1(=CC=C(O1)C2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)Cl,7139864413C1B228_F9DB9D5CC059585A_7022_UN,8.24285,00000000000000000000001000000000000000000000000000000000010000100000000000010001100101110011110010001001100110110001111011100100000001110100001000011011110010101111110,DEGUGVBQJBBODG-QAPCUYQASA-N
C1(=CC=C(O1)C2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,A3BD6E713FD91FD0_E032D462E8001683_7022_UN,8.242849,00000000000000000000001000000000000000000010000000000000010000100000000000010001100101110011110010001000100110110001111011100100000001110100001000011011110010101111110,VLJQXECNWKKDSE-QAPCUYQASA-N
FC2=C1N=CC=CC1=CC=C2NCC3CCCN(C)C3C4=CC=CS4,306A2CDDF6B092F4_6532782D5A245813_6041_UN,8.496617,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,HIMCPANOTVGQBY-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC3CCN(C)C3C4=CC=CS4)F,43700DD86087D7F8_8CAACBB5BDEDE07C_6041_DP,7.925915,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101100110110010001101011100100110101110110001011011011010110101111010,QLCJLJAYSCFSEW-UHFFFAOYSA-N
C[N]1C=CC2=C1C(=CC=C2)NC3=C(C=C(C=C3Cl)C56CC4CC(CC(C4)C5)C6)Cl,91A04FDFC09FFCAB_FBCE8CE746FFB9D8_7022_UN,7.878845,00000000000000000000000000000000000000000000000000000000000000100110000000010001000101010000010010000101010100001000000001100100100001110100001011001011000010101111010,ARAYLQGLNFCOME-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC2CCCC2N3CCOCC3,6E5D11FD29479730_1B86A706959DA891_7022_UN,8.308554,00000000000000000000000000000000000000000000000000000000010000100000000000010000101001110011000110101001000111010000001011100000110011110110001011011011010111101111110,SJRJYBHYCQCLNG-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1C[C@H](C)NC2=NC=C(C=C2)Br)C=CC(=C3)Cl)C4,E02FAEC6D6601B7D_293A486792645253_6034_UN,8.631477,00000000000000000000000000000000000000100000001000000000000000000100000000010101001101010010000010101101110110010011001011100100110101110110001011011101010110101111010,OOOUCLVRBBCALN-MBIQTGHCSA-N
CC1=C(C=CC=C1Br)NCC2CCCC2N3CCOCC3,B127E120308F53FC_C785F51A3CD33CA3_7022_UN,8.308525,00000000000000000000000000000000000000000000001000000000010000100000000000010000101001110011000110101000000111010000001011100000110011110110001011011011010111101111110,YHOVMWCPDWEQFJ-UHFFFAOYSA-N
CC1=C(C=CC=C1F)NCC2CCCC2N3CCOCC3,2491784216F77DB2_CA2DACAD834156B3_6041_UN,8.308539,00000000000000000000000000000000000000000010000000000000010000100000000000010000101001110011000110101000000111010000001011100000110011110110001011011011010111101111110,NMRSJXWFLGXLBV-UHFFFAOYSA-N
CC1=C(C4=C(N1CC2=C(ON=C2Br)C3CC3)C=CC=C4)C5=CCNCC5,B46805A9C6799655_08A34F60CEB8EAE6_6034_UN,8.690273,00000000000000000000001000000000000000000000001000100000010000100100000100011000101101110001001011111110110110010000101011101100110000100110001011011011110110101111110,CALOPHPMJCGEAU-UHFFFAOYSA-N
N1CC2CCCC1C2C=CC4=CC3=C(C=CC(=C3)C)N=C4Cl,3A4204558FE32A5F_E85A2B0659B5DE5A_7019_DP,8.064051,00000000000000000001000000000000000000000000000000000000000000000100000000000000001100010011000010111101110100010000001011000100110000100100001011010011010010101111010,WSSDWUNTURDRHA-UHFFFAOYSA-N
O[C@@H](CCl)C1=CC(=CC=C1)NCC2CC3CCC2N(C)C3,2C9554F69BA68A85_E25853D9DABC0D0D_6041_UN,8.254386,00000000000000000000000000000000000000000000000000000000000000000000000000010000101001100011010000101001110010010001101001100000110111110111001001011001110111101111110,YMRLNXYVWUYDPH-FEYJPFALSA-N
O[C@@H](CF)C1=CC(=CC=C1)NCC2CC3CCC2N(C)C3,8D5B605EA0853523_69B6E54956461D80_6041_UN,8.254382,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001100011010000101000110010010001101001100000110111110111001001011001110111101111110,NROYNTXFLPLCNY-FEYJPFALSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NCC3=C2CCCC2=CN=C3,B29764F8594C8CC3_990B04C1EDB1ABDA_6041_UN,8.018955,00000000000000000000100000000010000000000000000000000000000000000100000000100000101000100011010010101100010000001001001001000100110001010110011011011111010110101111010,XUVPJVOQVDDAHQ-UHFFFAOYSA-N
CCC4(COC1=CC(=CC=C1)C3=NC2=C(C=CC(=C2)F)[NH]3)COC(CI)C4,7FAF7FCDC052C2E5_EDF955FF7A224D67_6035_UN,8.316106,00000000000000000000000000010000000000100010000000000000010000100110000000000101000100010100000010000100010101001110100011000111110010100110001101000001110111011111110,XRBPZNSJUOFPSW-UHFFFAOYSA-N
C[N]1N=C(N=C1NCC2(CCCCC2)C3=CC=C(C=C3)F)C4CCOCC4,73A952D3A7699CC2_0BE9B66294B06CB0_6041_UN,8.010618,00000000000000000000000001000000000000100010000000001000010000100110000000010101101100110011011010101000001111001000001011101100110011110110001011011011010111101111110,MAXKHRNIUWQTTP-UHFFFAOYSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC2=C([N](N=C2C)C3=CC=C(C=C3)Cl)C)C4,B8104703B6902E14_AE763E0AFD418536_7019_DP,8.886205,00000000000000000000000000000000000000000000000000001000000000100100000000010000100100010010001010010001110100010000001011101100110001110100001011011111000010101111010,STUIYWWCIMJHRV-OGWOLHLISA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC2=C([N](N=C2C)C3=CC=C(C=C3)F)C)C4,7C5DF0F72B8F9D9F_86AC792EFDA08CE6_7019_DP,8.886211,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010010001010010000110100010000001011101100110001110100001011011111000010101111010,YDEQWCWJRNCPDH-OGWOLHLISA-N
ClC1=C(C2=C(C=C1)C=CC=N2)C=CC3=C(C=N[N]3C)C4CCC4,C253FB4B2185E673_1D5A0EEB2FBED472_7019_UN,8.326427,00000000000100000000000000000000000000000000000000001000000000100100000000010000100100010000011010110101010100000000001011101100000000100100001011011010000010101111010,TTWWLRRHFJWELS-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)C=CC3=C(C=N[N]3C)C4CCC4,C926D06047787AF3_43B44B50EAF9DE83_7019_UN,8.32642,00000000000100000000000000000000000000000010000000001000000000100100000000010000100100010000011010110100010100000000001011101100000000100100001011011010000010101111010,ZJNFQCBAJZPSNL-UHFFFAOYSA-N
SC2=NC1=C(C=C(C=C1)Cl)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,3FC1FE190883E2DD_11F19071A67A87D2_6034_UN,7.697977,00000000000100000000000000000000000000000000000100000000000100001110000000110101010101011010000010001101011110001000101011100100110000100100001011011110010110101111010,GZTDGMSPYCTMLU-KUNJKIHDSA-N
CC1=C(C(=CC=C1)Cl)NCC2(CCCOC2)N3CCOCC3,6BC72185FD3440DB_B5FFE2E969A1C414_7022_UN,7.734094,00000000000000000000000000000000000000000000000000000000010000100010000000010001001001110011000101101001000111011000001011100000110011110110001011011011010111111111110,JKZZPLXAZMJSMV-UHFFFAOYSA-N
CC1=C(C(=CC=C1)F)NCC2(CCCOC2)N3CCOCC3,3E969CE8C6E27436_0AF1281BA0799EC4_6041_UN,7.7340817,00000000000000000000000000000000000000000010000000000000010000100010000000010001001001110011000101101000000111011000001011100000110011110110001011011011010111111111110,QUJNZVKKZBDYSI-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NCC3(CCN(C)CC3)N4CCCCC4,28A39BD6761A1943_7328691EE76DECE5_6041_UN,7.2979383,00000000000000000000000000000000000000000010000000000000010000100010000010010001101101110011010010101000000101011001101011110000110011110110001011011011010111111111110,QSEAYQZVGMAAPB-UHFFFAOYSA-N
O(CC2CCOC1(CCOCC1)C2)CCN3CCOC(C)C3,A14CCC1AEEDDB63B_75183A267D55AA31_6039_UN,7.6205053,00000000000000000000000000000000000000000000000000000000010000000010000000010000000001100100000100101000010011011001101011100010110010000110100001111000110101111101110,IRWJFSPDMQOSBT-UHFFFAOYSA-N
C2(=C1C=CC=CC1=CC=C2Cl)NCC3N(C)CC4(CC3)CC4,048AD69A1F30FCAC_711521AB744DA9A9_7022_UN,7.8939605,00000000000000000000001000000000000000000000000000000000000000000010000000010001001001110011010000101101010110011001101001100100110001110110001011011011010110101111010,RXPRQEYPZJSMPT-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)N(C=N2)CC(C)(N3CCNCC3)C4=CC=C(C=C4)Br)Br,96B96528813DBAC1_9F74ED84F1C678AA_6034_UN,7.9776096,00000000000000000000000000000000000000000000001000000000000000000110000000010101001101110001000010101100110110011001101011100100110000100110001011011111010110101111010,MCEFQADNCBYSJM-UHFFFAOYSA-N
C[N]1N=CC2=C1C=C(C=N2)NCC3(CCOCC3)C4=CC=C(C=C4)F,49421D3829492B0F_F78B7443F0EAAB25_6041_UN,7.3231525,00000000000000000000000000000000000000000010000000001000010000100110000000010001101100110011011010101100010101001000001011101100110011110110001001011001010111101111110,XUYYYEPQJNHXQP-UHFFFAOYSA-N
CN1CCNCC1C2=NC=CN2CC4(CC3CO3)CCCC4,6A4F5392904F0B12_8956E6BDBC9556CD_6034_UN,7.587293,00000000000000001000001000000000000000100000000000000000010000100110000000010101101101100001010010101000100001011001101011100000110010000110001010011011110111101111110,RXBSLTQMTNYDKO-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NCC3CCN(C)C3C4=CC=CS4,11359928951E7585_48C8FB447B151115_6041_UN,7.793913,00000000000000000000000000000000000010000010000000000000010000100000000010010000111101111011010010001000000111010001101011110100110011110110001010011011010111111111110,NPJPLLCNVRNFNE-UHFFFAOYSA-N
FC1=CC(=CC(=C1)F)NCCN(C)CC2COCCC2,42172B44458E7CDB_26E6B015DFD215E3_6041_UN,7.2009273,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001001011001010111101111110,ZMPWIPJTBOEZAV-UHFFFAOYSA-N
N4CCC(C)(COCC3CC1(CC2(C1)OCCO2)CO3)CC4,70D0A2043C156136_D52155FD62E511EF_6039_DP,7.7258224,00000000000100000000000000000000000000000000000000000000010000000010000010000000001100100001000010101000110011011001101011010010110010000110100000110001110101111101110,LBTYFRPNNOXQKG-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NCC2CCCC3=C2N=CC=C3,AA002FD38A628D07_70CFA4E966D340A1_7022_UN,7.7635236,00000000000000000000100000000010000000000000000000000000000000000100000000100000101000100011010000101100010000001000001001000100110001010100011011011101010110101111010,CONGHFYSMDHUCP-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3(CCC3)C4CCC4,46C69ED6A07AD35B_4F10F3BCFEE820CD_6041_UN,8.424296,00000000000100000000000000000000000000000010000000001000000000100110000000010000100100010011011010000100110100011000001011101100110001110100001000011001000010101111010,VHGYIYVJKIIXSE-UHFFFAOYSA-N
CN5CCCN(CC1=C(C=C(C=C1)NC2C4(CC3=C2C=CC=C3)CCOCC4)F)CC5,A96047EE205783FD_7756779CA1D5698D_6041_UN,7.2781878,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110011010010101100010111011001101011100100110011110110001011011011010111101111110,OVNWLFJUKHWODB-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCCC3CCC(C)(C)CO3,28045FC0B1A38807_B7577B43A1D185FF_6041_UN,7.8613634,00000000000000000000000000000000000000000010000000000000010000000110000000100001001000010001000001101100110111011001101011000100110011110110011011010111110111101111110,XZWIHHMUDHEHDC-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCCC34CCOCC4,2BBB6B6E350AC2BF_D0804AC9DC40ACCD_6041_UN,7.509069,00000000000000000000000000000000000000000010000000001000010000000110000000010000101100110011011010101100010101001000001011101100110011110110001001011001010111101111110,MYGQSMAKEYJTOS-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC(C3CCCO3)C4=CC=C(C=C4)F,80C490F91225519D_D4DADA6C9BB44980_6041_DP,7.62574,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101010011010110101000100111010000001011100100110111110110001011011011110011101111110,KNKCBTZXBOQGSH-UHFFFAOYSA-N
O=[N](=O)C1=C(N=C(C=C1)NC2=C3C(=CC=C2)CCOC3)C4=CC=C(C=C4)F,00332607519DC9F6_F8B8AD866147D316_6041_UN,7.9025865,00000000000000000000000010000000000000100010000001000000110000110100001100000101000000110011001001100110010101000000001111101100111011110110001011111011010011110111110,JLZLMHLJQPMFSK-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC4CCOC(C4)C5=CC(=CC=C5)F,2F8C3B82D86EB53D_0207DC03FC774B0C_6041_DP,8.197618,00000000000000000000001000000000000000100010000000000000010000100100000000000101101101110011010011101000110111010000001011100100110111110110001001011001110011101111110,UMONOMFSYKMSPE-WHWMZARZSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@@H]3C[C@H](F)CN3CC4=CC=CS4,B480C2012489986D_3F8BBD81A78C5F18_6041_UN,8.356897,00000000000000000000000000000000000010100010000000000000000000000100000000010101011101111011000010101100010110010000000011100100110001110110001011001111010110101111010,CFLJVOQXVROGEG-HOTGVXAUSA-N
N(CC1C2CCC(C1)C=C2)C(C3NC4=C(C3)C=CC(=C4)F)=O,A003A76207F0E6FA_D3660EC4C0C5B21C_6038_DP,7.8723454,00000000000000000000000000000000000000000010000000000010000000000000000000000001001100010011100110011100110100110000011001000000110100110100001011010001011110100111110,RSGPGDTYVXNCTB-UHFFFAOYSA-N
CN4CCC1=C(C=C(N=N1)N[C@@H]2CCN(C)[C@H]2C3=CC(=C(C=C3)F)F)C4,C35349F3482D0C0D_D8864F36FBDD7963_6041_UN,8.169323,00000000000000000000000000000000000000100010000000001000000000100100000000010101100101110011011010101100110110010001101011101100110001110110001011011111010010101111010,OFEJVXSUHLAMLP-MJGOQNOKSA-N
CN1CCCCC1COCCC3COC2(CCCC2)O3,3CB4129D98C0165F_9D97BF32DA1A1FAD_6039_UN,6.8776703,00000000000000000000000000000000000000000000000000000000010000000000000010010000000101100100010110101000010011011001101011110010110010000110000000111010110111111101110,UNSAJMJOICKZTI-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OCC2=CN=CC(=C2)F)C3,156A9613A13A9D05_D4728F2640B3A7A4_6039_UN,7.9660454,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010011101000010101000001001001100011110000100110001101011110110101101111110,WPTXDIQAZAQZFR-LQKXBSAESA-N
FC1=C(C=CC2=C1CCC2)NC(CC)CC3=C[N](C)C4=C3C=CC=C4,689EB46518658EDC_E71F91D2B67EB555_6041_UN,7.766705,00000000000000000000000000000000000000000010000000000000000000000100000000010000000101010001010010000100110110010010101001100100010001110100001011011111000110101111010,HLIDRKSPMWSJIT-UHFFFAOYSA-N
C4CC1=C(C3=C(N1CC2(CN(C)C)CCCC2)C=CC=C3)CN4,A3625D462757392E_02701C40AC31FD5A_6034_UN,7.3615074,00000000000000000000000000000000000000000000000000000000000000000110000000110000101101100001010010101100110010011001001011100100110000000110001011011101010110101111010,NGKGKOWFEVGIRQ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3(CCCNC3)C,CC9DE14761BDC829_A9AAE3B8B92C7D40_6041_DP,7.8747163,00000000000000000000000000000000000000100010000000000100000000000110000000000100101000110011000000101100110110011001101011000100110101110110011011010111010110101111010,IQIGWKOKZJXMFV-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(CCC2)C3CC3)Cl)C4CC4,25DCE6F1AF0C15B5_6F157F0BD2934959_7022_UN,7.9123926,00000000000100000000001000000000000000000000000000000000000000100010000000000000001000010011000000001001000110001000001000000000110001110000000010010011010110101111010,PJJAKXYBZNTCSL-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NC3CCC2=C(C=CC=C2)[N]4C=CN=C34,EF4617566F54BB6E_6ADCC5C3B6E8E3F0_6041_UN,8.466146,00000000000000000001100000000010000010100000000000000000000000000100000000100101010101101010010010000100110000011000001011100100000001010100011010011111000010101111010,ZVUVTEVYYTYPHV-UHFFFAOYSA-N
FC2=C1OC=CC1=C(C=C2)NCCC4CCN(C3CCN(C)CC3)CC4,065B392CD184BC7B_7C0F1691C715C608_6041_UN,7.637681,00000000000000000000000000000000000000000010000000000000010000100000000000010000101101110001010011101100110100010001101011100100110001110110001001011001110110101111110,IERNIMLTAZRZJD-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[CH]3C[C]2(C[C](C)(C2)C)C3)Cl)C4CC4,160AC66CA98606E2_EB503D24C4B469A8_7022_UN,7.799179,00000000000100000000001000000000000000000000000000000000000000100010000000100000000000010001000000000001110110011001000000000000100001110000010010010111000010101111010,ZSKAEYQFELBSDY-UHFFFAOYSA-N
O(CC1CC2(CO1)CCOCC2)CCC3CCN(C)CC3,E487FA93742E0284_B6E129D491C7ED6D_6039_UN,7.352451,00000000000000000000000000000000000000000000000000000000010000000010000010010000000101100000010010101000010001011001101011100010110010000110000001111000110101111101110,UHHJCMABNDFOQG-UHFFFAOYSA-N
CCC(NC(=O)CC1CC2CC1C3CC23)C4=C(C=C(C=C4)F)F,AB6413C521015D96_348A4E952A772CAF_6038_UN,8.30269,00000000000000000001001000000000000000000010000000000000000000000000000000000000000000010001100010000000110100110010010000000000110010100000000011000011001110101111110,HRQMKDBILGQATB-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC3CC(C2=CC=N[N]2C)OCC3)F,076978C422ED4688_1E771B2C5B0859B2_6041_UN,7.863158,00000000000000000000000000000000000000000010000000001000010000100100000000110000100101110011011111101000100111010001001011101100110011110110011011011111110111101111110,SVAJQYKZLXTGSI-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CC2C(CNCC2)C3=CC=CC=C3)C(=CC(=C4)F)F)C5,A6938FBA519DBA47_427F7392093C64C8_6034_UN,8.028651,00000000000000000000000000000000000000000010000000000000000000100110000000110000001101110001000010101100110100011001101011100100110000100110001011011111010110101111010,PTDPDKBNXNBJRB-UHFFFAOYSA-N
N(CCC1C3CC2CC(CC1C2)C3)[S](C5=CC=C4[NH]C=CC4=C5F)(=O)=O,8D2DC107F13F8E55_1DAF20B9D4386FAB_6029_UN,7.717848,00000000000000000000000000000000110000000010000000010001001111001101010001000000011100011000001010001110111100011000011001001100111100101100001011011011010110110111110,OAXLHLGWGVXKDW-UHFFFAOYSA-N
FC1=C(C=CC=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,2E290B5FB59A596C_F1326EECC043AAAF_6041_UN,7.998308,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,GFLKVQDEFCIPRO-KUHUBIRLSA-N
N1CCCC2=C1C=C(C(=C2)NC5=CC3=C([N](C)C(=N3)C4CC4)C=C5)F,29F1CFD3B6D67E29_2528A1F2B0D5054C_6041_DP,7.6007996,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101100110110010000001011100100100101110100001011011011010010101111010,XOOMHEHAFXBCND-UHFFFAOYSA-N
CN(C1CCCNCC1)C2=NC=C(N=C2)N[C@H]3[C@@H](C3)C4=CC(=C(C=C4)F)F,F286CD8C396CCFC5_5EDF09F8E8C05D29_6041_DP,8.458632,00000000000000000001001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010000101011100100110101110110001011011011010010101111010,LWYNVNWHZZYYSM-JGNLYWJMSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2C4=C(OC3(C2)CCC3)C=CC=C4,B6E1AAF7F314B4AB_24B821F9F38C7DCE_6041_UN,7.9458084,00000000000100000000100000000010000000000000000000000000010000000110000000100001000000100001010001100100110000011100001011000100110011010100011011011111100011101111110,JKTCSLIKPTXVPC-UHFFFAOYSA-N
CC2=C1N=C(SC1=CC=C2F)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,FE6DEBDC51FA9837_B47201875E62263A_6041_UN,8.30084,00000000000000000000001000000000000010000010000100001000000000100100000000010101111101011011011010101100011100010000001011101100110001110110001011011111010110101111010,FJXGJTBJPPDNJT-VLIAUNLRSA-N
FC1=CC2=C(C=C1)C=C(N=C2)NC3CCN(C)C34CCCNC4,5B9C1BDDD34B27F7_46E154DB44C7E3A2_6041_DP,8.318502,00000000000000000000000000000000000000100010000000000100000000000110000000010101101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,TVMGKUUVMKMPMN-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC(N3CCOCC3)C4=C(C=CC=C4)F,E7CDB3153EE7CE6C_6A1DCD1AE16EDE67_6041_UN,7.8665657,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101110001010110101000000111010001101011100100110011110110001011011011010111101111110,LDWUZLXLESWSDP-BGERDNNASA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3(C2=C(C)C=CC=C2)CCOCC3)F)CC4,6C88B9E24984D2E8_7325D81A27C855CA_6041_UN,7.8915453,00000000000000000001000000000000000000000010000000000000010000100010000000010001101001110011010000101000000111011001101011100100110011110110001011011111010111101111110,BVWGVCROFMDCAO-UHFFFAOYSA-N
C2(=CC1=C(C(=CC=C1)Cl)S2)NCC(N3CCCC(CC)C3)(C)C,B8AE6320EA6694F2_8E1569EDA9915320_7022_UN,7.969758,00000000000000000000000000000000000010000000000100000000000000000010000000110001011101111001000010101101010110011011101011100100110001110110011001011101010110101111010,BMESXDOGZSYHDF-UHFFFAOYSA-N
C2(=CC1=C(C(=CC=C1)F)S2)NCC(N3CCCC(CC)C3)(C)C,2C03389D27C84566_69090C1F560961D0_7022_UN,7.969755,00000000000000000000000000000000000010000010000100000000000000000010000000110001011101111001000010101100010110011011101011100100110001110110011001011101010110101111010,XUUPRSDKWHDERP-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2C[C@@H]3CCCO[C@H]3C4=NC=C[N]4C)C5CCNCC5)F,6657CE026788FD1E_9676AC43382028E4_6034_UN,8.606291,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101110001010111101000100101010000001011100100110010100110001011011011110111101111110,CBMCSBSQQITYML-PGRDOPGGSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(C)CCN3CC4=CC=CC=C4)C5CCNCC5,43033E5C3BAFB0CD_278E1C9044B1FBD9_6034_UN,8.536644,00000000100100000000000000000000000000000010000000000000000000100110000000010001001101110001000010101100110100011001101011100100110000100110001001011011010110101111010,OLSYWCZKQAQVPE-UHFFFAOYSA-N
CC1=C[N](C)N=C1NC[C@H]2C3CCC([C@@H]2C(F)(F)F)CC3,E3BAB1CEBD6E4AC6_2E1EBCFF2850750D_7022_UN,8.427988,00000000000000000000000000000000000000100010000000001000000000000100000000010101101100000001011010001000011110001000001011101000110001110100001011011111010110101111010,RWLDONCZJRZSHK-TYUFSLCMSA-N
CC1=C(C=CC(=C1)C2=NC=CN2CC4[C@@H]3C[C@@H](C3(C)C)CC4)F,F6B055DEAADA8DD1_889EFB163921EDE7_6034_UN,8.025973,00000000000100000000000000000000000000100010000000000000000000100110000000110101000101010000000010001000010110001000101011100100110000100100011011011110010110101111010,RYFQXVOTXADOCA-BSOSBYQFSA-N
C1(=CC2=C(C=C1)C3CCC2O3)N[C@@H]4CCN(CC)[C@H]4C5=CC(=C(C(=C5)F)F)F,26ACACB280494788_6B3EDD4EA9A59AC0_6041_UN,8.563055,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011000010001100110110010010101011100100110011110110001011011011110111101111110,VGKHUYJIJYTXCH-LCLFBYRMSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CSCCS2)F)CC3,F52DAE75530368E4_42F3318F12F668BE_6041_UN,7.633064,00000000000000000001000000000000000010000010000000000000000000000000000000010001111001111011010000101000000110010001101011100000110001110110001011011011010110101111010,LTIRXZPFBJYNSO-UHFFFAOYSA-N
N(CC1CC2CCC(C1)S2)C(=O)C3=C[NH]C4=C3C=CC(=C4)F,938AC6E9BF2CDF68_32BA5DD212825895_6038_UN,7.518852,00000000000000000001000000000000000010000010000000000100000000000100000000000000111100011010100011101100010100100000011011000100110100100100001001010001011110100111110,KYDZMCFAJLBXEZ-UHFFFAOYSA-N
N(C1=CC(=C(C=C1)I)Br)C(C34CC(C2CNC2)(C3)C4)=O,DCA392327C8EE74D_7D8F862915C242E4_6038_DP,7.671168,00000000100100000000000000010000000000000000001000000000000000100010000000000000001000110011100000001000010100101000010001000000010101110110001010000011011010100111110,IBYKSXNRDGRTPJ-UHFFFAOYSA-N
N(C1=CC(=C(C=C1)Br)Cl)C(C34CC(C2CNC2)(C3)C4)=O,0DB4391D9E96B47A_549B0C9E4A7970B4_6038_DP,7.6711683,00000000100100000000000000000000000000000000001000000000000000100010000000000000001000110011100000001001010100101000010001000000010101110110001010000011011010100111110,YBEAYBXXYOKMQN-UHFFFAOYSA-N
N(C1=CC(=C(C=C1)I)Cl)C(C34CC(C2CNC2)(C3)C4)=O,6F0BDF07632C8946_1BA3FDFE61F4E90B_6038_DP,7.6711645,00000000100100000000000000010000000000000000000000000000000000100010000000000000001000110011100000001001010100101000010001000000010101110110001010000011011010100111110,BVGVBVZUGMUKNE-UHFFFAOYSA-N
N(C1=CC(=C(C=C1)F)F)C(C34CC(C2CNC2)(C3)C4)=O,3D07EDF94A0A9F47_F7BA2B7283971463_6038_DP,7.6711698,00000000100100000000000000000000000000000010000000000000000000100010000000000000001000110011100000001000010100101000010001000000010101110110001010000011011010100111110,BNJPJHLVLWGJIU-UHFFFAOYSA-N
N(C1=CC(=C(C=C1)Cl)Br)C(C34CC(C2CNC2)(C3)C4)=O,8A1A604FDBD770A4_C2389EF08E574D47_6038_DP,7.6711774,00000000100100000000000000000000000000000000001000000000000000100010000000000000001000110011100000001001010100101000010001000000010101110110001010000011011010100111110,PWSCVSLGKQJFSC-UHFFFAOYSA-N
N(C1=CC(=C(C=C1)F)Br)C(C34CC(C2CNC2)(C3)C4)=O,7AF4DF0CD9B45E85_4521AB987B7C8A5E_6038_DP,7.6711683,00000000100100000000000000000000000000000010001000000000000000100010000000000000001000110011100000001000010100101000010001000000010101110110001010000011011010100111110,OBYQOBAYOOIMEA-UHFFFAOYSA-N
N(C1=CC(=C(C=C1)F)Cl)C(C34CC(C2CNC2)(C3)C4)=O,230363A38D6077FA_A625EA0D726844D6_6038_DP,7.6711664,00000000100100000000000000000000000000000010000000000000000000100010000000000000001000110011100000001001010100101000010001000000010101110110001010000011011010100111110,YSOUPNFGDKZHPG-UHFFFAOYSA-N
N(C1=CC(=C(C=C1)I)F)C(C34CC(C2CNC2)(C3)C4)=O,1C025F2E607DAC26_DE738D97F6B1982E_6038_DP,7.6711636,00000000100100000000000000010000000000000010000000000000000000100010000000000000001000110011100000001000010100101000010001000000010101110110001010000011011010100111110,VQSQYPNJHNXVDZ-UHFFFAOYSA-N
N(C1=CC(=C(C=C1)Br)F)C(C34CC(C2CNC2)(C3)C4)=O,18BFDF1F34CA2D9F_CCF48702F26A17CA_6038_DP,7.6711645,00000000100100000000000000000000000000000010001000000000000000100010000000000000001000110011100000001000010100101000010001000000010101110110001010000011011010100111110,NYINMNMKEOORHY-UHFFFAOYSA-N
N(C1=CC(=C(C=C1)Br)Br)C(C34CC(C2CNC2)(C3)C4)=O,BE204C4C15ECCDEA_A80B7B0A061D7380_6038_DP,7.6711626,00000000100100000000000000000000000000000000001000000000000000100010000000000000001000110011100000001000010100101000010001000000010101110110001010000011011010100111110,XYMORNRZZPTHBY-UHFFFAOYSA-N
N(C1=CC(=C(C=C1)Cl)F)C(C34CC(C2CNC2)(C3)C4)=O,250FA6E8E0303C4D_737E7D8E0AE6253C_6038_DP,7.671154,00000000100100000000000000000000000000000010000000000000000000100010000000000000001000110011100000001001010100101000010001000000010101110110001010000011011010100111110,WNUXDXZMPHYOBT-UHFFFAOYSA-N
N(C1=CC(=C(C=C1)Cl)Cl)C(C34CC(C2CNC2)(C3)C4)=O,0AE762BCF0A3732E_6B993729BB9CE0C5_6038_DP,7.67116,00000000100100000000000000000000000000000000000000000000000000100010000000000000001000110011100000001001010100101000010001000000010101110110001010000011011010100111110,MVAJBGSEFADMGD-UHFFFAOYSA-N
N(C1=CC(=C(C=C1)Cl)I)C(C34CC(C2CNC2)(C3)C4)=O,2EFE836582C8364E_E84B9E7A826B86D7_6038_DP,7.6711583,00000000100100000000000000010000000000000000000000000000000000100010000000000000001000110011100000001001010100101000010001000000010101110110001010000011011010100111110,PDQWKQFPIAAFTA-UHFFFAOYSA-N
N(C1=CC(=C(C=C1)Br)I)C(C34CC(C2CNC2)(C3)C4)=O,041DCC1030898B74_64571C396BAE9AB1_6038_DP,7.6711526,00000000100100000000000000010000000000000000001000000000000000100010000000000000001000110011100000001000010100101000010001000000010101110110001010000011011010100111110,CFSYHGDAYLVFBH-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CCC3=CC(=CC=C3)F,B5CE12CF1BBCF84E_BB6BE595AD7BE0A5_6038_UN,7.6884146,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001000110100110000011000000000110010100000000001010001011110100111110,SJFMKYOCCUIADE-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC(C)C3CCCC3,F214FCFAB38E404C_2FFCCDC473225868_6041_UN,7.9166527,00000000000000000000000000000000000000100010000000000000000000000100000000000100001000010001000010101100010110000001101001000100110001110100011011010111010110101111010,UWESMYNHCCPJJE-UHFFFAOYSA-N
C[N]1N=CC(=C1)C2=CC(=CC=C2)NC3C4CC5CC3CC(C4)(F)C5,BBAAFF9D6FFC66CF_84642028C437994B_6041_UN,7.5048614,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010010011010000100010100001000000011101100100001110100001001001001000010101111010,CXNYGIKNSWBVAE-UHFFFAOYSA-N
C2(=CC1=C(C(=CC=C1)F)O2)NCC3N(C)CC4(CC3)CC4,97E15134890DFC5E_74CC4E77F4F72766_7022_UN,7.773426,00000000000000000000001000000000000000000010000000000000010000000010000000010001001101110011110010101100010110111001111011100100110001110110001001011011110110101111110,VWHJXAPYIGBCTG-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC3C(C)(C)C4CCC3C4,5CA899623136A569_C52D5E532E8C5965_7022_UN,8.230369,00000000000000000000000000000000000000000010000000001000000000000110000000110000101100010001001010001000010110011000101011101100110001110110001011011111010110101111010,CURLWJOHLVSBST-UHFFFAOYSA-N
N1CC2CCC1CN2C3=NC(=CN=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,2194526371F57238_617C23E27F6D7609_6041_DP,7.8593516,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000110110010001101011100100110101110110001001011011010010101111010,ANBVESXQEVERHG-PKZBPHAMSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CC4(CN3)CC4,0E69CBBB756A8C25_3B5CC11CE8A46209_6041_DP,7.536533,00000000000000000000001000000000000000100000000000000010000000000110000000000101001100000011000010101100110010011000000011000100110101010110011011010111010110101111010,DVKWXTPFHDQJPD-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CC3=C[NH]C4=C3C=C(C=C4)F,32BFA012EA996B0E_36D2F92253D0B7F2_6038_UN,7.83381,00000000000000000001000000000000000000000010000000000000000000000100000000000000000100010011100010000100110100110000011001000100110111100100001001010001001110100111110,MENQWZKPWSVQOV-UHFFFAOYSA-N
CC1=C(C3=C(C=C1)N=C2CCCCC2=C3NC[C@H]4[C@@H](OCC4)C5=CC=C(C=C5)F)F,962088EF8BE93C1B_070AB41A515814EA_6041_UN,7.30248,00000000000000000000000000000000000000000010000000000000010000100100000000000000101100010011000011101100010101010000001011000100110011110110001011010011110111101111110,UZJZKZMQKSEQFL-GKVSMKOHSA-N
FC1=CC4=C(C(=C1)NC3C[C@H]2CCC[C@H](N2C)C3)C=CN=C4,3052A489789F16A1_85BFE00346280E34_6041_UN,8.323315,00000000000000000000000000000000000000000010000000000000000000000100000000010000100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,FCLPPKAXGCLGIP-MQVJKMGUSA-N
FC1=C(C(=CC=C1)CC#N)N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,D41EC2C16FAA4F66_E03025800636077F_6041_DP,7.3202553,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,WIHIMSNBJPMAQN-SJLPKXTDSA-N
C1CC(CN1)C3=CC2=C(C=CC=C2)N3C[C@H]4[C@@H](CNC4)C5=CC(=CC=C5)F,D4748A9A2CAB26FB_FE203144B7308527_6034_UN,8.860725,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010001100110100010000001011100100110100100110001011011011010110100111010,RTMXMFILMHSSPY-ZDZADGERSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2CC3C[C@H](C)O[C@@H](C3)C)C4CCNCC4)F,F4167860A95ADFB7_3D293FA4D62FE5AF_6034_UN,8.829449,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101110001000010101000100110010001001011100100110010100110001011011111110111101111110,FIYYMVZNYHOKFT-XYPWUTKMSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)C[C@]34[C@](C)(C3)CNC4)Cl,FB4EC7543C22DB6A_B39511D61790FB53_6034_UN,8.015743,00000000000000000000001000000000000010000000000100000000000000000110000000010110111101111011000010101001011110001001100111100100110101110110001011001111010110101111010,VJTVWYYWKZQBFS-MSOLQXFVSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F,C13A5FBE936D043F_0B3C3413445CE3D2_6041_DP,8.162826,00000000000000000000000000000000000000100010000000000010000000100100000000010101101101110011010010101000100110010001101011100100110101110110001011011011010010101111010,AIHIVKAIMDSGKE-YSGRDPCXSA-N
COC1=CC=C(C=C1)NC24CC3CC(C2)CC(C3(F)F)C4,7155A1F8DE39C84B_64254B738F04D7AC_7022_UN,7.871749,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010001010000000100110100011100000000000011100001110000000101000001100011101111110,YPQMYOYDFSIRMO-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)N[C@@H]2C3=C(CCC2)C(=CC(=C3)F)F)[C@H]4C[C@@H]5CC[C@H](C4)N5,D98430E0ED377F84_85654AD00DD056D9_6041_DP,8.030304,00000000000000000001000000000000000000100010000000001000000000000100000000000101100101110011011010101100110100010001101011101100110101110100001011011001010110101111010,AQJNQFINNJTDNK-UTAOTPEMSA-N
CC(C=CC1=C[N](C)N=C1C2=C(C=CC(=C2)F)F)C3CCCCC3,23D38DA1A0506444_19B722DFE811FBD2_7019_UN,8.096803,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010000000110000000101011101100110000100100001011011110000010101111010,UQAZLVUDNWMAGN-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C[N]2C=C(C=N2)NC[CH]4C[C]3(C[C](C)(C3)C)C4)F,573A7768DFD3BA84_10A67732C9FB7406_6041_UN,8.503939,00000000000100000000000000000000000000000010000000001000000000000110000000110001101100010011001010001000010110011001000011101100100001110110001010001111010110101111010,ZFEHTKGLBHRCMZ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2(CC2)C3COCC3)F)CC4,EE6FDC899470D796_CD83009E8CFAB345_6041_UN,7.4526267,00000000000000000001001000000000000000000010000000000000010000100010000000010001100101110011010011001000100111011001101011100000110011110110001010011011010111101111110,KOOCQPDCVMDLRH-UHFFFAOYSA-N
FC2=C(C=C1C=COC1=C2)NCCC3CCN(C)CC3,118EC65E55FBF478_27AD772FC7388DE9_6041_UN,7.953813,00000000000000000000000000000000000000000010000000000000010000000000000000010000001101110001010010101100110100010001101011100100110001110110001011011011110110101111110,LHWSARMIIYPXAE-UHFFFAOYSA-N
O=[N](=O)C1=CC2=C(C=C1)N=CC=C2NC4=C3OCCCC3=CC(=C4)F,04AC96CC0706BF6A_7FE4B8994AE19ECA_6041_UN,8.282016,00000000000000000000000010000000000000000010000001000000110000010100001100000000100000010001001100100110010101000100001111101100101011110100001011111001110011110111110,CEWPDSDSOSXTFZ-UHFFFAOYSA-N
C1CC(CCN1)C3=CC2=C(C=CC=C2)[N]3CC4(CCN4)C,81ED41468C07AE85_7306184CE534DAAB_6034_DP,8.213788,00000000100100000000000000000000000000000000000000000000000000100110000000010001001101100011000010101100110000011001101011100100110100000110001011011011010110101111010,ZJSDLIMQACHTDP-UHFFFAOYSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)CCC4CCCN4C,215AD7E972CC8E9C_365A3CA1DC44B1E4_6034_UN,7.22551,00000000000000000000000000000000000000000000000000000000010000000100000000010000101101100001010110101100110011010001101011100100110010000110001001011011010111101111110,JWERWNLXLQIWPU-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@]23C[C@H]2COC34CCC4)F)[N]5C=CC=C5,7222BF9D98EB9BD4_00CB7EAB0180E1B2_6041_UN,8.122679,00000000000100000000001000000000000000000010000000000000010000100110000000010000001101010011000011101000010101001000001011100100110011110110001011011011110111101111110,WLEPSCXXRJIUNX-HNAYVOBHSA-N
N(C2CCOC1=C(C=CC=C1)C2)[S](C4=CC3=C(C(=C[NH]3)CC)C=C4)(=O)=O,5CA45B8338B8402B_962DE9DF54B0DD94_6029_UN,9.069055,00000000000000000001000000000000110000000000000000010001011111001101010001000000010100001011001011000110111001011110011011001100111111001100001011111001110111111111110,XYZIHMZSJNSPHN-UHFFFAOYSA-N
N1CCC4(CC1)CCC2=C(C=CC(=C2)NC3=CC(=NC=C3)CN(C)C)O4,41FD2C7A42A0EAFA_944176164883A2B8_6041_DP,7.031796,00000000000000000000000000000000000000000000000000000000010000000110000000100001101001100001010001101100110000011101001011100100110111010110001011011101110111101111110,NIMLONGWSAFKRA-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)N[C@@H]4CCN(C3CC3)[C@H]4C5=CC(=C(C=C5)F)F,79EEB138B3123C13_C5D7282C85794BA6_6041_UN,8.845165,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101010011000010101100110100010000001011100100110001110100001011011111010010101111010,GTVWICMODGNTKF-GGAORHGYSA-N
N(CC1C2CCC(C1)CC2)C(C3=C(C=C(CC)C=C3)F)=O,6A72465C096F151F_39B5E34CF5676CD6_6038_UN,7.972886,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000001000010100100010011000000000110000100000000011010011011110101111110,BNBLXKYRYQWZRQ-UHFFFAOYSA-N
C2(=CC1=C(C(=CC=C1)F)S2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,7ED8D43095C12701_895423DD740FC6E8_7022_UN,8.084313,00000000000000000000001000000000000010000010000100001000000000100100000000010001111101011011011010101100010100010000001011101100110001110110001011011011010110101111010,LUOMESXYUMCMEJ-QRWLVFNGSA-N
C2(=CC1=C(C(=CC=C1)Cl)S2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,AFC88AC3A2955FA2_6E48462F8B97F418_7022_UN,8.0842905,00000000000000000000001000000000000010000000000100001000000000100100000000010001111101011011011010101101010100010000001011101100110001110110001011011011010110101111010,GCCYAKUMGXFCIP-QRWLVFNGSA-N
C1(=C(C=C(C=C1)C2CC2)F)NCC3N(C)CC4(CC3)CC4,BFEBA28AD4069847_21AD5A8A38DE9B3E_7022_UN,7.303464,00000000000000000000001000000000000000000010000000000000000000100010000000010001001001110011010000101000010110011001101001100000110001110110001011011011010110101111010,LDMPAYAMDQBYMS-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CCC3CCC2=C(C=CC=C2)N3)C(=CC(=C4)F)F)C5,C49EADB7B650E787_B7265278A2CF9546_6034_UN,7.7562256,00000000000000000000000000000000000000000010000000000000000000000110000000110000100101010011000010101100110100011001101011100100110000110100001011011101010110101111010,BYBYWDUADHNKRG-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NC2=CC3=C(C=C2)CNCCO3,55E2EAFC4EB72151_D2AB7F45F660590E_6041_DP,7.6167912,00000000000000000101100000000010000000000000000000000000010000000100000000100001001000100000010101101100110001011100001011000100110111010110011011011111110011101111110,GXYKXEPPQSTEGD-UHFFFAOYSA-N
CCCC1=CC2=C(C=C1)N=CC=C2NCC(N3CC(C)OC(C3)C)C4=C(C=CC=C4F)F,7FEE448CBF13DCC3_358E251493E9CAD4_6041_UN,8.350666,00000000000000000000000000000000000000000010000000000000010000000100000000010001101001110001000100101100010110010011001011100100110011110110011011011111110111101111110,JZYKGHSQXXLBEW-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NCC3N(C)CC4(CC3)CC4,FF829A5418E6F2B0_D56DA887709D3A81_7022_UN,7.3034506,00000000000000000000001000000000000000000000000000000000000000100010000000010001001001110011010000101001010110011001101001100000110001110110001011011011010110101111010,ADBUCHQIYBXQRH-UHFFFAOYSA-N
NCCC(OC1=CC=C(C=C1)C2=CCNCC2)C3=CC=C(C=C3)Br,B2FAA954FC668CE0_108FD1C60C87950E_6035_UN,8.226643,00000000000000000000000000000000000000000000001000100000000000100000000000001000001010110001000001111000100100010100001001000111110110100110001101010001110101100111110,KMURRLPWXOQUAU-UHFFFAOYSA-N
C1(=CC=C(C=C1)CC2CC2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,F1053670EF3FD601_C039149E73241EE6_7022_UN,8.220859,00000000000000000000001000000000000000000000000000000000000000100000000000010000101001110011010000101001000110010001101001100100110001110110001001011011010110101111010,YRLRYJKYJKQIIH-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC3CC(C2=NC=C[N]2C)OCC3)Cl)C4CC4,828E5ABE4739C65A_F5C24D55C1D906A1_7022_UN,8.227435,00000000000000000000001000000000000000100000000000000000010000100100000000010101000101010010010111100001100111010000001011100100110011110100001011011111110011101111110,YDQQZLMWNUJRDD-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)N[CH]2C[C]3(C2)CC[CH2]CC3,9971A127FE99223F_8D5A4A22FF22E59A_6041_UN,7.6883965,00000000000100000000100000000010000000000000000000000000000000000110000000100001000000100001010000100000110000011000001001000000110001010100011011011111000010101111010,XEHKVHLXTMQCMF-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)NC(CCC)C2=C(C=C(C=C2)F)F)C3[C@@H]4CNC[C@H]34,44BB8FBB2594965A_DFD25EE9065F7FBF_6041_DP,7.973607,00000000000000000000001000000000000000100010000000000000000000000100000000000101101101110011010010101000110110010011001011100100110101110110001011011111010110101111010,VVXDKUVSCPBYFV-OSHAMATESA-N
CN(CC1CNC1)CC2=NC=C(N=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,F606845F72E82C61_78397491EA29BB0E_6041_DP,7.715847,00000000100100000000000000000000000000100010000000000100000000100100000000000101101001110011010000101000100110010001001011100100110101110110001001011011010110101111010,AJSBQWYRCMBXGA-GHTZIAJQSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(C=CC4=CC=N[N]4C)=O,E2884FF537EC0A10_018BC8E5FF8DA9CD_6038_UN,7.779457,00000000000000000000000000000000000000000000000000001000010000000100000000010000100100000001111011010100010000100000011011101100000011010100001011011011101011111111110,UIJCPTRZGDVXJQ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3(C2=C(C)C=CC=C2)CCCCC3)F)CC4,0E5983C72DF383D2_E96B444FF84227B7_6041_UN,8.392897,00000000000000000001000000000000000000000010000000000000000000100010000000010001101001110011010000001000000110011001101011100100110001110110001011011111010110101111010,LGQJNVIBMWEMND-UHFFFAOYSA-N
C(C1CN1CC2CC2)=CC3=C[N](C)C4=C3C=C(C=C4)F,A564D800CD8B3A29_E73AF7BF11C75E71_7019_UN,8.957657,00000000000000001000001000000000000000000010000000000000000000000100000000010000000101110000010010011100010100000000000011100100110000100110001000011010010110101111010,UXDFCFUARGUHLO-UHFFFAOYSA-N
N1CCC4(CC1)CCC2=C(C=CC(=C2)NC3=CN=CC(=C3)CN(C)C)O4,25F4F5E97A4B2572_246C39DD7A0F25CF_6041_DP,7.1751995,00000000000000000000000000000000000000000000000000000000010000000110000000100001101001100001010001101100110000011101001011100100110111010110001011011101110111101111110,YKUFDYZQNGWOPB-UHFFFAOYSA-N
N5CCCC4(CN(CC1=NC=C(N=C1)NC2(CC[Si](C)(C)CC2)C3=CC=CC=C3)C4)C5,67438F89F3F27C9D_43174486807747D4_6041_DP,8.020634,00000000100100000000100000000010000000100000000000000000000000100110000000110101101001100011010000101000110000011001101011100100110101010110001001011101010110101111010,DALNGLXGELLCSY-UHFFFAOYSA-N
C1(=CC2=C(C=C1)COCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,D71467B6FBF9E97E_976D9C1DF08A59DC_6041_UN,8.629983,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011010010101100110111010001101011100100110011110110001011011011010011101111110,MBUAYBMHCQNPEB-UXHICEINSA-N
CN5CCC1=C(C4=C(N1CC(C2CC2)C3CC3)C=CC(=C4)Cl)C5,006B938F1B4A1B38_941BD65030E9F4DD_6034_UN,7.9218435,00000000000000000000001000000000000000000000000000000000000000000100000000010000100101110000010010101101010100010001101011100100110000100110001011011000010110101111010,MNJOFZORZMREQD-UHFFFAOYSA-N
ClC1=C(C=CC=C1)C2=C[N](C(=N2)C3NCCC3)CC4[C@@H]5CNC[C@H]45,C62F895D8BF31547_562086B01BD776B7_6034_DP,9.002663,00000000000000000000001000000000000000100000000000000000000000100100000000010101001101110011000010101001110100010000001011100100110100100110001011011011010110100111010,VSRHSNYHKATVOH-KWOWKCNFSA-N
ClC1=C(C=CC=C1)C2=CN(C(=N2)C3NCCC3)CC4[C@@H]5CNC[C@H]45,C62F895D8BF31547_ACAD9BB0B343EC70_6034_UN,9.002659,00000000000000000000001000000000000000100000000000000000000000100100000000010101001101110011000010101001110100010000001011100100110100100110001011011011010110100111010,VSRHSNYHKATVOH-KWOWKCNFSA-N
N(CC1CC2CCC(C1)S2)C(C3=C(CC)[N](N=C3)C4=CC=C(C=C4)F)=O,8AE205643B020F88_E994236EC79F35B9_6038_UN,8.420145,00000000000000000001000000000000000010000010000000001000000000100100000000010000111100011011101011101000010100110010011011101100110001110100001011011011011110101111110,QWKYIBSJLMNNQH-UHFFFAOYSA-N
N(C1C3CC2CC(CC1C2)C3)C(C5=C(CC)N=C4C=C(C=CC4=C5)F)=O,856281BD41B82C44_F7045BF433E2A192_6038_UN,7.632974,00000000000000000000000000000000000000000010000000000000000000000100000000000000100000010011100001100100010100110010010001000100100001100100001011000011001110101111110,XXROIJMYYBRZJE-UHFFFAOYSA-N
O(C3CCN(CC1=CC=CC=C1)C2(CCC2)C3)CC4=NC(=CS4)C(C)(C)C,97FD1DEC6C9F2932_6E1497DD79BDC860_6039_UN,8.272561,00000000000100000000000000000000000010000000000100000000000000000110000000110000010101101000000111101000010001011000001011100111110010000110011101011100110111101111110,HYMLJUZFUXMXBP-UHFFFAOYSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC5CC(C4=NC=C[N]4C)OCC5,FF799B9465EC7A8D_B886B8A982392064_6041_UN,7.754924,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101110010010111100100110111010000001011100100110011110110001011011011110011111111110,HSAIWRJPDVSINH-UHFFFAOYSA-N
C2(=C1OC=CC1=CC=C2F)NCC3CCC(CN3)(C)C,ABC35BBF742417F2_FFC6D48246AE0578_7022_DP,7.8238897,00000000000000000000000000000000000000000010000000000010010000000010000000100001001100010011000110101100110100011001101011000100110101110110001011010111110110101111110,KLURZOBSPLRSER-UHFFFAOYSA-N
OC(CF)C1=CC(=CC=C1)NC23CC(C)(C2)OC34CCC4,B058B403F366C99C_432DDB946177BC5E_6041_UN,8.163073,00000000000100000000000000000000000000000010000000000000010000000010000000000000000100000011000111000000110010011001001000000000110111110101000000010001110111111111110,UEHVBOZQLNAEDO-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC4=C(C=C(C=C4)F)C5=CC=C(C=C5)F,46FD6B51321912CF_BFBFC612634494C9_6041_DP,8.21406,00000000000000000001000000000000000000100010000000000000000000100100000000000101100101010011010010100000110100010000101011100100110101110100001011011011000010101111010,GFBUQLPWIBHAGF-ACDBMABISA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3CNCC(C)(C)C3)Cl,E4C3776811DBF904_B764CBB2C5A8BB79_6034_UN,8.657692,00000000000000000000000000000000000010000000000100000000000000000110000000110110111101111011000010101001001110001001000111100100100101110110011011001111010110101111010,PWQINMYMLPWVAF-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CC(OCC2)C3=CC=CS3)F)CC4,A486A74AEAB97ABE_242CA4F6EB713C6F_6041_UN,7.7838507,00000000000000000001000000000000000010000010000000000000010000100000000000010001110101111010010011101000100111010001101011100100110011110110001011011011110111101111110,CPGOHTCIRMAQGY-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC=C2NCC4CC3(CCN3C)C4,87F920AF68AFDAB9_5CEA3BF156AE7970_6041_UN,7.926428,00000000100100000000000000000000000000000010000000000100000000000110000000010000101101110010010010001100010100011001101011100100110101110110001010011011010110101111010,ZPIVGZRWKWOCTB-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC[C@H]3[C@H](C2=NC=C[N]2C)OCC3)C4CC4,F43089BC151829F5_64F4E221FAAAC6AD_6041_UN,8.042219,00000000000000000000001000000000000000100010000000000000010000100100000000010101001101010011010111001000000101000000001011100100110011110110001010011011110111101111110,BVXYBZIOGWHJSB-SUMWQHHRSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC2=C[N](N=C2)CC3=NN=C4CCCC[N]34,AEA77BFD4BC70681_A07B6B43DA5121C2_6041_UN,7.7972374,00000000000000000000100000000010000000100000000000001000000000000100000000110101100101100001011010101100010000011000001011101100111001010110011011011101010110101111010,DZHDNUULKVIXIW-UHFFFAOYSA-N
CC4(C)CC1=C(C(=CC=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C4,45634C8C47CD006B_605ED8AC4FCD9C8C_6041_DP,7.2293572,00000000000000000000000000000000000000000010000000000100000000100010000000100000101000110011000010101100110100011001001001000100110101110110001011010111010110101111010,SLENEJADYUYGBU-AZUAARDMSA-N
N4CCC(C[N]1C=C(C=N1)NCC(N2CCN(C)CC2)C3=CC=C(C=C3)F)CC4,1CD0CAE04BDBBC55_C0994C63C9C3FABF_6041_DP,8.132894,00000000000000000000000000000000000000000010000000001000000000000100000000010001101101110001011010101000100100010001101011101100110101110110001001011001010110101111010,QGHIXIYRQXTNFH-UHFFFAOYSA-N
C([C@]12C[C@H]1COC23CCC3)=CC4=C[N](C)C5=C4C=C(C=C5)F,6AEA555972A65A5D_3CDD126A4F549625_7019_UN,8.365672,00000000000100000000001000000000000000000010000000000000010000000110000000010000000101010000010010110100010101001000001011100100110010100100000001011000110011101111110,RGIZKDSZRREIRT-KSSFIOAISA-N
C[N]1N=NC2=C1C=CC=C2NCC34OC(C)(C)C(C3)C4,4A2A6B4D11635134_D5C21DC16F874F2F_6041_UN,7.087481,00000000000100000000000000000000000000000000000000001000010000000110001000110101101100000010011110001100010010001000100011101100101011010100011000001101110111101111110,QZIPZDLUHLVHKX-UHFFFAOYSA-N
CN(C)C1=CC=C(C=C1)NCC2=CC=CN2CC3(F)CNCC34COC4,33EEBB9074F840C1_00C6B8766DF22381_6034_UN,7.8437924,00000000100100000000000000000000000000000010000000000000010000000110000000110001101101110011010011001000010101011000000011100100110101110110001010001111010111101111110,AIPOZLQXVNQPIJ-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)OCCC2=O)[S](C4=CC(=C3[NH]C=CC3=C4)CC)(=O)=O,5FB9FD53EC16C1B9_D897336E24EFA9EA_6029_UN,8.205432,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100001110001010100110011001001110011011001101001111011100101111111001111111111111110,OMADJFKHSKHVMG-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CC(=N2)NC4C[C@H]3CCC[C@H](N3C)C4,743D3465AD2AD562_22D83B40502E9787_6041_UN,8.19939,00000000000000000000000000000000000000100010000000000000000000000100000000010100100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,JHGKWDXWVSFTDV-MQVJKMGUSA-N
CC3=NC2=C([C@H]1CCCN[C@H]1CC2)N3CC4(CCNC4)C5=CC(=CC=C5)F,0471B359D021A035_835D669DA5D85FE7_6034_UN,7.839595,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101110011000010101100110110011000101011100100110100100110001011011011010110101111010,PKFLJXBMHICBDC-NVPCEHRXSA-N
CSCC3(C=CC2=CC1=C(CCNC1)S2)CCOCC3,9DBB2513A3B2515A_29BF2095BF548C0E_7019_DP,8.024756,00000000000000000000000000000000000010000000000000000000010000000010000000000000011100101001010010111100110011011001001011000000110010000110000011010001010101101111110,KURJWSPJHLZCJI-UHFFFAOYSA-N
CC(C)(C#N)C1=C(C=C(C=C1)NCC3CC2(CCN2)C3)F,0B3E2A9FBE0E83AD_F232F2818F7C5CB8_6041_DP,7.7780304,00000000100100000000000000000000000000000110000000000000000000000010000000100000001000010011000000001000110100011000001001000000110101110110001010010111010110101111010,ZPVQAHOJVDGLGL-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CC3(C2)CCOC3)Cl)C4CC4,253C4D6543985A9D_00A395823431A7F5_7022_UN,7.312788,00000000000100000000001000000000000000000000000000000000010000100010000000000000001100110010000010001001010111001000001000000000110011110110000010010011010111101111110,RRGVPCIFCDWLMX-UHFFFAOYSA-N
N(CC12CCC(CC1)CC2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)Cl,7FB24F9DAF879057_AE082F92AC2C32EC_6038_UN,7.2459326,00000000000100000000000000000000000000000000000000000000000000100010000000000000001000010011100000001001010100101000011000000000110000100000000011010011011110100111110,DVRIVENJKHINTF-UHFFFAOYSA-N
N(CC12CCC(CC1)CC2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)F,8EC5DBB315A38316_61ED759A771A4BCA_6038_UN,7.245923,00000000000100000000000000000000000000000010000000000000000000100010000000000000001000010011100000001001010100101000011000000000110000100000000011010011011110100111110,QDLXITVBFOJWKH-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(C3=C(SC)C=CC=C3F)=O,71AAA96C77672D06_0A69C42EC77BDAFA_6038_UN,7.9957724,00000000000000000000000000000000000000000010000000000000000100001000000000000000011000011001110010001000110100110000011000000000110000100000000011010011011110101111110,QZZMFUOLYLJZKP-UHFFFAOYSA-N
FC1=C(C=CC(=C1)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C)OC4CCOCC4,5A07E3C00B4D3556_836656BB99172537_6041_UN,8.397021,00000000000000000000000000000000000000000010000000000000010000100100000000010101101101110111010010101000000111010101101011100111110011110110001111011111110111111111110,RBAUMSJZYBABOD-KSFYIVLOSA-N
CC1=C(C=C(C(=C1)NC[C@H]2CCCCN2CC3=CC=CC=C3)Cl)C4CC4,94017D6487FCFED5_BE04D95477CE9891_7022_UN,8.116349,00000000000000000000001000000000000000000000000000000000000000100000000000010001001001110011000000101001000110010000001001100100110001110110001011011011010110101111010,VPLYWFKVBULXDP-HXUWFJFHSA-N
CN(C)CC1=C(C4=C(N=C1C2=CC=C(C=C2)C3CCC3)SC5=C4CCC5)C6=CC(=C(C=C6)Cl)Cl,E2ABEE2C1AE4B76D_08735CE82DE109D9_2201_UN,8.161685,00000000000100000000000000000000000010000000000100000000000000100100000000100000110101111000010010101101010100000001001011100100010000100100001011011110010110101111010,BPGWJTHIELIVRV-UHFFFAOYSA-N
CN(C)CC1=C(C4=C(N=C1C2=CC=C(C=C2)C3CCC3)SC5=C4CCC5)C6=CC(=C(C=C6)Cl)F,85CABAFAFC7977D7_9F40FF4751FB4970_2201_UN,8.161674,00000000000100000000000000000000000010000010000100000000000000100100000000100000110101111000010010101101010100000001001011100100010000100100001011011110010110101111010,PUQSUZAYYMGHHV-UHFFFAOYSA-N
CN(C1CCCNCC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=C(C(=CC=C4)F)F,539FBD1016DE634A_F467944E1616A2EB_6041_DP,8.343324,00000000000000000001001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010000101011100100110101110110001011011011010010101111010,MCRAHSYNLUHZDO-BOBJKBKNSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3(CCC3)C4CCC4,109FD29AC0DF31AF_F44D1EB1604CD33A_6041_UN,7.7216144,00000000000100000000000000000000000000100010000000000000000000100110000000000100001000010011000000101100010110001000001001000100110001110100001011010111010110101111010,KXHIQLUFFBAJSN-UHFFFAOYSA-N
C(CCC1CCOC1)=CC3=CC(=C(N2CCN(C)CC2)C=C3)F,A811754B0672DECB_98A909A3FCC88FA9_7019_UN,7.1554403,00000000000000000000000000000000000000000010000000000000010000100000000000010001000101110000010010111000000101010001101011100000110011110110001011011010010111101111110,FALWPBFKGIRBFQ-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC3CCCC3N4CCOCC4,361446EA96374405_6FF6AD3F6A747702_6041_UN,8.43572,00000000000000000000000000000000000000000010000000000000010000100100000000010000101001110011000110101100010101010000001011100100110011110110001011011011010111101111110,KZMLOMMYHPGMKN-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C=C[NH]2)NC3CCCC4=C3C=N[N]4C(C)(C)C,B63E6474CC38A327_BE959A9DA843837A_6041_UN,7.050748,00000000000000000000000000000000000000000000000000001100000000000110000000110000100100000011001010000100110010011000001011101100100101010100011011011101000010101111010,FTAGTWCCFRQHEU-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3(CCCC3)C4CC4,83B1B0AB40F2E8F4_F738D3E2863D4D85_6041_UN,8.471407,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010011011010000100110100011000001011101100110001110100001000011001000010101111010,UBQWBAPJTJSREN-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC4(CC3CC3)CCCC4,8C5AADCE568737EE_257865E1C69B702A_6041_UN,7.438423,00000000000000000000001000000000000000100000000000000000000000000110000000000100001000000011000010101100010010001000001001000100110001010100011011010111010110101111010,AKNIXWGFCCVWRD-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@@H]3[C@H](C(C)C)CCO3,848E0D2C809C866D_1D356251E5155FE0_6041_UN,8.019062,00000000000000000000000000000000000000100010000000000000010000000100000000100100001100010001000110101100010111000000101011000100110011110110011011010111110111101111110,RNCHFJGDQGXPFW-WMLDXEAASA-N
CC1=C(C=C(C(=C1)NCC2(CCCNC2)C)Cl)C3CC3,16BD07C4151E06A4_2811DBB708C1B321_7022_DP,8.120445,00000000000000000000001000000000000000000000000000000100000000100010000000000000101000110011000000101001100110011001101001000000110101110110001011010111010110101111010,HEJHHMFAWABXDP-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CC4(C3)CCOC4,B822A0D775B6111A_FFED3437A6DE744B_6041_UN,7.6460695,00000000000100000000000000000000000000000010000000001000010000000110000000010000101100110010011010001100010101001000001011101100110011110110001000011001010111101111110,MGSGLDXHUAZDKP-UHFFFAOYSA-N
CC1=C(C=CC(=C1)F)NCC2N(C)CC3(CC2)CCC3,32E540A01FF835F5_5F2485737275C4BC_6041_UN,7.236059,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011111010110101111010,VXUWSEMXPVZARR-UHFFFAOYSA-N
C2(=C1CCCCC1=CN=C2)NC3=C(C=CC(=C3)CN(C)C)C,52D3A7FF64E96E62_D1A4F3AB47F821F0_6041_UN,7.0790954,00000000000000000000000000000000000000000000000000000000000000000100000000100001000001100011010000101100010000000001001001100100110001010100011011011111010110101111010,BNRCPLBJIRRRRZ-UHFFFAOYSA-N
FC2=C1C=C[NH]C1=CC=C2NCC3CC4CCC3N(C)C4,ABB7BC0F4ABFA9F3_F839D08EC28D826B_6041_UN,8.148874,00000000000000000000000000000000000000000010000000000000000000000100000000010000101101110011010010101100010110010001101011100100110101110110001011011011010110101111010,QDECHRGVJCHAQO-UHFFFAOYSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)C[C@]34CCC[C@H]3CNC4,DCC1CAA12DC2BEA0_FB0239089D7C4A15_6034_DP,8.491918,00000000000000000000000000000000000010000000000100000000000000100110000000010110111101111011000010001101011100011011001111100100110001110110001010011111010110101111010,YZALEQHZJGWDPS-GPIDFBCLSA-N
FC1=CC2=C(C=C1)C(=CN2CC(CC)NCC3=C(C=CC=C3)Br)C4=CCNCC4,8C7120FE45D1870C_0434AE49ED36B4E1_6034_UN,8.617022,00000000000000000000000000000000000000000010001000100000000000100100000000011001001101110001000010111100110110010010101011100100110100100110001011011011010110101111010,FSQJIRYDWOGFHX-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)F)NC2CN(C)C3(C2)CCOCC3)F,20134914F52B4732_0400B90314C6358B_7022_UN,7.247181,00000000000000000000000000000000000000000010000000000000010000000010000000010001100101110001010011101000110111011001101011100000110011110110001011011111010011101111110,GUAAQYQOXRZYMW-UHFFFAOYSA-N
CC1=CC(=C(C=C1)NCC2(CCSC2)N3CCOCC3)F,A93C9B04A7E42772_B5EFC152A74B86B4_6041_UN,7.7850537,00000000000000000000000000000000000010000010000000000000010000100010000000010001001101111011000110101000000101011000001011100000110011110110001011011011010111101111110,ZSCOSZZCKRHYTD-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CC3(NC2)CCC3)Cl)C4CC4,CCBD16AFF0DED9EF_700044CFBA438497_7022_DP,7.699859,00000000000100000000001000000000000000000000000000000100000000100010000000000000101100010011000010001001110110011000001001000000110101110110001010010011010110101111010,PBWDOILAQZUUED-UHFFFAOYSA-N
CC1=CC(=C(C=C1)NCC2(CCSC2)N3CCOCC3)Cl,75FCADCFE4953F8C_55A43374251F2C87_7022_UN,7.785047,00000000000000000000000000000000000010000000000000000000010000100010000000010001001101111011000110101001000101011000001011100000110011110110001011011011010111101111110,NCPWCHBSHVWVAA-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2=CC=CC(=C2)CC3CCCN(C)C3)Cl)C4CC4,72865A04D0561122_78F72F932B424556_7022_UN,7.7279577,00000000000000000000001000000000000000000000000000000000000000100000000000010000000001110001010000101001000110010001101001100100110001110110001011011111010110101111010,DRBBOJDCLNRBBM-UHFFFAOYSA-N
N(CC12CC(C1)CCO2)C(=O)C3(CCOCC3)C4=C(C=C(C=C4)F)F,B43534355AA989A4_0B0501FD0D65CB95_6038_UN,7.869439,00000000000100000000000000000000000000000010000000000000010000100010000000000000001000110011100100101000010101101000011010000000110010100110000011110011111111110111110,KAGYZKOCYUQJOP-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC3OCC2(CCNCC2)C3)F,9C109DEF18DD5BF0_6F6F3CE5DE98BAEB_7022_DP,7.464279,00000000000000000000000000000000000000000010000000000000010000000010000000100000001101110011010110101000110101011001001011100000110111110110001011011111110111101111110,DJCUXYGGVIBNRC-UHFFFAOYSA-N
CC1=C(C=C(N=C1)F)NCC2CCCN(C)C2C3=CC(=CC=C3)Cl,189B1A9447A9DD42_93332FFB609E5FF1_7022_UN,8.112465,00000000000000000000000000000000000000000010000000000000000000100100000000010000101001110011010000101001000110010001101011100100110001110110001011011111010110101111010,VLDBLBLGYQAXOV-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=C[N]2CCC3CNCCN3)C4=CCNCC4,4BB84757E2542EE8_A0D5F92FCC62E5E7_6034_DP,8.457603,00000000000000000000000000000000000000000000000000100010000000100100000000011001101101100011000010111100110000010000001011100100110100000110001001011001010110101111010,WWIUNBBSJNMPLF-UHFFFAOYSA-N
N3CCC1=C(C=C(C=C1)C=CC2=C(C=C(N)C=C2)Cl)C3,EB4110219FEEE904_13651022BD357810_7019_DP,8.918365,00000000000000000000000000000000000000000000000000000000000000000000000000000000001010110001000000111101110100010000001001000100110101110110001011010011010010100111010,RNHBPZAQUWDADU-UHFFFAOYSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)C[C@H]5C[C@@H]4CNC[C@@H]4N5C,28A3D85D06483DA9_CFF86DD85C2FAF51_6034_UN,7.0838666,00000000000000000000000000000000000000000000000000000000010000000100000000010001101101100011010110101100110011010000101011100100110110000110001001011011010111101111110,OPRFDRWFUQOWOU-NMVAHXIRSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NC4C[C@H]3CCC[C@H](N3C)C4,118B7767D0B0BD33_F3E5B63188FE54D7_6041_UN,8.229094,00000000000000000000000000000000000000000010000000000000000000000100000000010001100001010001010000100100110110010000101011100100110001110100001011011011000010101111010,PMNNRDBPTOIPIP-GOOCMWNKSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CC3(CCC2)CC3)F,A60F5160B4A9322F_FDB41549AD96924F_7022_UN,7.6600323,00000000000000000000001000000000000000000010000000000000000000000010000000100000001001110011010000001000010100001001001000100000110001110010001011011111010110101111010,GQDLEQGFDWBNLL-UHFFFAOYSA-N
CC3CC1=C(C=CC(=C1)NC2=N[N](C(C)(C)C)C=C2)O3,0D190B91FA199E21_5B3D312F883E6DCB_7022_UN,7.9099803,00000000000000000000000000000000000000100000000000001000010000000110000000110101100100000001001010000100010000001101000011101100000011010100011010001101100011101111110,NILZBIGSHJOUES-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2(COC2)C3=C(C=CC=C3)F)C4CCCC4,43D8B08930F5D895_FFB0EDD4140408B5_6041_UN,8.068739,00000000100100000000000000000000000000100010000000001000010000100110000000010101100100110001011110000000100101011000001011101100010001110110001010011011010011101111110,ASKVBALJMJUYMG-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NCC2CNCC(C2)(C)C)F)C#N,8D207A0EAC5492F4_AAD15421B5366CAF_6041_DP,8.097622,00000000000000000000000000000000000000000110000000000100000000000010000000100000101000110010000000101000000110001001000001000000100101110110011011000111010110101111010,WYIGCXRQGGFFIV-UHFFFAOYSA-N
COCC[N]1C=CC2=C1C=C(C=C2)NCC(N3CCOCC3)C4=CC=C(C=C4)F,083F36B6261A3AEA_879C5D17D7E4277D_6041_UN,7.528389,00000000000000000000000000000000000000000010000000000000010000000100000000010001101101110001010110101100010101010001101011100110110011110110001001011001010111111111110,MIAPYCCSWRJKJF-UHFFFAOYSA-N
FC1=CC(=C(C(=C1)F)NC(COC)C2CCCOC2)F,578EC4AA6D8579FC_190ED3F51593701E_6041_UN,7.7909493,00000000000000000000000000000000000000000010000000000000010000000000000000000000000000110011010101100000100101010001001000000010110011110110000011010011010111111111110,ZAMWKBUSISZGGJ-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NC2CCN(C)C23CCCNC3)F)F,D85ECD528EF9B6EB_B7BE1C50043B2788_7022_DP,8.142088,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101110011010010101000110110011001101011100000110101110110001011011111010010101111010,FVPPIGRECOVJQD-UHFFFAOYSA-N
O(C1CC(C1)(C#N)C2=CC=C(C=C2)F)C[C@@H]4C[C@H]3COC[C@H]3O4,56E597E0D259E00F_4633BCBAAE1E46B9_6039_UN,8.220555,00000000000100000000000000000000000000000110000000000000010000100010000010000000000100110100000010000100010101001000000010000011110010100110000100100000110101010111110,PYWZEEQAGWJUQY-QXUKGGDDSA-N
N(CC1C2CCC(C1)C2)C(=O)CCC3=CC=C(C=C3)F,D32B78A4C1A717B8_7BC75C60863879CF_6038_UN,7.697029,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001000110100110000011000000000110010100000000001010001011110100111110,QCGVZYKKFVOPBG-UHFFFAOYSA-N
CCC1=C(C(=NC=N1)NC3C[C@H]2CCC[C@H](N2C)C3)F,34D9A1E21EE9D5F8_6F1417769ADE476E_6041_UN,8.474657,00000000000000000000000000000000000000100010000000000000000000000100000000010100100001010001010000100100110110010010101011100000110001110100001011011111000110101111010,OPKWNRAVCGEYFP-YOGCLGLASA-N
FC1=C(C(=CC=C1)NC3CC(C2=CC=N[N]2C)OCC3)C=C,9565F1556FADD009_7206A2987C0A4671_6041_UN,8.043222,00000000000000000000000000000000001000000010000000001000010000100100000000010000100100010010011111110000100111010000001011101100110011110100001011011011110011101111110,JBVOPQPBLBKEQZ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NCC2N(C)CC3(CC2)CC3)C=C,F06AD08EDD8F7F54_2C989405B7E93717_6041_UN,7.8197503,00000000000000000000001000000000001000000010000000000000000000000010000000010001001001110011010000111000010110011001101001100000110001110110001011011011010110101111010,MUVHUFINWCVTNT-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)F)F,084A0ECAB3C92F39_A30713CFA56419EE_7022_DP,9.02309,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001111010110101111010,TZTSYSIUWQSBPJ-NWDGAFQWSA-N
CC3=NC1=C(C=CC2=C1CCCN2)[N]3C[C@@]45CCN(C)C[C@H]4CNC5,7489A91CCB2559F2_866D601283E9548D_6034_DP,7.6851716,00000000000000000000000000000000000000100000000000000000000000000110000000010101101101100011010010101100110010011001101011100100110100010110001011011111010110101111010,VEUXLMWPXAINRR-QRWLVFNGSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NC4CC(C3=CC=N[N]3C)OCC4,7A8E6D62509DD149_CEC03254172F151F_6041_UN,8.1006975,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010010011111100100110111010000001011101100110011110100001011011111110011101111110,RJCLVTSTEMQQNH-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C2CC2)NC[C@H]4[C@H](C3=NC=C[N]3C)OCCC4,250639BC82279E18_886564BE9FF9BB8E_6041_UN,7.9747906,00000000000000000000001000000000000000100010000000000000010000100100000000010101001101010011010111101000000101000000001011100100110011110110001011011011110111101111110,LLBXYOGJEWCVDY-KBXCAEBGSA-N
O(CCN3CC1=C(C=CC=C1)C2(CC2)C3)CC4=CC(=CC5=C4OC(OC5)C6=CC=CC=C6)F,5182DDBC206F60E0_991EBE48DD1C191E_6039_UN,8.2461195,00000000000000000000001000000000000000000010000000000000010000100010000000010000000001110100000100101100010101011100001011110110110010100110000011111000110101110111110,TWINGKYKKGAHPD-UHFFFAOYSA-N
CN3CCC(CNC(=O)C1CC2CC1C=C2)C3C4=CC(=C(C=C4)Cl)F,78FEF9A177618AC9_51549987CBB2AD1C_6038_UN,8.283945,00000000000000000000000000000000000000000010000000000000000000100000000000010000101101110011110010011001010110110001111001100000110000100110001011011011011110101111110,AEPMHPPAMOBWAN-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)C2OCCO2)C)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,C7A1B803A725E3CB_9D19B35776E655B8_6041_UN,7.4953465,00000000000000000000000000000000000000000010000000000000010000100000000010010001000101110000010010101000000101010001101011110100110011110110011011011111010111111111110,ACNLMHSIROJJGH-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(C4=C(C3=CC=CC(=C3[NH]4)CC)F)=O,9E44777BA66FAA1C_A11F5727108E89A3_6038_UN,8.017114,00000000000000000001000000000000000000000010000000000010010000000100000000000001001100010011100110101100010100100010011011000100110110100100001011010011111111111111110,DSOMFELMPZRXSU-UHFFFAOYSA-N
O(CCC1CCCCC12OCCO2)CCC3CN(C)C3,58E247D2E37B5CEF_430CC39BDD0DA871_6039_UN,7.441699,00000000100100000000000000000000000000000000000000000000010000000000000010010000000101100000010010001000010011001001001011110010110010000110000000111000110101111101110,RXFMRSVIIVAEDI-UHFFFAOYSA-N
FC1=C(C=CC=C1)CC2=NN=C(S2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,E6F362B32F9AFD30_10A85ED1B561BE67_6041_UN,8.423449,00000000000000000000001000000000000010000010000100001000000000000110000000100101111100011011001010001100011100011001101011001100110001110100001011010111010110101111010,XUZPNZOZHXFWOB-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)NC3=C([N](C)N=C3)C4CC4,957FF8F8A0D8A7A3_421DE901563A04B0_6041_UN,7.354099,00000000000000000000001000000000000000000010000000001000000000100100000000010001100100010001011010000100010110000000001011101100010001110100001010011011000010101111010,HSRGFMMNKFPNIX-UHFFFAOYSA-N
CC1=C[NH]C2=C1C=C(C=N2)NC3CCN(C)C34CCCNC4,EFE942C282365B37_14535222DEBA473B_6041_DP,8.149527,00000000000000000000000000000000000000100000000000000100000000000110000000010101101101100011010010101100110010011001101011100100110101010110001001011101010010101111010,OJQLCZBWYCYNTP-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)C3CC(F)(C3)C4=CC(=CC=C4)F,EB76491F9057B7F8_99635E7025E428BA_6038_UN,7.4455276,00000000000100000000000000000000000000000010000000000000000000100010000000000000001000010011100000011000010100101000011000000000110000100000000001010001011110100111110,MEOXGDRBJHTOPC-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CC=N2)NCC3CCN(C(CC)C)C3,733A134BF61FF5A6_C585569E66B32A38_6041_UN,8.504033,00000000000000000000000000000000000000000010000000000000000000000100000000010000101101110011000010101100010110010011101011100100110001110110001001011101010110101111010,JAVTWSZALCUWET-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NC2CCCC3=C2C=N[N]3CC)C4CC4,8313B1863EE79E1E_720B228DE5EA6A68_6041_UN,8.210278,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010011001010001100110110010010001011101100110001110100001011011011010110101111010,YIUOTCJBILIKBW-UHFFFAOYSA-N
CC1=CC2=C(C(=C1)C)N=C(C=C2C)NCC3CCCC(O3)C4CC4,7B69CDC35BECBD65_13C493A2615CCC7B_6041_UN,7.6471014,00000000000000000000001000000000000000100000000000000000010000100100000000000100001000000011000100101100010000000000001011000100110011010100011001010101110111101111110,BQFBWDSPKJOEAE-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CCCC3)C4=C(C=CC=C4F)F,994B18C6D28576B1_251AA818F6C6FC5B_6041_UN,7.9350367,00000000000000000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,ZXKWNOBQVWMEBB-IBGZPJMESA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NC3CNCC4(C3)CCC4,2345E4DCDCA888FC_B4572C09B4CFD309_6041_DP,8.03705,00000000000100000000000000000000000000100000000000001010000000100110000000010101101100100011011010101000110000011000001011101100110101010110001011011111010010101111010,UULJWOWZUUTRSH-UHFFFAOYSA-N
OC(CBr)C1=CC=C(C=C1)NCC2N(C)CC3(CC2)CCC3,083DFAA8C616873E_D676786BF0AF9696_6041_UN,8.047728,00000000000100000000000000000000000000000000001000000000000000000010000000010001001001100011010000101000110010011001101001100000110111110111001001011011110111101111110,QEBOFWMAWFJKMH-UHFFFAOYSA-N
OC(CF)C1=CC=C(C=C1)NCC2N(C)CC3(CC2)CCC3,DFA1855F11D18204_A1A81BEC522441FD_6041_UN,8.047715,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001100011010000101000110010011001101001100000110111110111001001011011110111101111110,UFWUQCSWZVLBML-UHFFFAOYSA-N
CC(C)C1=C(C=C(C=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)F,4860703050C70087_3A410E285AA90E78_6041_DP,8.391543,00000000000000000000000000000000000000000010000000000100000000100100000000110101101101110011010010001000000110000000000011100100110101110110011010001111010110101111010,LEBMFVNEDYAXMX-XJKSGUPXSA-N
NCCC(OC1=C(C=CC=C1)CC2CCNCC2)C3=CC(=C(C=C3)Cl)Cl,2E722F06D45F4149_E2DBC2F0DC1579D2_6035_UN,8.316718,00000000000000000000000000000000000000000000000000000000000000000000000000000000001010110001000001101001100100010100001001000111110110100110001111010011110101100111110,BHBPRLRMLRFTEG-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC4OC3(CCC(C)(CC3)C)CC4,0120317902F155CF_1B11290FC7C85BCB_6041_UN,7.773266,00000000000000000000000000000000000000000010000000000000010000000110000000100000101100010011000110101100010100001001101011000100110011110100011011010111110111101111110,GYIZQRSDJXKOOO-UHFFFAOYSA-N
N4CCCC1=C(C=C(S1)NC2=CC(=C(C=C2)N3CCCC3)F)C4,CE5FDC707AF913EA_2FE9F62B518ED7C1_6041_DP,7.5688615,00000000000000000001000000000000000010000010000100000000000000100000000000010000011101111011000010001100110100010000001011100100110101110110001010011011010010100111010,WYUGKHJBQQMXDS-UHFFFAOYSA-N
C1(=C(C2=C(C=C1)C=CC=C2)F)NC[C@@H]3CCCN(C)[C@H]3C4=CN=C[N]4C,C0345CB676787E95_7F114A260EFF4C4E_7022_UN,7.620137,00000000000000000000000000000000000000000010000000000000000000100100000000010101101101110011010010101100010110010001101011100100110001110110001011011111010110101111010,IOGXJWLAUMLZGS-HRAATJIYSA-N
N(C1=CC=C(C=C1)C24CC3CC(CC(C2)C3)C4)C(C5C6=C(CCN5)C(=C(C=C6)F)F)=O,4E68A4E9EB2D60B5_38247607C69DE6BE_6038_DP,7.4888124,00000000000000000000000000000000000000000010000000000010000000100010000000000001001000010001100100101100110100111000011001000100100101110100001011010011011010100111110,VVKCMVVMUHVNNW-UHFFFAOYSA-N
N1CCCCC1C2=NC=C(C=N2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,84FA977914D9E6C5_7FF13730AD445461_6041_DP,8.973568,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100110101110110001011011011010010101111010,SMNVBCQIMXRFNO-KGNCLDLBSA-N
O=C3C=CC1=C(C2=C(C=C1)C=CC=N2)N3CC4(CCCN(C)C4)C,E67AAC6F77738127_070FA6D6F9D7C3A4_6034_UN,8.211522,00000000000000000000000000000000000000000000000000000000000000000110000000010001100001100000110000101100010010111101111011100101110000000110001111011110011110101111110,GYNFYRCXMAILHW-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC34C(C3)CNC4)Cl,5165EEE7182FCA87_4D5AD9E9A1A1C317_6034_UN,7.525049,00000000000000000000001000000000000010000000000100000000000000000110000000010110111101111011000010101001011100001000000111100100110101110110001011001011010110101111010,QWXNVOLJWVUZCK-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(C)CCCO2)F)CC3,6B6351F3ADC2EF0C_FA5C079A45E01CF6_6041_UN,7.107995,00000000000000000001000000000000000000000010000000000000010000000010000000010001101101110011010110001000000111011001101011100000110011110110001010011111110111101111110,ALJAEFSCJYYKTM-UHFFFAOYSA-N
CN5CCCN(CC1=C(C=C(C=C1)NC3C2CCOC2C34CCCC4)F)CC5,74DCE38634EBF8B9_FB2D35B2CB6D860C_6041_UN,7.2732787,00000000000100000001000000000000000000000010000000000000010000000010000000010001100101110011010011001000010111011001101011100000110011110110001010011011110111101111110,BFXLBGDHDUEYAP-UHFFFAOYSA-N
NC[C@@H](OCC1OCCC12CCNCC2)C3=C(C=CC=C3)F,F800CFD5BEC1A373_84E283CD10BFAF52_6039_DP,8.1174965,00000000000000000000000000000000000000000010000000000000010000000010000010000000001110110001000110101000110101011000001011000010110110100110001011010011110101110111110,BOEJWPAGLMSCDK-AAFJCEBUSA-N
FC1=CC=C(C=C1)C(CCC=CC2=C(C=N[N]2C)C3CC3)C4=CC=C(C=C4)F,7A9EE0F39545E7CE_D1343CF729BE9721_7019_UN,7.9916534,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010000011010010000000100000000001011101100000000100100001011011010000110101111010,XCMUAEMCCRXFSD-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC4CC3(CC3F)C4)C5CCNCC5,116163FC987607C2_118F2C8B0B542FE3_6034_UN,8.167973,00000000000100000000001000000000000000000010000000000000000000100110000000010000001101110001000010101100110100011000001011100100110000100110001001011001010110101111010,CLFPCUFWKFIUMJ-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=C2C3CC3)CCCC4(C)CCCN4,25095790B7B0B591_AAD23745386FE5A5_6034_UN,8.058495,00000000000000000000001000000000000000000000001000000000000000100110000000010000001101010011000010001100110110011001101011100100110000100110001000011001010110101111010,JTYXRZPVTPNGGA-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CCCC23CCNCC3)F,5FC27C7D992AA3D3_46B70898C1FF8749_7022_DP,7.600729,00000000000000000000000000000000000000000010000000000000000000000010000000100000001001110011010010101000110100011001001001100000110101110110001011011111010110101111010,RHVGHZUREPZWKL-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C=C)NCC2CC3CCC2N(C)C3,551344940B9F33C0_60411278D7440FDC_6041_UN,8.423397,00000000000000000000000000000000001000000010000000000000000000000000000000010000101001110011010000111000010110010001101001100000110001110110001011011011010110101111010,AVHIXQIANZXKKY-UHFFFAOYSA-N
COC(OC)C1=CC(=C(C=C1)F)NCC2(CCCCC2)C3=CC4=C(C=C3)OCO4,A45CC7A48EE12334_EF12BA4E472DF8A8_6041_UN,7.3327346,00000000000000000000000000001000000000000010000000000000010000100010000010000000001100010011010010001100010101001100001010010110110001110110100011110111110111111111110,DJJCIJIVHYGDHR-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NCC2C3(CCNC2)CCOCC3)F)C#N,48F14BF8A6E184BA_B70DA0F17F4C78D7_6041_DP,8.0041065,00000000000000000000000000000000000000000110000000000100010000000010000000000000101000110011000000101000110101011000001011000000110111110110001011010011010111101111110,LWAOHVOZMKRLBD-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC3=NC=C(C2CC(C)CCC2)S3)F,3927720196C4D0E9_930B1114CAAEE90D_7022_UN,8.444418,00000000000000000000000000000000000010000010000100000000000000100100000000100100010101111000010010001000001110000001101011100100110001110100011011011111010110101111010,FSUQPBMEHFRGBO-UHFFFAOYSA-N
NCCC(OC1=CC2=C(C=C1)CNCC2)C3=CC=C(C=C3)Br,EE590BF0DB2259C2_28E2038B33376A9A_6035_UN,8.195225,00000000000000000000000000000000000000000000001000000000000000000000000000000000001010110001000001101100110100010100001001000111110110100110001111010001110101100111110,MGVKTRXVCAPQTL-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCCC2CC3=C(CC2)C=CC=C3,99DD685523A4059D_4405D16D9ED1FB80_6041_UN,7.4178004,00000000000000000000100000000010000000000000000000000000000000000100000000100001001000100001010000101100110000011000001001000100110001010100011011011111010110101111010,POHITDSMPKMLJX-UHFFFAOYSA-N
C(NCC1=CC2=C(C=C1)N(C=C2)CCC3NC4=C(OC3)C=CC(=C4)F)C5=CC=CS5,27129A629F9C3160_7F524991F58F3462_6034_UN,8.826763,00000000000000000000000000000000000010000010000000000000010000000100000000010000111101111011000110101100110101010100001011100100010100110110001011011001110111100111110,BPHDJIXUJCFKAB-UHFFFAOYSA-N
N4C[C@@H]3CN(CC1=NN=C(C=C1)NC(CC)C2=C(C=C(C=C2)F)F)C[C@]3(C)C4,B2C814FEA1A3D08E_72EA846A0A72192B_6041_DP,8.886929,00000000000000000000000000000000000000100010000000001000000000000110000000010101101101110011001010101100110110011011100011101100110101110110001011001111010110101111010,YJBLWTBDRLEVJB-NUOIPDLJSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(C)CCCCC2)F)CC3,FED4DCCACE0BBB10_AF1B8DD4E0AEA56C_6041_UN,7.688904,00000000000000000001000000000000000000000010000000000000000000000010000000010001101001110011010000001000000110011001101011100000110001110110001011011111010110101111010,VQHPSDYZVLPWDV-UHFFFAOYSA-N
FC1=C(C=CC=C1)C2=C[N](C(=N2)C3CCCN3)CCC4CNC(C4)(C)C,A2B9D9E96AC28477_49097172A4A7561A_6034_DP,8.063436,00000000000000000000000000000000000000100010000000000000000000100110000000110101001101010011000010001000100110011001101011100100110100100110001010011111010110101111010,OFXZQAGGFOCXHT-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2C3(C2)CCCCC3)F,8D149E1434E7A1FC_F8CF47AF64F39B09_7022_UN,7.7003245,00000000000000000000001000000000000000000010000000000000000000000010000000100000000001110011010000001000110100011001001000100000110001110000001011011111010110101111010,PKYDLIBPKSNNEQ-UHFFFAOYSA-N
N(C2=C1OCCCC1=CC(=C2)F)C(C4=CC3=C(C=C[N]3C)C=C4)=O,0708FD8DA1DA74ED_BF8572595ED376A2_6038_UN,8.37918,00000000000000000000000000000000000000000010000000000000010000000100000000010000000101010001110110100100010101100100011011100100100011110100001011011001111011111111110,BNUCFRQFGUEWKM-UHFFFAOYSA-N
N(CC1C2CCC(C1)CC2)C(C3=C(C)C4=C([NH]3)C=C(C=C4)F)=O,8C7A4A7305669E1C_B019456B361254BB_6038_UN,7.8862653,00000000000000000000000000000000000000000010000000000010000000000100000000000001001100010011100110001100010100100000011001000100110100100100001011010011011110101111110,KAMUURDYGJFIQO-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N(C=C2C3=CCNCC3)CC4=C[N](N=C4[C@H]5CC[C@@H](C)O5)C,E844A490A165A475_11EAA42D678CDEE0_6034_UN,8.3579445,00000000000000000000000000000000000000000010000000101000010000100100000000011000101101110001011111111100110110010001101011101100110010100110001011011111110111101111110,ZGSQHUBEMHIGOL-IVZQSRNASA-N
CC2=C1N=C(C=C(C1=CC=C2)C)N[C@@H]4CCN(C3CC3)[C@H]4C5=CC(=C(C=C5)F)F,281D91515CB29B63_8F8A2285D2D39F4C_6041_UN,8.899492,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101010011000010101100110100010000001011100100110001110100001011011111010010101111010,AXMPUBHUCQVRCM-QPPBQGQZSA-N
FC1=C(C=CC(=C1)NCC2N(C)CC3(CC2)CCC3)C#C,03BF8A2D7D23D13A_B64BAD4D6B5F5C99_6041_UN,7.4364157,00000000000100000100000000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011011010110101111010,XXUHCXUSMBHFCK-UHFFFAOYSA-N
CN5CCCN(CC1=C(C=C(C=C1)NC2CC3(C2)C4CCC(C3)C4)F)CC5,147D16090D80EC35_61DD9D7309B01D7B_6041_UN,7.56567,00000000000100000001000000000000000000000010000000000000000000000010000000010001100001110001010010001000110110011001101011100000110001110110001011011011010110101111010,MOVASYKHNZWOHO-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2C(C)(OCC2)C)F)CC3,15979EE98F8E459E_5922E089B3DE6411_6041_UN,7.549501,00000000000000000001000000000000000000000010000000000000010000000010000000110001101101110011010011001000000111011001101011100000110011110110011010011111110111101111110,OFZMVPHFSVXUSX-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@@H]3[C@@H]2CC[C@@H](N2)C3)F)[N]4C=CC=C4,644EFB24DF6E06F6_A0F24DAA241EA675_6041_DP,8.406935,00000000000000000000000000000000000000000010000000000110000000100100000000010001100101010011000010000000110100010000001011100100110101110100001011011011000010101111010,BWCJYTHZJJXDON-INWMFGNUSA-N
CC4=CC1=C(C=C(C=N1)NC2=CC=CC(=C2)CC3CCCN(C)C3)[NH]4,86618721E3846E75_CBC24DF92F8A7A8C_6041_UN,8.029377,00000000000000000000000000000000000000000000000000000100000000000100000000010001100101100001010010101100010010010001101011100100110101010110001001011101010110101111010,BBXPLOZIXJQIJT-UHFFFAOYSA-N
C[N]1N=C(C=C1F)NC(C2CC2)C3=CC4=C(C=C3)OCCO4,F88198B207A78467_994300F3F868A0DC_6041_UN,7.930801,00000000000000000000001000000000000000100010000000001000010000000100000010010101100100010011011010100100010101000100001011101100000011110110001011011011110011111111110,JEJWVJJGAAIYME-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC3(CCOCC3)C=C,6FAD0AA9D093DBD5_F7C40DEDD719AA4C_6041_UN,7.639875,00000000000000000000000000000000001000100000000000000000010000000110000000000100000000100010000001110100110001011000001011000100110011010110011011010111010011101111110,HEXCQTIMYZBTGU-UHFFFAOYSA-N
C(C[C@]12C[C@H]1CCC2)=CC3=C[N](C)N=C3C4=C(C=C(C=C4)F)F,8E8B1CA5CCF12DF1_DAA094029009A5C4_7019_UN,8.259888,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001011011010000110101111010,MLBIAHJAKPPFTI-KUHUBIRLSA-N
CC1=C(C=C(C(=C1)NCC2C3(COCC2)CCCC3)F)[N]4C=CC=C4,68030A9766316F50_9DEF0BB0AC5A4981_6041_UN,7.7321167,00000000000000000000000000000000000000000010000000000000010000100110000000010000001101110011000010101000010101001000001011100100110011110110001011011011010111101111110,XOSRUUOEFUGYLI-UHFFFAOYSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC3=C([N](N=C3C)C4=CC(=CC=C4)Cl)Cl,3D6A478241A93D45_96D0E1D687D358A2_7019_UN,8.5434065,00000000000000000000001000000000000000000000000000001000000000100100000000010000100100010000001010010001000100000000000011101100110001110100001010011010000110101111010,HIUQFCHJLPXWEW-KDOFPFPSSA-N
FC3CCCC(C=CC1=C([N](N=C1C)CC2=C(C=CC=C2Cl)Cl)C)C3,58F189540E992623_DD2548D1D3C7642F_7019_UN,8.531332,00000000000000000000000000000000000000000010000000001000000000000100000000010000100100010000001010011001000110010000101011101100110000100100001011011110010110101111010,WWWOQMRRXDGYNN-UHFFFAOYSA-N
C(CN1CC2CCC(C1)O2)=CC3=CC(=C(C=C3)O)SC,7AC33F5027806ED7_BE0081A9BF32392E_7019_UN,8.725045,00000000000000000001000000000000000000000000000000000000010100001000000000010000010101101000010110111000010000000100001011100001110010000111000111011010110101111111110,KGAQNSQULWWGDI-UHFFFAOYSA-N
CC(NC(=O)CC1CC2CCC1O2)C3=NC(=C[NH]3)C4=CC(=C(C=C4)Cl)Cl,2F2A5BD984A9D9E8_DF20610E61DB3D4A_6038_UN,7.956093,00000000000000000000000000000000000000100000000000000010010000100100000000000101000100010001100010000001110110110000011011000100110110100100001011010011101111111111110,KSTROGVJZBQGTB-UHFFFAOYSA-N
CC1=C(C3=C(C=C1)N=C2CCCCC2=C3NC(CC)C4CC5CCC4C5)F,E0DFD423C6B28C2F_E17847524CF21C8B_6041_UN,7.4675217,00000000000000000000000000000000000000000010000000000000000000000100000000000000100000010011000010100100110110010010001001000100110001110100001011010111000110101111010,FHLQHYSDYXZPPG-UHFFFAOYSA-N
CC1=C(C(=NO1)C2=CC=C(C=C2)F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,5E77E018BE5CCE80_3120F41F3DD03834_6041_UN,8.31046,00000000000000000000001000000000000000000010000000000000010000100100000100010101101101010011011111101010000110010000001011101100110001110110001011011111110110101111110,CXRODJLASQWOQU-HXOBKFHXSA-N
FC2=C1C=NC=CC1=CC(=C2)NCC3CCN(C(CC)C)C3,1BF258FBB4223873_A5AA5E9950306315_6041_UN,8.458854,00000000000000000000000000000000000000000010000000000000000000000100000000010000101101110011000010101100010110010011101011100100110001110110001001011101010110101111010,DODLOLXZKGUPDC-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(C)CCCC4=C3C=CC=C4)C5CCNCC5,E017F79A2F96BFD3_C13E8E354EFFB1C5_6034_UN,8.217867,00000000000000000000000000000000000000000010000000000000000000100110000000010000001101110001000010101100110110011001101011100100110000100110001011011001010110101111010,FIKVSGQDJKFRCP-UHFFFAOYSA-N
C1(=CC2=C(N=C1)[NH]C=C2C#N)NCC3C[Si](C)(CC3)C,1C6DF873143E7BB1_B8FCAA0F6EE2E3C1_6041_UN,8.393241,00000000000000000000100000000010000000100100000000000000000000000100000000100101101100100011010010101100010010001001101011000100110101010110001000011101010110101111010,IKKIBMCVUNBIJR-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC3(CC2CC2)CCCC3)F)F,20E89066A3FA5A87_54051C3DB792C450_7022_UN,8.324332,00000000000000000000001000000000000000000010000000000000000000000010000000000000001000010011000010001000000100001000001000000000110001110000000010010011010110101111010,ZFHORNQTYDSKBX-UHFFFAOYSA-N
N4CCC1=C(C=C(S1)NC2=CC(=C(C=C2)N3CCCC3)F)C4,1EC864D538D759E0_9AA17B78C8120727_6041_DP,7.664517,00000000000000000000000000000000000010000010000100000000000000100000000000010000011101111001000010101100110100010000001011100100110101110110001011011011010010100111010,ZHXXMIZEXJGIEZ-UHFFFAOYSA-N
CC1=CC(=C(C=C1)C)[C@@H]2CCCC[C@H]2OCC3CNC(CO3)(C)C,DAB9D89712F5B979_631319473D488A8F_6039_DP,8.377921,00000000000000000000000000000000000000000000000000000000010000100010000010100000001000000011000101101000100011011001101011000011110010000110010111010111110111111111110,ZNSAMLDZLMQYQU-AQCCAAQSSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)CC4(CC)CNC4,79D24C882457339C_8373A5A86B8B3983_6034_UN,8.128944,00000000100100000000000000000000000000000000000000000000010000000110000000010000101101100011000110101100110001011010101011100100110110000110001001011001010111101111110,KLENARXYKDZQOZ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCCC2CCN(C)C2)Cl)C3CC3,E4DE168CD2E9C542_3B3B7C7B84139260_7022_UN,8.049177,00000000000000000000001000000000000000000000000000000000000000100000000000010000001101110001010010001001100110010001101001100000110001110110001010011111010110101111010,QJAKFSAVZOJIFO-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)F)F)C(C34CC(C2CNC2)(C3)C4)=O,A6460DF651FC3067_8FF5382A97179E2D_6038_DP,7.914653,00000000100100000000000000000000000000000010000000000000000000100010000000000000001000110011100000001000010100101000010001000000110100100110001010000011011110100111110,CWIBSTHNBFQZCS-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC3CCC2(CC2)CC3)C=CC(=C4)Cl)C5,6E8A20181CB92FFA_E8D2AB03CDD52ACA_6034_UN,7.143934,00000000000000000000001000000000000000000000000000000000000000000110000000010000100101110000010010101101010100011001101011100100110000100110001011011000010110101111010,SKHRERXCGZIUPC-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CCC(=O)C3=C(C=CC=C3F)F,6CCD26AF05E99D54_C2937BD35E79DB73_6038_UN,7.7419167,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001000110100110000011000000000110010101000000011010011111110110111110,JSNRBBANTKIBNR-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCCN3C2CCCCC2CCC3,27CBBC46A2C4A3C1_93425DA5D02926AD_6041_UN,7.9585924,00000000000000000100100000000010000000000000000000000000000000000100000000110001001001100001010000101100110000011000001011100000110001010110011011011111010110101111010,ZMOSGJVIYLWFLD-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)Br)Br)C(C34CC(C2CNC2)(C3)C4)=O,679F8291608A98AF_044236F20F226AD1_6038_DP,7.9146476,00000000100100000000000000000000000000000000001000000000000000100010000000000000001000110011100000001000010100101000010001000000110100100110001010000011011110100111110,TWENPQNAVHKRGN-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)F)Cl)C(C34CC(C2CNC2)(C3)C4)=O,B24613276EA2F2D5_D32EFC24D2454691_6038_DP,7.9146466,00000000100100000000000000000000000000000010000000000000000000100010000000000000001000110011100000001001010100101000010001000000110100100110001010000011011110100111110,ZOHZETWCRCEGGW-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)Br)F)C(C34CC(C2CNC2)(C3)C4)=O,7E6054B64DF29B07_9B4253BE32ED09C5_6038_DP,7.91465,00000000100100000000000000000000000000000010001000000000000000100010000000000000001000110011100000001000010100101000010001000000110100100110001010000011011110100111110,AKIAGAHBSPZDFJ-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)Cl)Cl)C(C34CC(C2CNC2)(C3)C4)=O,3B580558A22CE189_ABD3C04D0BB907DF_6038_DP,7.9146466,00000000100100000000000000000000000000000000000000000000000000100010000000000000001000110011100000001001010100101000010001000000110100100110001010000011011110100111110,BAMGRCXAQKGCOL-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)Cl)F)C(C34CC(C2CNC2)(C3)C4)=O,84527B64D4932136_BCEDFD62878B0ACF_6038_DP,7.914644,00000000100100000000000000000000000000000010000000000000000000100010000000000000001000110011100000001001010100101000010001000000110100100110001010000011011110100111110,HITBNRIQCPIDSB-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)F)Br)C(C34CC(C2CNC2)(C3)C4)=O,FDC08AB0CF4D99ED_FAC6D13383C27404_6038_DP,7.9146466,00000000100100000000000000000000000000000010001000000000000000100010000000000000001000110011100000001000010100101000010001000000110100100110001010000011011110100111110,DCQFXQHIWVPJIE-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)I)Cl)C(C34CC(C2CNC2)(C3)C4)=O,925BE70FA083801C_3BD157CC8566027E_6038_DP,7.914639,00000000100100000000000000010000000000000000000000000000000000100010000000000000001000110011100000001001010100101000010001000000110100100110001010000011011110100111110,BTYCBPQURISMBB-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC4=CC=C(N3CCN(C)CC3)C=C4)C5CCNCC5,C13BA59CFAC8D188_2DB80CABCB105CF1_6034_UN,8.195934,00000000000000000000000000000000000000000010000000000000000000100100000000010001001101110001010010101100110100010001101011100100110001110110001001011001010110101111010,QXZOLHWYNSPLNL-UHFFFAOYSA-N
C[N]1C=CN=C1C(NC(=O)CC2CC3CC2C4CC34)C5=C(C=CC=C5)F,8C37798076E3A4C7_0B468C0AB17DACB8_6038_UN,8.281752,00000000000000000001001000000000000000100010000000000000000000000100000000010101000101010001110010000000110100110000010011100100110010100100001011001011001110101111110,UIOUAEMEZQHVOL-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC3N(C)CC4(CC3)CCC4,403035B55FABD396_B1512AB805295F6C_6041_UN,7.927784,00000000000100000000000000000000000000100010000000001000000000100110000000010101101101110011011010101000010110011001101011101100110001110110001011011111010110101111010,XVJPBOOOGIZSJA-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC3CCCC2(CNC2)O3)F,DD53A19FB5B6B8D5_1CE91788E4C357E5_6041_DP,7.329116,00000000100100000000000000000000000000000010000000000000010000000010000000100000001001110011010100101000010100001001001011100000110111110110001011011111110111101111110,UPYNHQXNWUCWBU-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC4=C(CN(C)C3CCCCC3)C=CC=C4,CEA4959D43B51B83_4F66C789FE01FE94_6041_UN,7.8727126,00000000000000000000000000000000000000100010000000000000000000000100000000000100001001110001010000101100010110010001101001100100110001110110011011011111010110101111010,RTLRQWDBBONGKS-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCNC23CCCC3)F)CC4,10F83BC1EB396A17_4261DE2EC6FE83AA_6041_DP,7.451842,00000000000000000001000000000000000000000010000000000110000000000010000000010001101101110011010010001000110110011001101011100000110101110110001010011011010110101111010,NCXPLJNZWQQEHN-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CC2(CCNCC2)CC3=CC=CC=C3)C(=CC(=C4)F)F)C5,5C33BDD713CAA337_7C6FC2A531A5201E_6034_UN,8.146181,00000000000000000000000000000000000000000010000000000000000000000110000000110000001101110001000010101100110100011001101011100100110000100110001011011101010110101111010,TTZMMIMSBQMAJC-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC4CCC3(CCCC3)C4,AE6A17EA903AE18F_278D840A7C49B132_6041_UN,8.194408,00000000000000000000000000000000000000000010000000001000000000000110000000010000100100010011011010000100110100011000001011101100110001110100001000011001000010101111010,QMHCEQLABDDGEP-UHFFFAOYSA-N
C2(=C1C=CN=CC1=NC=C2C#N)NCC3C[Si](C)(CC3)C,F811F7D1AE1CC924_C0499CA08C09BF9D_6041_UN,8.114198,00000000000000000000100000000010000000000100000000000000000000000100000000100001101100100011010010101100010010001001101011000100110001010110001011011111010110101111010,UOWIPVXDAMHAOR-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=C1)NCC2=CC=CC3=C2CCCN3,04C06659051B6FE1_B5C5A954887CDCDA_6041_DP,7.663901,00000000000000000000100000000010000000000000000000000000000000000000000000100000001000100011010000101100110000011000001001000100110101010110011011011111010110101111010,UIUSKEMXJMKQOB-UHFFFAOYSA-N
CN(C)CCC1=CC=C(C=C1)NCC2(CCNCC2)C3=C(C=NC=C3)F,DFA4D810837245A1_9B422199B7286D18_7022_DP,7.9238405,00000000000000000000000000000000000000000010000000000000000000100110000000100000001001110011010000101000100100011001101011100100110101110110001011011111010110101111010,CRXYPOGGNUAGKJ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCCCC3CCOCC3,DCF8298EC0C6559A_6A0C1367D5BC88BB_6041_UN,7.230106,00000000000000000000000000000000000000100000000000000000010000000100000000000100001000100010000000101100110011010000001011000100110011010110011011010111010111101111110,JABMWQDABGTYBF-UHFFFAOYSA-N
CN(CC1CCNC1)CC2=NC=C(N=C2)NCC3C4=C(CC3)C=C(C=C4)F,24FB4F46AC76F0A9_36073B3B6514D891_6041_DP,7.9843254,00000000000000000000000000000000000000100010000000000000000000000100000000000101101101110011010010101100110110010001001011100100110101110110001011011001010110101111010,GHZGNDTWEUXVJT-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OCC2=C(F)C=CN=C2)C3,069AD21EEC7FEA48_586BDA3D6420D948_6039_UN,8.043745,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010011101000010101000001001001100011110000100110001111011110110101101111110,PXRYYKURCKQUIH-CQJJVWNLSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC4C3CCOC3C45CCCC5,681CAE6CAB1B023A_8B1BB0292830D4FA_6041_UN,7.5856485,00000000000100000001000000000000000000100000000000000000010000000110000000000100000100000011000011100100010001001000001011000100110011010100011011010111110011101111110,GPNUJONKWSWVAR-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(CCCC2)C3CC3)Cl)C4CC4,58FE95764368A8F3_6F2AB3276615C040_7022_UN,7.7447033,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010011000010001001000110001000001000000000110001110000000010010011010110101111010,BVXRXBHUWZJAPN-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CCN3CCNCC3(C)C)Cl,AAEE57D1E3BD939E_EAF10D0BEBA4D101_6034_UN,8.443285,00000000000000000000000000000000000010000000000100000000000000000110000000110111011101111011000010101001101110011001101111100100110101110110011011011111010110101111010,MULPJJLRDLJFQS-UHFFFAOYSA-N
C[N]1C=C(C=N1)NC(C3CC2CCC(N2C)C3)C4=CC=C(C=C4)Cl,06101FDFF22072FB_604C1A1B6E787415_7022_UN,7.971673,00000000000000000001000000000000000000000000000000001000000000000100000000010001100101010010011010100001010110010000101011101100110001110100001001011101000010101111010,ZUNNZNGWOHYAID-UHFFFAOYSA-N
C1(=CC2=C(N=C1)[NH]C(=N2)C3CC3)NC4CCCC5=C4C=C(C)[N]5C,39714F0F3E7EC159_5D80B5418F404324_6041_UN,8.413215,00000000000000000000001000000000000000100000000000000000000000100100000000010101100101000011010010100100110010010000101011100100100101010100001011011111000010101111010,UTJOTUCQOGMLIT-UHFFFAOYSA-N
NCCCC(OC1=CC(=CC=C1)CC2CCNCC2)C3=CC=C(C=C3)F,9445A828E8768E4F_D51CEA99E9CA88DA_6035_UN,8.364683,00000000000000000000000000000000000000000010000000000000000000000000000000000000001010110011000000101000100100010100001001000111110110100110001101010001110101100111110,ZCPALQSLVFEWKS-UHFFFAOYSA-N
NC2=NC1=C(C=C(C(=C1)F)F)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,9B1A855852A34D22_DF3E7012EB433C15_6034_UN,7.91616,00000000000100000000000001000000000000000010000000000000000000000110000000110101000111010010000010001100011110001000101011100100110001110100001011011111010110101111010,GADGBWNDGJNOSZ-DVRYWGNFSA-N
NC2=NC1=C(C=C(C(=C1)Br)F)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,7CF78BEC763366C8_8CFDB3D8C19717C4_6034_UN,7.916147,00000000000100000000000001000000000000000010001000000000000000000110000000110101000111010010000010001100011110001000101011100100110001110100001011011111010110101111010,NXJBIFRBVCYYNC-DVRYWGNFSA-N
NC2=NC1=C(C=C(C(=C1)F)Cl)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,BCEC602BCB12E364_98213ECE14CE5D90_6034_UN,7.9161434,00000000000100000000000001000000000000000010000000000000000000000110000000110101000111010010000010001101011110001000101011100100110001110100001011011111010110101111010,WSENEUNHKOVHNK-DVRYWGNFSA-N
O[C@@H](CCl)C1=CC=C(C=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,40BA1A80E51DFC1D_00617C3307AD7AC0_6041_UN,8.95222,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101100001011110101001100011010001101011101100110111110111001001011111110111111111110,UWBKTIOXJCREEP-BZSNNMDCSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCCC3=CC(=C(C=C3)Cl)Cl,3E1DA5C784790E83_298A7C0CA679C4DE_6038_UN,7.9460573,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010011100000011001110100110000011000000000110010100000000011010011011110100111110,YKGMHARSXTUOGN-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCCC3=CC(=C(C=C3)F)F,698E42D32A4F9799_B5761E911005E84D_6038_UN,7.946045,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,DGNPYZUXZPAYFK-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C[N]2C=C(C=N2)NCC3(CCCC(C)C3)N(C)C)F,B67E0DC762D6E1C7_27EF8580233914B0_6041_UN,8.229493,00000000000000000000000000000000000000000010000000001000000000000110000000110001101101110011011010001000000110011001101011101100110001110110011011011111010110101111010,SLAKCFNUXKNQCF-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(C3=C(C)C4=C([NH]3)C=C(C=C4F)F)=O,B108A166D4D7AB6A_C45F0C74935F772F_6038_UN,8.20602,00000000000000000000000000000000000000000010000000000010000000000100000000000001001100010011100110011100010100100000011001000100110100100100001011010011011110101111110,UOROXMXCTXLCDY-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CO2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,DD14920B4DCAE48A_C2EF06F940C1E573_6041_UN,8.336619,00000000000000000000000000000000000000000010000000000000010000000000000000000000100101110010010110001100010110010001101000100100110001110100001011011011110110101111110,SZHYLWUTWDMRDY-UHFFFAOYSA-N
C2(=C1OCCCC1=CC(=C2)CC#N)NC3=CC=[N](C=C3)=O,8F24DAFBBBDA8A3B_8A6141FD75F74AE0_6041_UN,8.248562,00000000000001000000000010000000000000000100000001000000010000000100000100010000100000000001001100100110010001010100001011101101100011010100001111011001110111110111110,LFPDXIYNOWMPCT-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)N[C@H]4[C@H](C3=C(C)[N](N=C3)C)C4,C7026A9221957FFB_E84003C150DCFFA5_7022_UN,8.483536,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010010011010000000100110010000000011101100000001110100001010011111000010101111010,CQYBYIAJPGGTCB-SUMWQHHRSA-N
CC1=C(C(=CC(=C1)Br)C)NCC2=NC=CN2C[C@H]3NCC4(C3)CC4,580781B22F12AA6E_464AE6D0FA3D5A11_6034_UN,7.8511715,00000000000000000000001000000000000000100000001000000000000000000110000000010101001101010011000010001000110110011000000011100100110101110110001010011111010110101111010,OQLFLSZIONTUEA-INIZCTEOSA-N
N1C4CCC1CC(C=CC2=C[N](C)N=C2C3=C(C=CC=C3)Cl)C4,A7F497CDF20CA960_A9EAFC85AC4670E9_7019_DP,7.6686964,00000000000000000001000000000000000000000000000000001000000000100100000000010000100100010011011010110001110100010000001011101100110000100100001011011011000010101111010,RBRACMZLJVAUCF-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCCC3N4CCOCC4,A2E480005711A553_72524ECE467E26DE_6041_UN,7.834246,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110011011110101100010101010000001011101100110011110110001001011011010111101111110,IWXANDHHFHXNSJ-UHFFFAOYSA-N
COC(OC)C(OCC3CCC1(CCC2(CC1)OCCO2)O3)C4=CC(=C(C=C4)F)F,359342E57609ED85_368A8CDE35474F67_6039_UN,7.6711025,00000000000000000000000000000000000000000010000000000000010000000010000010000000000100010000010010000000010101001000001010010010110010100110100011110110110101011011110,INHPZDTWXKBQQA-UHFFFAOYSA-N
CC2=C(C=C1N=C(C(=CC1=C2)C)NC3CCOCC3OCC)C,8E3FC3128DB1C85F_1E63C1D071A3F30E_6041_UN,8.163715,00000000000000000000000000000000000000100000000000000000010000000100000010000100000000100011000101100100110011010010001011000111110011010110011111010111110111111111110,BLJKGLDCVQTRHP-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC23CCNC2CCCC3)F)CC4,864160BA9D103CAC_1C10E30FC66784F5_6041_DP,7.643272,00000000000000000001000000000000000000000010000000000110000000000010000000010001101101110011010010001100110110011001101011100000110101110110001011011011010110101111010,FPMCEJCWPLCSTN-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NCC3C(CCN3)C4CC4,335CF491AC304E4C_D486783B94260CC6_6041_DP,8.3200655,00000000000000000000001000000000000000000010000000000010000000100100000000100001101100010011000010101100110100010000001011000100110101110110011011010111010110101111010,GSBLDBRBZQVFSS-UHFFFAOYSA-N
NC[C@@H](OCC1OCCC12CCNCC2)C3=CC=C(C=C3)F,069905347B68C30B_A35531A28ED71F64_6039_DP,8.075469,00000000000000000000000000000000000000000010000000000000010000000010000010000000001110110001000110101000110101011000001011000010110110100110001001010001110101110111110,IVCJOSIWLJPBCR-AAFJCEBUSA-N
CC1=C(C=C(C(=C1)NC3CCN(CC2CCCO2)CC3)Cl)C4CC4,B981D10B7E31665B_3CEDBCE6AE5D8F14_7022_UN,7.557813,00000000000000000000001000000000000000000000000000000000010000100000000000010000100101110010000110101001100111010000001011100000110011110110001011011011110111101111110,OGRQZUDAJFIKQC-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3CCN(C)C34CCCNC4,79095B3B65DA5857_0554A74CA83CA549_6041_DP,8.037756,00000000000000000000000000000000000000000010000000001100000000000110000000010001101101110011011010101100110110011001101011101100110101110110001001011101010010101111010,SYQLTHQZLOJCHW-UHFFFAOYSA-N
C[N]1N=C(C=C1N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)C4CCCC4,96F53C3493C59A13_F7108F79B24A52A4_6041_DP,8.903662,00000000000000000000000000000000000000100010000000001010000000100100000000010101101100110011011010101000100100010000001011101100110101110110001011011011010010101111010,KZJSZJKBPNLRFR-DNVCBOLYSA-N
FC2=C(C=C1C(=CN(C1=C2)C[C@@H]3CC(C)(CN3)C)CC#N)F,BEBDF4EE19326380_3DB02111DD328A12_6034_UN,8.3761,00000000000000000000000000000000000000000110000000000000000000000110000000110001001101010011000010001100110110011001000011100100110000100110001010001111010110101111010,CXRIYKIFUAEVAZ-LBPRGKRZSA-N
C1(=C(C=CC=C1F)F)NC34CC2CC(CC(C)(C2)C3)(C4)C,B06A71BA725B890A_6BEA3C7DBAAC6E3E_7022_UN,7.907504,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010001000000000100110110011001000000000000100001110000000011000111000010101111010,HAHZQCLIIVWXSX-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(CC)CCCC2)Cl)C3CC3,58D3F13FF4232B77_38F727CBDDDBC409_7022_UN,7.462409,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010011000010001001000110001010101000000000110001110000000010010111010110101111010,PGHRRENCSHHARN-UHFFFAOYSA-N
C1(=C(C=CC=C1F)Br)NC34CC2CC(CC(C)(C2)C3)(C4)C,F1C833B9910B9F31_A3EF281D0116E3BB_7022_UN,7.9074974,00000000000000000000000000000000000000000010001000000000000000000010000000000000000000010001000000000100110110011001000000000000100001110000000011000111000010101111010,MGWKHARYISWXNI-UHFFFAOYSA-N
CC1=CC=C(C#N)N1C[C@H]2[C@@H](CNC2)C3=CC(=CC=C3)F,B4F767E0C47C20C4_EF73C47B5922EC76_6034_UN,7.7889132,00000000000000000000000000000000000000000110000000000000000000100100000000010001101101110011000010001000000100000000100011100100110000100110001010001011010110101111010,KJZVBYZZTYVEEI-YOEHRIQHSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,82D6BB420647B401_59B8C0D275A9F74F_6041_UN,8.124048,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101100010111010001101011101100110011110110011011011111110111101111110,NZNCCOCOWBBIEG-ICSRJNTNSA-N
CCN1C(CC2=C1C=C(C=C2)F)C3=NC=CN3CC5[C@@H]4C[C@@H](C4(C)C)CC5,DDA558B1A8098FA0_6FA4253CF34915BD_6034_UN,8.195343,00000000000100000000000000000000000000100010000000000000000000100110000000110101000101010000000010001100010110011010101011100100110000110110011011011110010110101111010,AXVGVEKMTYCNRP-JTEYQQGYSA-N
CN5CCC1=C(C4=C(N1CC3CCC2(CCCC2)CN3)C=CC(=C4)Cl)C5,5E11F2AB36428E42_79F401949428A3B9_6034_UN,6.881464,00000000000000000000000000000000000000000000000000000000000000000110000000010001101101110011010010101101110100011001101011100100110000100110001011011001010110101111010,QYVACGRDDWQBBR-UHFFFAOYSA-N
CC1=CC=C(C=C1)C2=NC(=C(Cl)N2C[C@H]4[C@H]3CNC[C@H]3OC4)C#N,4F41D9E3D4C24484_1E096A8BC701FDD2_6034_UN,7.50131,00000000000000000000000000000000000000100100000000000000010000100100000000010101101101110001000111001101010101000000000011100100110010100110001010001011110111101111110,NOLHYMWNJNPNFX-IIAWOOMASA-N
C1(=NC2=C(C=C1)CCC2)NC3=CC=C(CO[Si](C)(C)C)C=C3,E3214C1C8E2B25C9_CB29C7D58B8C139C_6041_UN,7.679783,00000000000000000000100000000010000000100000000000000000000000000100000000100100000000100001010010100110010001011000101001001110010001010100011011011101010111101111110,ZDYHYANWYUEDIY-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC2CC3(CN2)CCC3,221719F28B4B3E84_02720065AFEB99C3_6041_DP,7.484768,00000000000100000000000000000000000000000110000000000010000000000010000000000001001100010011000010001000110110011000001001000000110101110110001010010011010110101111010,MBPJIVACYGSOFN-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)C3=NC2=C(C=CC=C2)N3CC4C5(CNC4)CCC5,3B8F99F3811A841A_CC466784B12FA66A_6034_UN,8.025572,00000000000100000000000000000000000000100010000000000000000000100110000000010101101101110011000010001100010100001000001011100100110000100110001011011011010110101111010,KKQKUHRQOKNGGV-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CCC3)C4=C(C=CC=N4)F,E5169DB51D908F4D_50BA8C1D83B0E117_6041_UN,7.980665,00000000000100000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,LUBYFDKGJJZUII-KRWDZBQOSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC3=CC=C(C2OCCNC2)C=C3,2F743C8918911601_C131B3B550FA20FC_6041_DP,8.034199,00000000000000000000100000000010000000000000000000000000010000100100000000100001001000100001010100101000100001011000001011000100110111010110011011011111110011101111110,KTXWSVWUAAWGIG-UHFFFAOYSA-N
CN(CC1CNC1)C2=NC(=CN=C2)N[C@H]3[C@H](CC3)C4=C(C=C(C=C4)F)F,C8600C00718770C2_416D414CF68E0492_6041_DP,8.121547,00000000100100000000000000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010001001011100100100101110110001011011011010110101111010,GVFIBJDFMSTECN-NVXWUHKLSA-N
CN4C[C@@H]3CC[C@H](OC1=C(C=CC(=C1)C2CNCCC2)F)[C@@H]3C4,A617D0373A9FDDD1_FDEA73F4D909BFD8_6035_UN,8.33436,00000000000000000000000000000000000000000010000000000000000000100000000000010000001101110011010011101100110110010101001011100011110010100110001111011011110001101111110,VGJCSXOSIGLWBS-MMNRESRNSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(C)COCCN3CC4=CC=CC=C4)C5CCNCC5,61EF41FD097856AD_499CDBA876E211EC_6034_UN,8.374252,00000000000000000000000000000000000000000010000000000000010000100110000000010001001101110001000111101100110111011001101011100100110010100110001001011011010111101111110,JUGANPQIFLXVFR-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1C[C@H]3[C@H]2CNC[C@H]2C3)C=CC(=C4)Br)C5,2AC1EB232118075F_C0C86E8E0A4322CA_6034_UN,8.073513,00000000000100000001000000000000000000000000001000000000000000000110000000110000001101110011000010001100010100011001101011100100110000100110001011011101010110101111010,WUGOKRWDWRSMQR-GLJUWKHASA-N
C1(=CC2=C(N=C1)[NH]C=C2C3CCC3)N[C@@H](CC)C4=CC(=C(C=C4)C)F,AA779D0BA86BA7D2_3C5BF7DEC3EF31D9_6041_UN,8.219087,00000000000100000000000000000000000000100010000000000000000000100100000000000101000100010001000010100100110100010010001011000100000101110100001011010111000110101111010,PGWNEXFGNRVWNH-FQEVSTJZSA-N
N(CC1C2CCC(C1)C=C2)C(=O)C3CC(F)(C3)C4=CC=C(C=C4)F,F8CF3767EF2C6774_FE65FDE5646DFAC1_6038_UN,7.4343467,00000000000100000000000000000000000000000010000000000000000000100010000000000000001000010011100000011000010100101000011000000000110000100000000001010001011110100111110,DVXMMTZRLCOBCQ-UHFFFAOYSA-N
C[N]1N=C(C=C1NCC(N2CCOCC2)C3=CC=C(C=C3)F)C4CCCC4,370E2D6A611DF1A8_0E1AADEF6D6DA82D_6041_UN,8.028283,00000000000000000000000000000000000000100010000000001000010000100100000000010101101101110001011110101000000111010000001011101100110011110110001011011011010111101111110,FPJSKYOUPMDXIP-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCC3=C(C=CC=C3F)F,04A7FC35C3FA94DD_A0F4DB5D4211FBC4_6038_UN,7.6454453,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,GHIKQHQWXWEECW-UHFFFAOYSA-N
FC1=C(C=CC(=C1)N[C@@H]2[C@@H](N(C)C)CCC2)OC3CCOCC3,D82B3E28214D778B_ED256BD201861D97_6041_UN,7.356571,00000000000000000000000000000000000000000010000000000000010000000000000000100001000001110111010010100000100111010100101000100011110011110110001111011111110011111111110,LJESMZDTPYXIND-IRXDYDNUSA-N
CN(C)CC1=C(C=CC(=C1)O[C@@H]2C[C@H]3C[C@@H]2CC34OCCO4)F,EC440D38A4E11D41_875015D832BD1067_7022_UN,7.5788765,00000000000000000000000000000000000000000010000000000000010000000000000010100000000101110000010010001000010101001101001010110011110010100110000111111110110101111111110,ZJKJAUCWKGVFHJ-SUYBPPKGSA-N
C2(=C1C=C(OC1=CC=N2)C#N)NC3=CC4=C(C=C3)[S](CCC4)(=O)=O,665F3BDA352EB697_CE20906C99CB64D0_6041_UN,8.206614,00000000000000000000000000000000000010100100000000010001011111000101000001000100010100001001000111100110010000001000001011001101101011011100001111111001110010110111110,DYCMDGUTZGBIPI-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3[C@H]2CCCO[C@H]2C3)F)CC4,B5C068FF81F7AC3A_3B39BEF64025124F_6041_UN,7.4044843,00000000000100000001000000000000000000000010000000000000010000000000000000010001100001110011010001101100110111010001101011100000110011110110001011011011110111101111110,KPEINDHGOHGWMV-BPYOIECJSA-N
N(CCC1=C[NH]C2=C1C=CC(=C2)F)C(C34CCC(C)(C3)CO4)=O,C8CB67DC3EFBBE48_3264837800BCF3B1_6038_UN,8.322344,00000000000000000000000000000000000000000010000000000000010000000110000010000000001100010011100110101100110111111001111011000100110110100110001001010001111111111111110,YOTWQWGCYKXLOW-UHFFFAOYSA-N
CC4(C)CCC1=C(C=CC(=C1)N[C@@H]2CCN(C)[C@H]2C3=CC(=C(C=C3)F)F)O4,83AB7FE09027D4B1_D8DA86C62756AB9C_6041_UN,8.478057,00000000000000000000000000000000000000000010000000000000010000100010000000110001100101110011010010101100110110011101101011100100000011110100011011011111110011101111110,FFRXHJFUQZWVRV-CTNGQTDRSA-N
CCC2=C1N(C=C(C1=CC=C2)C3CCNCC3)CC5CCCN(CC4=CC=C(C=C4)I)C5,96128CF557E3329E_E059839D4510D46D_6034_UN,8.443814,00000000000000000000000000010000000000000000000000000000000000100100000000010000101101110001000010101100110100010010001011100100110000100110001001011001010110101111010,JBPFNEPUENXZFI-UHFFFAOYSA-N
O=[N](=O)C2=C1C(=CN=CC1=CC=C2)NC4=C3OCCCC3=CC(=C4)F,11D08A47D6243B28_02D63705ACB18F06_6041_UN,8.311447,00000000000000000000000010000000000000000010000001000000110000010100001100000001100000010001001100100110010101000100001111101100101011110100001011111001110011110111110,MVDAWQKDFPMUEO-UHFFFAOYSA-N
O(C1CCCC12CCOCC2)CCN3C(C)(COCC3)C,543830034AD5F17F_FF15048A88825495_6039_UN,7.2780056,00000000000000000000000000000000000000000000000000000000010000000010000000110000000001100000000110101000010011011001101011100011110010000110000101111110110111111101110,SEIPVXXBSGWCAL-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCCOC3CCOCC3,21A3179EB78F6902_2F8A0560FA39680F_6041_UN,7.769057,00000000000000000000000000000000000000100000000000000000010000000100000000000100001000100100000100101100110011010000001011000111110011010110011111010111110111111111110,INHZQVRLFDSAKI-UHFFFAOYSA-N
C[N]1N=C(N=C1NC2CCCC(C2)C3=CC=C(C=C3)F)C4CCOCC4,447D5139C945FEDF_C658AFDFE2CC3AD3_6041_UN,7.917769,00000000000000000000000001000000000000100010000000001000010000100100000000010101100100110011011010100000101101010000001011101100110011110110001011011011010011101111110,FEUWRDHYZUOGEC-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CCOC(C2=CN=C[N]2C)C3)F)CC4,1BC6B9637F506E3A_187BC2E4086C13E1_6041_UN,7.474777,00000000000000000001000000000000000000000010000000000000010000100100000000010101100101110010010111101000100111010001101011100100110011110110001011011111110111101111110,ZBNDRQJNMUGMQZ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2C3=C(COC2)C=CC=C3)F)CC4,A2A967C66E23B807_FA94941BF0F7D226_6041_UN,7.5365186,00000000000000000001000000000000000000000010000000000000010000000000000000010001101001110010010001101100010111010001101011100100110001110110001011011011010111101111110,RSQJKUFZWROZKC-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)F)NC2CN(C)C3(C2)CCOCC3)F,866AD44DEF0F2CA8_ECECB3C7B6B4A571_7022_UN,7.2796946,00000000000000000000000000000000000000000010000000000000010000000010000000010001100101110001010011101000110111011001101011100000110011110110001011011111010011101111110,HVTFYJZNVAZZOG-UHFFFAOYSA-N
FC1=C(C=C[N]2C=CN=C12)NCC34OC(C)(C)C(C3)C4,8B028713B7F9494D_23A44DB847ECA874_6041_UN,7.500669,00000000000100000000000000000000000000100010000000000000010000000110000000100101101101010010000110101100010110001000100011100100100011110100001010001111110111101111110,ALDFHDAGUBTCPT-UHFFFAOYSA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=N3)CCC4CCCCN4C,5820F81C0D44C32A_810B4AE854AE3F92_6034_UN,7.4758444,00000000000000000000000000000000000000100000000000000000000000100100000000010100101101100011010010101100110010010001101011100100110000000110001001011011010110101111010,RKCGQAOINYIFTK-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)N[C@H]2CO[C@H]3CNC[C@@H]23)F,E78DB6548A371CF1_1533E3499AD5DD4E_7022_DP,7.735576,00000000000000000000000000000000000000000010000000000100010000000000000000100000101101110011010111001100110101010001000011100000110111110110001010001111110111101111110,GFHPDBOKKVXWGW-QEJZJMRPSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC5CCCN(C4=C(C=CC(=C4)C)F)C5,A0682741D991B857_3E194D5EA6C807C6_6041_DP,8.157633,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101110011010010101000110110010000001011100100110101110110001011011111010010101111010,WRMPKIUBQNJJED-JNEVZFNKSA-N
FC1=C(C=CC(=C1)C2CC2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4,48B02FAA9F2AD4F2_4D0B981A06EE512B_6041_UN,8.254314,00000000000000000000001000000000000000000010000000000000000000100000000000010000101001110011010000101000000110010001101001100100110001110110001011011011010110101111010,HEUYJYFHRUHKFL-UGKGYDQZSA-N
CC1=C(C4=C(N1CC3CCCN(CC2=C(C=CC(=C2)F)F)C3)C=CC=C4)C5CCNCC5,B21DEC85705EE828_A6617087252828DD_6034_UN,8.441807,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110001000010101100110110010000101011100100110000100110001011011011010110101111010,VJVMLYLDEPGBJE-UHFFFAOYSA-N
CC1=C(C3=C([N]1CC[C@@H]2CCNC[C@@H]2C=C)C=CC=C3Br)C,5E7A9B3240D3DBC0_B20EE6BA8734C8B4_6034_DP,8.69667,00000000000000000000000000000000001000000000001000000000000000000100000000010000001101110001000010111100110110010000101011100100110000100110001011011111010110101111010,XCFJIJMTNSVMRW-HOTGVXAUSA-N
CN(C)CC1=CN(C2=C1C=CC(=C2)F)CC3C4(CNC3)CCOCC4,AC8E1B3CC979E10B_64DE2E41ECEBD11D_6034_UN,7.299024,00000000000000000000000000000000000000000010000000000000010000000110000000110000101101110011010010101100010101001001001011100100110010100110001001011101010111101111110,AHELSVUQOVLQAI-UHFFFAOYSA-N
CN4CCN(CC1=C(C=CC=C1)NCC23CCCCC2C3(F)F)CC4,F72F3033C457C6C0_9EA7681F5725BEA5_7022_UN,7.774226,00000000000000000001001000000000000000000010000000000000000000000010000000010001101001110011010000101000010100011001101011100000110001110110001011011011010110101111010,XFDLEZUCPAUGJQ-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC3CCCC2(CCC2)C3)F,AE31D75DD5204AAA_A38592453B39E2F6_6041_UN,7.6706133,00000000000100000000000000000000000000000010000000000000000000000010000000100000000001110011010000001000110100011001001000100000110001110000001011011111010110101111010,BYBJLTWZCONVHY-UHFFFAOYSA-N
C1(=CC(=CC=C1)CN2CCCCC2)NC3=C[N](C[Si](C)(C)C)N=C3,F58567F63E560452_AFBD9FFD7F1468C4_6041_UN,7.406709,00000000000000000000100000001010000000000000000000001000000000000100000000110001100101100001011010101000000000011001001011101100110001010110011001011101010110101111010,PXMUDMVFXCRCLG-UHFFFAOYSA-N
N(C1=CC(=CC=C1)C2=CC(=C(C=C2)F)F)C([C@@H]3CC(CN3)C45CC(C4)C5)=O,7A9153608AE1AB74_389CBFFB65E7F711_6038_DP,7.553689,00000000000100000000000000000000000000000010000000000010000000100010000000000001001100010011100110001000110100111000010001000100010101110100001011000011011010100111110,RFODBCDYSKREDR-FDJFBYMISA-N
C1(=CN=C(C=C1)SC2CCOCC2)NC3=C[N](C[Si](C)(C)C)N=C3,DA19DC3DB9156A00_8690F6D0C2E5C6D0_6041_UN,7.378756,00000000000000000000100000001010000000000000000100001000010100001100000000110001110100101001011010101000000001011001001011101100110011010110011001011101010111101111110,IXKRRRGQHOZALN-UHFFFAOYSA-N
N(C1=CC(=CC=C1)C2=CC(=C(C=C2)Cl)Cl)C([C@@H]3CC(CN3)C45CC(C4)C5)=O,9E52A7FDAC6B09E1_4627E6E347DD946E_6038_DP,7.553675,00000000000100000000000000000000000000000000000000000010000000100010000000000001001100010011100110001001110100111000010001000100010101110100001011000011011010100111110,QDPCGUDAYCBMEV-FDJFBYMISA-N
C1(=CC=C(C=C1)C2OCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,15D12FF2D9F8C9BF_61DDB6446ED3FEC9_6041_UN,7.892451,00000000000000000000000000000000000000000010000000000000010000100000000010010001100101110011010010001000100111010001101011110100000011110110001001011011010011111111110,HDZKDUVBCGZAAU-MOPGFXCFSA-N
FC1=C(C2=C(C=C1)SC=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,25AF90BAB1C50F98_522EC528B5AC720C_6041_UN,8.214506,00000000000000000000000000000000000010000010000000000000000000000000000000000000110101111010010010001100010110010001101000100100110001110100001011011011010110101111010,RARAOHXTFQSEHD-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC2(CCNC2)C3CC3,F7D3F3EEB2A99F38_EF9B2A96E9A13117_6041_DP,8.172379,00000000000000000000001000000000000000000110000000000100000000100010000000000000101100110011000010001000100110011000001001000000110101110110001010010011010110101111010,QDULBLPFNFWXGC-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(C)CCCOC3)C4=CCNCC4,EF6250F7DAECBB6A_F62267574CFF63EB_6034_UN,8.446764,00000000000000000000000000000000000000000010000000100000010000100110000000011000001101110001000011111100110111011001101011100100110010100110001001011001010111101111110,REQFSXIFVGYBQF-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3C(C(C)C)OCCC3,81DBE054CC682940_C786643EEEC47E35_6041_UN,8.117854,00000000000000000000000000000000000000000010000000001000010000000100000000110000101100010011011011101100010111000000001011101100110011110110011001011111110111101111110,LBOHLUGSQIQPRW-UHFFFAOYSA-N
FC2=C1C=CC=CC1=C(C=C2)NC3CCN(C)C34CCCNC4,F30F910E92A8D59A_6557CCAF641CED12_6041_DP,8.298109,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,NWKZPOZXVQSPAA-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,8D275710C894B9A9_41D32D191C4137C7_6041_DP,7.9492106,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101000100110010000001011100100110101110110001011011011010110101111010,MPVHQAIXDUKFNP-FTLRAWMYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2C3(CCC2)CCC3)F,51195E164DDDECC3_325EA1A7C9A114AC_7022_UN,7.5740643,00000000000100000000000000000000000000000010000000000000000000000010000000100000001001110011010010001000010100001001001000100000110001110010001010011111010110101111010,BYQSJPKDQXKVDK-UHFFFAOYSA-N
CC1=N[N](C(=C1)C)CC2=CC=C(C=C2)NC3C4CC5CC3CC(C4)(F)C5,7674B82E8907ECF0_51942DEFF7CED57A_6041_UN,7.7956877,00000000000000000000000000000000000000000010000000001000000000000110000000010000100100010010001010001100010110011000100011101100100001110100001011001111010110101111010,FAZKVQZEMNUQKJ-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)N[C@H]4C6=C(OC5(C4)CCCC5)C=CC(=C6)F,5139CB03EE60D590_1CC070F9AA2C006A_6041_DP,8.18191,00000000000000000001000000000000000000100010000000000000010000000110000000000101100101010011010011100100110100011100101011100100110111110100001011011001100011101111110,ORXRBTWDHRAJDL-RCLSDMTESA-N
C1(=C(C2=C(C=C1)C=CC=C2)F)NCC4(N3CCN(C)CC3)CCCCCC4,8AB647E3BD99036F_D8D5FE2AC855749E_7022_UN,7.8459506,00000000000000000001000000000000000000000010000000000000000000100010000000010001001001110011010000101100010100011001101011100100110001110110001011011011010110101111010,GDIZBTBHVSBLLU-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)F)NC2C3(C(N(C)C)C2)CCC3)F,C710A6B968728FD0_B79AA68DC2A4D7F7_7022_UN,7.7236557,00000000000100000000000000000000000000000010000000000000000000000010000000100000100001110011010000000000110110011000101000100000110001110000011010011111000010101111010,FPMHCVHSMCJDNI-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC3(CC)CNC3)C4=CCNCC4,A952CBB1D404EFD6_EE617BCDFBBD9B0A_6034_UN,8.131821,00000000100100000000000000000000000000000000000000100000000000100110000000011000101101100011000010111100110000011010101011100100110100000110001001011101010110101111010,DWJNBFRGMKSPOH-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NC2=CC=C(C=C2)C3CCOCC3)F)C4,6656CEA02419ADBD_4335240051B9DFB1_6041_UN,7.2969556,00000000000000000000000000000000000000000010000000000000010000100000000000010000000001110001000000101100010111010010101011100100110011110110001011011001010111101111110,ZCKICDACBMZENS-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CC3(CCC2)CCCC3)Cl)C4CC4,B271692B0E1D75DD_D51689D36B1A54A6_7022_UN,7.5047398,00000000000000000000001000000000000000000000000000000000000000100010000000000000000000010011000010000001110110011000001000000000110001110000000011010011000010101111010,WBTVQHOVXZTCGW-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NCC4(CC4)C5=C(C=CC=C5F)F,1CC9EDECFC91D8A7_F81D2CD09C3F780C_6041_DP,8.145041,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000010110001000000011100100110101110110001011011011010110101111010,RPNJIWATEUAZFV-ZHZUQJFRSA-N
C([C@]12C[C@H]1COC23CCC3)=CC4=C[N](C)N=C4C5=C(C=CC=C5)Cl,51758D3661DCB7DF_FBCB45F3B190A16A_7019_UN,7.3816123,00000000000100000000001000000000000000000000000000001000010000100110000000010000100100010000011010110001010101001000001011101100110010100100001011011010110011101111110,XHRLVEYCVAPJKS-KXBFYZLASA-N
CN1CCCC1C2=CC=C(C=C2)NCC34CC(CNC3)(F)C4,6ABBCC6E8676F918_CCFAC76F1A88718C_6041_DP,7.5392985,00000000000100000000000000000000000000000010000000000100000000100010000000010000101101110010010010101000010110011001101011100000110101110110001001011011010110101111010,KWIPIGDCEXIXJY-UHFFFAOYSA-N
FC1=CC(=CC=C1)C2=C[N](C(=N2)C3NCCCC3)CC4[C@@H]5CNC[C@H]45,700D637E0703F078_772E8A5F3B2C3B67_6034_DP,8.828535,00000000000000000000001000000000000000100010000000000000000000100100000000010101001101110011000010101000110100010000001011100100110100100110001011011011010110100111010,SORVFUVCIXHYSK-OQSMONGASA-N
FC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCCC3)CC4[C@@H]5CNC[C@H]45,700D637E0703F078_8DA3975F93B8A1A0_6034_UN,8.828533,00000000000000000000001000000000000000100010000000000000000000100100000000010101001101110011000010101000110100010000001011100100110100100110001011011011010110100111010,SORVFUVCIXHYSK-OQSMONGASA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3(CC3)C4C5=C(CCC4)C=CC=C5,0F8FC6E963F90BFA_2C3A0F769028AFAD_6041_UN,8.115592,00000000000000000000001001000000000000000010000000000000000000100110000000010101000101010011010010000100111100011000001011100100110001110100001011011011000010101111010,UFYNESSCOMAVJU-UHFFFAOYSA-N
CC1=C(N(C(=N1)C2NCCC2)C[C@H]3C[C@H](F)CN3CC4=CC=CC=C4)C,D317B2C8FE5D659F_AD6FC9419182259A_6034_UN,8.473929,00000000000000000000000000000000000000100010000000000000000000100100000000010101001101110011000010001000100110010000101011100100110000100110001010011111010110101111010,ZKHDLOWCWACZSX-ABZYKWASSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC3CNCC4(C3)CCOCC4,54862588D02B7119_39AF1E193045E2E9_6041_DP,7.364296,00000000000000000000000000000000000000100000000000001010010000100110000000010101101101100011011010101000110001011000001011101100110111010110001011011111010011101111110,BVSCMCXZQAFWPL-UHFFFAOYSA-N
FC1=C(C=CC(=C1)NC[C@@H]2COC[C@H]2N(C)C)OC3CCOCC3,9666652A6CC57D73_CF44575208FBB5DE_6041_UN,7.6500554,00000000000000000000000000000000000000000010000000000000010000000000000000100000101101110111010111101000000111010100101010100011110011110110001111111111110111111111110,YKZALJWWDWOPAU-CXAGYDPISA-N
CN4CCCN(CC1=C(C=C(C=C1)NC(C2CC2)C3CCCOC3)F)CC4,E6C97ECFBF9FCE7A_3FB66F9FC11ADB56_6041_UN,7.602458,00000000000000000001001000000000000000000010000000000000010000000000000000010001100001110011010001101000000111010001101011100000110011110110001011011011010111101111110,GMRZXYBIMPEPGP-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC23CC(OC2)CCC3)Cl)C4CC4,0F1C44152F17EF31_922D5AA0E97F5F6A_7022_UN,7.2545986,00000000000000000001001000000000000000000000000000000000010000100010000000000000000100010011000111000001110111011000001000000000110011110100000011010011110011101111110,JVIJZWUMFAFSKY-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(CCCCC2)OC3CCCC3)F)[N]4C=CC=C4,5CEA631ABE26D235_A15E3F178F63C3AF_6041_UN,7.8739247,00000000000000000000000000000000000000000010000000000000000000100110000000010000001101010011000110001000000100001000001001100111110011110100001111011011110111101111110,QEUQMBWLZFJANX-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)OCCC2)[S](C4=C3[NH]C=CC3=C(C)C=C4)(=O)=O,43BF2B4684DB0186_844A74D26AA0A658_6029_UN,8.731559,00000000000000000000000000000000110000000000000000010101011111001101010001000000110100001001001011100110011001001100011011001100101111011100001011111001110011111111110,DCXYJLRYRGKZGF-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[NH]C=C2C3CC3)NC4=C(C=C(C=C4)F)C5CC5,C8EB87E18BB6E3FA_1E0C1650FDF0556E_6041_UN,8.534458,00000000000000000000001000000000000000000010000000000000000000100100000000000000000100010001000010000100010100000000001001000100000101110100001011010011000010100111010,YDJMRHVSODYDJL-UHFFFAOYSA-N
N(CCC1=CC2=C(C=C1)COC2)[S](C4=CC3=C([NH]C=C3)C=C4)(=O)=O,4D678AC54EF48524_51CBB9EAD8F26C0E_6029_DP,8.793229,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100101000001010001110111001011000011011001100111100001110001011111001010111110111110,LVRRVSCJGSXYKW-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)N[C@H]4C6=C(OC5(C4)CCCC5)C=CC(=C6)F,41E5B6E52D2DE17E_04E51D71854E47F1_6041_DP,8.143902,00000000000000000001000001000000000000100010000000000000010000000110000000000100100101010011010011100100111100011100101011100100110111110100001011011001100011101111110,QBBLLQCEAQWXET-RCLSDMTESA-N
CN(CC1=NN=C(C=C1)NC2=C(C=CC(=C2)C)F)[C@H]3C[C@@H]4CC[C@H](C3)N4,F770DFABBF9D2319_36DD0E73C879B0B4_6041_DP,7.5461183,00000000000000000001000000000000000000100010000000001000000000000100000000000101100101110011011010101000110100010001101011101100110101110100001011011111010110101111010,VRNORJLXVFKXIR-SCAQPMJSSA-N
FC1=C(C2=C(C=C1)C=CO2)NC[CH]4C[C]3(C[C](C)(C3)C)C4,73D66787E1A6606D_57A3B2F5301B7747_6041_UN,7.924511,00000000000100000000000000000000000000000010000000000000010000000010000000100000001100010010000110001100010110001001000000000100100001110100000010000111110110101111110,KJWFGQBBKBEJHG-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N(C=N2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,ABEBA763156D5AC6_A86B291AC2674F16_6034_UN,8.487862,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,KESATAPBIRBZMJ-VLIAUNLRSA-N
BrC1=CC2=C(C=C1)N(C=N2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,01424870A015EE8E_937565457A92A23B_6034_UN,8.487853,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,GXWSXCZTTMJQAP-VLIAUNLRSA-N
CCN4CCC1=C(C(=CC(=C1)NCC2(CCCC2)C3=CC=CS3)F)C4,8BC87D8B6C8013D9_C4836BC762E63BA9_6041_UN,7.6124234,00000000000000000000000000000000000010000010000000000000000000100010000000010000011101111011000010101100010110011010101011100100110001110110001011011001010110101111010,LUCNOSMDKXONEG-UHFFFAOYSA-N
C2(=NC1=C(C=CC=C1)[N]2C3CC3)N[C@@H]4CCN(CC)[C@H]4C5=CC(=C(C(=C5)F)F)F,2DA1B4B1E1377316_906C67E06B369774_6041_UN,8.779776,00000000000000000000001001000000000000000010000000000000000000100100000000010101100101110011000010001100111110010010101011100100110001110110001011011011010110101111010,GEGOHQGQYMXSIZ-NQIIRXRSSA-N
C[N]2C=C1C=CC(=CC1=N2)NCC3(CCOCC3)C4=CC=C(C=C4)F,8A380FB1B1E1FD38_4F9AF7E2C27D4EAD_6041_UN,7.1834116,00000000000000000000000000000000000000000010000000001000010000100110000000010000101100110011011010101100010101001000001011101100110011110110001001011001010111101111110,KUXHKXIJFDWKAC-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C#N)NC(C2CNC2)C3=CC=C(C=C3)F,E57F17A5D7E20AB6_D5AF7FA6D046792F_6041_DP,7.637789,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110010000000001000000100000000000001000100000101110110001011000011010010100111010,RLAYIGANEJBKSI-UHFFFAOYSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC2=C(Cl)[N](C(=N2)N(C)C)C3=CC=C(C=C3)C)C4,941B69C0312ECFF2_67140CCEC304FB10_7019_DP,8.139982,00000000000000000000000001000000000000000000000000000000000000100100000000110101000101110010010010010001111100010000001011100100110001110100011011011111000010101111010,GISYPOGLIRNIOU-INMHGKMJSA-N
BrC1=CC2=C(C=C1)N(C=C2C3CC3)CCN(C)C4CNCCC4,9AD16EB294D0D4F9_7858FC0976DC1F19_6034_UN,7.981695,00000000000000000000001000000000000000000000001000000000000000100100000000010001001101110011010010101100110110010001101011100100110001100110001001011001010110101111010,PVHPMTFNAQDCIL-UHFFFAOYSA-N
FC2=C1OC=CC1=C(C=C2)NCC3(CCN(C)CC3)N4CCCCC4,005B482FDC7816D3_673096881D6D63DA_6041_UN,7.777286,00000000000000000000000000000000000000000010000000000000010000100010000000010001101101110011010011101100010100011001101011100100110001110110001001011001110110101111110,BXNPZXDOYXWYPQ-UHFFFAOYSA-N
CC1=CC(=C(C=C1)C)[C@@H]2CCCC[C@H]2OCC3SC(=NC3)N4CCOCC4,40D6ECAC91208910_C11A2F644EE613E5_6039_UN,8.686183,00000000000000000000000000000000000010000000000100000000010000100000000000010110010101101000000111101000001011010000001111100011110011000110001111011110110111111111110,YARQBAURWLCPSJ-IZOREMLJSA-N
C[N]1C=CN=C1C(NC(=O)C2CC3CC2C4CC34)C5=C(C=C(C=C5)F)F,543D3AF29BEC4012_9F17805FCA8CA176_6038_UN,8.230997,00000000000000000001001000000000000000100010000000000000000000000100000000010101000101010011110010000000010100100000010011100100110000100100001011001011001010101111110,IDCXDHLLTLFEKN-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N(C=C2C3=CCNCC3)CC4(N)CC=CC4,AC606563025EC781_A9B81675052E1F5C_6034_UN,8.062248,00000000000000000000000000000000000000000010000000100000000000100110000000011001001111110001000010111100110100011000001011100100110101100110001001011001010110100111010,YERVMOYCJNJQQX-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC[C@@H]3CCCN(C)[C@H]3C4=C[N](N=C4)C)F,EB7C9256B25D2AFC_5CB8AABD6FCEF555_6041_DP,7.8631186,00000000000000000000000000000000000000000010000000001000000000100100000000010000101101110011011010101100110110010001101011101100110101110110001011011111010110101111010,GNQADXLXRJULMY-MGPUTAFESA-N
FC1=C(C2=C(C=C1)CCC2)NCC4=C(CN(C)C3CCCCC3)C=CC=C4,E5FB66ADFAE0180E_1017D6AE5BDDB9EC_6041_UN,8.02365,00000000000000000000000000000000000000000010000000000000000000000000000000000000001001110011010010001100010110010001101000100100110001110010001011011011010110101111010,YIDLAKKLHIEZRQ-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4=C(C=CC=C4)C5=CC(=C(C(=C5)F)F)F,2A1C30696638CAD3_E6A299067D0C5C9F_6041_DP,8.13583,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110001010010101000010110000000000011100100110101110110001011001011010010101111010,QPSHXINFJMHNLA-SZLXDWMPSA-N
CCC(C)C2=C[N]1C=CC=C(C1=N2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,F4D229BFEABE624D_D9F72802FC5320C0_6041_UN,8.6632395,00000000000000000000000000000000000000100010000000000000000000100100000000010101100101110011010010101100110110010011101011100100000001110100011011011111010110101111010,FNSRATYLBSAQOJ-VXOHXDMYSA-N
CC1=CC2=C(C=C1)C(=CN2CCC3CCN(C)C3)C4CCNCC4,7955DA660D6ECFED_6D4DBEE91E943EFA_6034_UN,8.097459,00000000000000000000000000000000000000000000000000000000000000100100000000010000001101100001010010101100110010010001101011100100110000000110001001011101010110101111010,PKDBYEJKCAJGTL-UHFFFAOYSA-N
BrC1=CC2=C(N=C1)N(C=C2CC3=CC=CC=C3)CC4CNCCC45CN(C)C5,2B121DF72FE6B486_6DD42C20490856B9_6034_UN,7.7623625,00000000100100000000000000000000000000100000001000000000000000000110000000010100101101110011010010101100110110011001001011100100110000100110001001011001010110101111010,FNVZJKNYJWOVKG-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)F)NCC2CC3CCC2N(C)C3)F,ED91910831FDBC18_1A1010EDD13D517E_7022_UN,8.300861,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001110011010000101000010110010001101001100000110001110110001011011111010110101111010,DLPCHOKVCWGNDH-UHFFFAOYSA-N
C2(=C1OCCCC1=CC=C2)NC3=CC=C(CC[Si](C)(C)C)C=C3,F19B16AC3754F484_A6AD40E6E7992B48_7022_UN,6.914198,00000000000000000000100000000010000000000000000000000000010000000000000000100000000000100001010100100100010001001101101000000100100011010110010011011101110111101111110,OKMAVIMLJHVZMZ-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NC3CCC2(CCN(C)CC2)CC3)CC=C,51E59F9BEAAC9B15_5A5D90AE354EE94C_6041_UN,7.8580794,00000000000000000000000000000000001000000000000000000000000000000010000000010000000001100011010000111000110000011001101001100000110001010110001011011111010110101111010,DWHGSBLKQLSJQS-UHFFFAOYSA-N
CN(CC1CCNCC1)C2=NC=C(N=C2)N[C@H]3[C@@H](C3)C4=CC(=C(C=C4)F)F,9F9DDCEC33D801B9_20B7864D221DCA65_6041_DP,8.343775,00000000000000000000001000000000000000100010000000000000000000100100000000000101001001110011010000101000100110010001001011100100110101110110001011011011010110101111010,HFOOYHBZGVDPNE-MAUKXSAKSA-N
CC1=CC2=C(C=C1)C(=CN2CC3(CC(F)C3)C4=CC=CC=C4)C5=CCNCC5,3D55B3A942BAFD73_F9A65A55C8D40DA8_6034_UN,8.517805,00000000000100000000000000000000000000000010000000100000000000100110000000011000001101110001000010111100110100011000001011100100110000100110001001011001010110101111010,NKPRDYZYAMNZSG-UHFFFAOYSA-N
CC2=C(C=C1N=C(C(=NC1=C2)C)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C,8E9C4C2D6DD84BDD_1EAC7304D6C91376_6041_DP,8.314832,00000000000000000000000000000000000000100010000000000100000000100100000000000101101000110011000000101100110110010000001011000100110101110110011011010111010110101111010,BWBOPOLDTNZVRG-AZUAARDMSA-N
FC2=C1[NH]C=CC1=CC(=C2)NCC3CCCC(CC)CC3,B38F001F5171037E_32D39B41376FF238_6041_UN,8.531534,00000000000000000001000000000000000000000010000000000000000000000100000000000000001100010011000010001100010110000010101001000100110101110100001000010001010110101111010,OFYKGXSBXWKIDA-UHFFFAOYSA-N
FC2=C1N=CC(=C(C1=C(C=C2)F)NC[C@@H]3CC(CN3)(C)C)C#N,75EE47D17BF31C07_B2805FD22233A993_6041_DP,7.894068,00000000000000000000000000000000000000000110000000000010000000000110000000100001101100010011000010101100110110011001000011000100110101110110001011000111010110101111010,MESAOEOQEUPEMS-NSHDSACASA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC[C@@]34CCN[C@@H]3CCC4,A17884E19D1E6B10_E2F461CE920CAF6E_6041_DP,8.420519,00000000000000000000000000000000000000000010000000001100000000000110000000010000101100010011011010001100110100011000001011101100110101110110001000011001010110101111010,QRVNPELTHQFFOK-GDBMZVCRSA-N
N(CCN1CC2C(C1)C3CCC2C=C3)C(C4=C(C=CC(=C4)C)F)=O,016A2A0A410AAD9E_7CF7C54491F0B195_6038_UN,8.275476,00000000000000000000000000000000000000000010000000000000000000000000000000010001001101110001100010011100110100110000011001100000110000100110001011011011011110101111110,ZTIXDLULMUUTBG-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,CD737B5BB2789341_E0E8B7942DA3E6F1_7022_UN,8.404204,00000000000000000000001000000000000000000010000000001000000000100100000000010101101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,BMWUGYYGRJNMNV-HXOBKFHXSA-N
N1CCC5(C1)CCN(CC2=NN=C(C=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F)CC5,8B9A9822951B54A8_0DB34A8745FD5C9D_6041_DP,8.110335,00000000000000000000000000000000000000100010000000001000000000100110000000010101101101110011011010101000110110011001101011101100110101110110001001011011010110101111010,ZBFUSRHTZOPFJF-GGAORHGYSA-N
C1CC(CCN1)C2=CC3=C(C=C2)N(C=C3)CC4=C([N](N=C4C)C5=CC=CC=C5)Cl,0B06B07E9835490D_C7DB4B3BF651D698_6034_UN,8.210029,00000000000000000000000000000000000000000000000000001000000000100100000000010000101101110001001010101101110100010000101011101100110001110110001011011011010110101111010,ICGAUOJQZRSJFS-UHFFFAOYSA-N
C2(=CC1=C(C(=CC=C1)Cl)S2)NC[C@@H]3CCCN(C)[C@H]3C4=CN=C[N]4C,71A7F85985000210_4EFB7FDEB7C26DC5_7022_UN,7.719592,00000000000000000000000000000000000010000000000100000000000000100100000000010101111101111011010010101101010110010001101011100100110001110110001011011111010110101111010,CLPYBEBSZYWNOA-KBXCAEBGSA-N
C2(=CC1=C(C(=CC=C1)F)S2)NC[C@@H]3CCCN(C)[C@H]3C4=CN=C[N]4C,7216B226ED47A1E0_A9E71A2C485A5F35_7022_UN,7.719578,00000000000000000000000000000000000010000010000100000000000000100100000000010101111101111011010010101100010110010001101011100100110001110110001011011111010110101111010,PTIIHBGITFSBKQ-KBXCAEBGSA-N
CC1=C(C=C(C(=C1)NCCN2CCC=CC2)Cl)C3CC3,C3CE17E426BD8956_26630C3DF336A1C4_7022_UN,8.103355,00000000000000000000001000000000000000000000000000000000000000100000000000010001001001110001000000111001100110010000001001100000110001110110001011011011010110101111010,XJGHFSKCPSMHKK-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC3=C2CCCC2=CN=C3,F56573934E2B3E2E_C7AD0EAA5C1EFA9D_6041_UN,7.6606555,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100011010010100100010000001000001001000100010001010100011011011101000010101111010,DXYVMZHPARTGQC-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3C4(CC3)CCC4,642ABE9C0FA81EEE_8E79AAEC247E588B_6041_UN,7.9098096,00000000000100000000000000000000000000000010000000001000000000000110000000010000101100010011011010001100010100001000001011101100110001110100001000011001010110101111010,DOOYHTRMRVEDQP-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2=C(C=CC=C2)F)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,BD9FB330C9BE6944_CA3724FAC6EA639E_7022_UN,7.8165083,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,JSUQRICHFKRMGZ-VXKWHMMOSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NC(C2CCNCC2)(C)C,E7970A6930F108B1_C7FEF9D9CF391CD0_7022_DP,8.523768,00000000000000000000000000000000000000000110000000000000000000000010000000100000001000110011000000101001100110011000101001000000110101110110001011010111010010101111010,VAVPYYAWJKZOSQ-UHFFFAOYSA-N
CCC2=C1N(C=C(C1=CC=C2)C3=CCNCC3)CC4(CCNC4)C5=CC(=CC=C5)F,25A93FC1A4EB9F23_7B0845061F947D5E_6034_UN,8.248006,00000000000000000000000000000000000000000010000000100000000000100110000000011000101101110011000010111100110100011010001011100100110100100110001001011001010110101111010,IEPHDLRERAFRIP-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C3CCC2O3)NC4=CN=CC(=C4)[Si](C)(C)C,333E068B1C5BCF2C_6274E564749D8C97_6041_UN,7.191557,00000000000000000000100000000010000000000000000000000000010000000100000000100001000100100000010010100100010000001000001011000100000011010100011011011101100011101111110,BXHPOIYDRVQXKY-UHFFFAOYSA-N
C([C@]12C[C@H]1COC23CCC3)=CC5=C(OC4=CC(=C(C=C4)Cl)CC)C=CC(=C5)F,4913CB31E91B6694_7B0F7429302C1572_7019_UN,8.104143,00000000000100000000001000000000000000000010000000000000010000000010000000000000000100010000000010110001010101001110001000000111110010100100000111010010110101011011110,RPFSIWPPRZDYMP-MBSDFSHPSA-N
CC1=C(C=C(C(=C1)NCCC3CCN(C2CCN(C)CC2)CC3)F)[N]4C=CC=C4,27360ABBC57312D1_E05A371C82D1BAB5_6041_UN,7.698078,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110001010010101000100100010001101011100100110001110110001011011111010110101111010,BEPKYUPZKIAENA-UHFFFAOYSA-N
CN(C1CCCNCC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=C(C=C(C=C4)F)F,87B099D3974F61F4_E9616D3CA33E9922_6041_DP,8.368757,00000000000000000001001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010000101011100100110101110110001011011011010010101111010,GMGZSTKZZSYVFN-RNYWFIABSA-N
O=[N](=O)C1=CC2=C(C=C1)N(C=C2)CC4=C3OCCC3=CC(=C4)Br,3C46EFD5EEF521CD_3B72C32601929978_6034_UN,8.538342,00000000000000000000000010000000000000000000001001000000110000010100001100010000000101010000001011001110010101000100001111101100101011110110001011111000110111110111110,ORBFYAIQTABQSF-UHFFFAOYSA-N
O=[N](=O)C1=CC2=C(C=C1)N(C=C2)CC4=C3OCCC3=CC(=C4)Cl,C51340376ECA447D_1A1634C1320A7439_6034_UN,8.538339,00000000000000000000000010000000000000000000000001000000110000010100001100010000000101010000001011001111010101000100001111101100101011110110001011111000110111110111110,ZHEUJBKMXMNZRP-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2C(CCCC2)Cl)F,67A9D58A830F41B4_666402712B3D5C9F_7022_UN,7.7284117,00000000000000000000000000000000000000000010000000000000000000000000000000100000001001110011010000001001000100000001001000100000110001110010001011011111010110101111010,HZFMKQGHWORDAA-UHFFFAOYSA-N
N5CC1=C(C=C(C=C1)NCC2(CC[Si](C)(CC2)C)C3=CC=CC=C3)C4(CC4)C5,3455C98C886FD261_E2CAC5A95C59463B_6041_DP,7.7512445,00000000000000000000101000000010000000000000000000000000000000100010000000100000001000100011010000101100010000001001101011000100110101010110001011011101010110101111010,BOSWPGAISOEHGJ-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2C(CCCC2)F)F,EB4F3EA0708E97C8_6D34012987661714_7022_UN,7.728404,00000000000000000000000000000000000000000010000000000000000000000000000000100000001001110011010000001000000100000001001000100000110001110010001011011111010110101111010,OHOZNSYUSSVVRV-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC3=CC=CC(=C3)CC4CCCN(C)C4,994094B164ED47EF_30A0A248973EDC44_6041_UN,7.0608945,00000000000000000000000000000000000000000010000000000000010000100000000010010000000101110001010010101000000111010001101011110100110011110110001011011011010111111111110,ROXNMRSEOUUSSO-UHFFFAOYSA-N
CN1CCCCC1CCOCC3COC2=CSC=C2O3,8C6B231D3273F0E7_BD370D54F954DE20_6039_UN,8.173744,00000000000000000000000000000000000010000000000000000000010000000000000010010000000101101100010011101100010011010101101011100010110010000110000011111010110111111111110,KNWGRWLFFCZNIG-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCCC2CSCCN2)F)CC3,0814D26787837870_8D284392A7F6D1D6_6041_DP,7.7799773,00000000000000000001000000000000000010000010000000000100000000000000000000010001101001111011010000101000100110010001101011100000110101110110001011011011010110101111010,DZTMQFVFXUAMSS-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)NC(CC)C3CCOCC3,46BC11C0422DDEB9_27822D99EDA76404_6041_UN,7.358776,00000000000000000000000000000000000000000010000000000000010000000000000000000000000000110011000010100100110111010010001000000000110011110110000011010011010111101111110,MYOQWBJQRKBQLK-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCCCC3)C4=CC=CC=C4,E757F3DDDC14C85C_A1D2A972546374EA_6041_UN,7.5005856,00000000000000000000000000000000000000000010000000001000000000100110000000010000101100010011011010001100010100001000001011101100110001110100001001011001010110101111010,YFEMSFBSUQODBC-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C([N](N=C3C)CC4=C(C=CC=C4Cl)Cl)C,FDA4907876E5D45B_9BE143109B0A4DEA_7019_UN,8.220507,00000000000100000000000000000000000000000000000000001000000000000110000000010000100100010000001010011001010110011000101011101100110000100100001011011110010110101111010,LVCGPHGTATYSOJ-UHFFFAOYSA-N
NCC(OC2=C1CNCCC1=C(C=C2)F)CCC3CC3,0D0562C0A8E5FE30_FD8304F7D9263197_6035_UN,8.290148,00000000000000000000001000000000000000000010000000000000000000000000000000000000001010110011000101101100110100010100001001000011110110100110001111010001110101100111110,GSBDORAGQAWAAT-UHFFFAOYSA-N
C[N]2C=C1N=CC(=CC1=N2)NCC(N3CCOCC3)C4=CC=C(C=C4)F,8A117931FDF4E9EA_011585CCD6582B92_6041_UN,7.53275,00000000000000000000000000000000000000000010000000001000010000000100000000010001101101110001011110101100010101010000001011101100110011110110001001011001010111101111110,KTECGNCXPMCHSQ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N(C=C2Br)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,96BC93EFBE9E8760_246CC5FE66EDD68D_6034_UN,8.875287,00000000000000000000001000000000000000000010001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,OUFVNDWITMTGDZ-SZNDQCEHSA-N
CN(C)CC1CCCCC1OC2=CC3=C(N=C2)C(=C(F)C=C3)F,D3DCF616A16640BA_FB10331A3CF488DD_6035_UN,8.269887,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010101101100010110000101001001100111110010100100001111011110110111101111110,WFFPYAQBVZEPPL-UHFFFAOYSA-N
CN(C)CC1CCCCC1OC2=CC3=C(N=C2)C(=C(Cl)C=C3)Cl,A1D36B2CBD377D3C_8B75449C2E87AF35_6035_UN,8.269904,00000000000000000000000000000000000000000000000000000000000000000100000000100000000001110000010101101101010110000101001001100111110010100100001111011110110111101111110,WRUHERJPDGRSBA-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=C2I)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,787E7D240E4AB502_C2C2A505F5B33444_6034_UN,8.87527,00000000000000000000001000010000000000000000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,MROBVHIPFVLICK-SZNDQCEHSA-N
ClC1=CC2=C(C=C1)N(C=C2I)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,752D2C3BFB7A9649_43D47C27FC5C6E40_6034_UN,8.875266,00000000000000000000001000010000000000000000000000000000000000100100000000010101100101010000010010101101010100010000001011100100110001100110001011011010010110101111010,OYXXPBYMGCFCCQ-SZNDQCEHSA-N
FC1=C(C=CC(=N1)N[C@@H]2CNC[C@@H]2CC3=CC=CC=C3)C#N,6E9FEC19A1D0855C_B993A75029A6964B_6041_DP,7.237874,00000000000000000000000000000000000000100110000000000110000000000100000000000101101100110011000010101000100100010000000011000100110101110110001011000011010110100111010,FAJMGSZFMXBDLH-LSDHHAIUSA-N
CC1=C(C=C(C(=C1)NC3=C2C4CCC(C2=CC=C3)O4)Cl)C5CC5,84ED86C9A32ED9A8_571932675347F631_7022_UN,7.4188333,00000000000000000000001000000000000000000000000000000000010000100000000000000000000100010001000011000101010110000000001000000100000011110100000011010011100011101111110,PVQSWHVNHMILAG-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)NCC(C2CCCN2)(C)C)C#N)F,2EB536FB50E28B92_D5C5FCD658064C5A_6041_DP,8.627507,00000000000000000000000000000000000000000110000000000100000000000010000000100000101100010011000010001000100110011001101001000000110101110110001010010111010110101111010,QQOXHQJHQYZCEI-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NCC23COC(C)(C2)CCC3)C4CC4,053D918AA8BAA65E_A57420BA97176E51_6041_UN,7.266699,00000000000000000001001000000000000000000010000000000000010000100010000000000000001100010011000011001000010111001001101000000000110011110110000011010011110111101111110,IWVWFMHWBUZEPX-UHFFFAOYSA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=N3)CC5=CC(=C(N4CCN(C)CC4)C=C5)F,AA389A656172D472_D0EA987A6C7DC5F2_6034_UN,8.378496,00000000000000000000000000000000000000100010000000000000000000100100000000010101001101110011010010101100110100010001101011100100110001110110001011011011010110101111010,GJVXMQJAESJXEA-UHFFFAOYSA-N
CC(C)(C#N)C1=C(C=C(C=C1)NCC2CC3(CN2)CC3)F,A11D2D4BBF662652_9048C58ABF040A50_6041_DP,7.905193,00000000000000000000001000000000000000000110000000000010000000000010000000100001001100010011000010001000110100011000000001000000110101110110001010010111010110101111010,YZPMOPWKFZTFHR-UHFFFAOYSA-N
CC2=C1N=C(C=C(C1=CC=C2)C)NC3C4(C(O)C3)CCOCC4,AB36AFAC2C4C467D_9B9128BEA24672EE_6041_DP,8.281206,00000000000100000000000000000000000000100000000000000100010000000110000000000100000000100011000001100100110001011000001011000101110111010111001101010101110011111111110,YAYFHSAGVDBLKX-UHFFFAOYSA-N
ClC1=CC3=C(C=C1)C(=O)C2=C(CCCC2)N3CC5CNCC4(CCC4)O5,847E5C338C8F4CF8_9071A782AF0A8DC2_6034_UN,8.599037,00000000000100000000000000000000000000000000000000000000010000000110000000010000101001110011000101101101010100011100001011100101110010100110001111011001111111110111110,PRIYFJRXZQRCQL-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)CCOC2)[S](C4=CC3=C(C=C[N]3CC)C=C4)(=O)=O,96E1E2AF37CF06A0_357FA74A8470D365_6029_UN,8.614919,00000000000000000000000000000000110000000000000000010001011111001101010001010000011101101000001010101110011001001010011011101100111010001110001011111001010111111111110,JSYLNZRUFAXVHZ-UHFFFAOYSA-N
FC1=CC5=C(C(=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)C=CN=C5,610BD47E0434224E_80D6AF5E5F5E6B7A_6041_UN,8.486301,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,QIEGIOOSKYHADO-QRQCRPRQSA-N
N(CC1=CC2=C(C=C1)COC2)[S](C4=CC(=C3[NH]C=CC3=C4)C)(=O)=O,803A3FD494006B5F_46139D82CFD5B8A5_6029_UN,8.725759,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100101000001010001110011001001000010011001100111100001110001011101001010111111111110,VYPACYTZPHKELV-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC24CC(OC23CCNCC3)(C)C4)F)[N]5C=CC=C5,E7C1F3CD5CDF6BBE_EFE70FD3D0114759_6041_DP,7.6658497,00000000000100000000000000000000000000000010000000000000010000100110000000010000001101110011000111101000110110011001001011100100110111110110001011011111110011101111110,SKVZEAKCCZSOBI-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC(=C2)NC3=CC=CC(=C3)CC4CCCN(C)C4,7E47D592D41D9D5B_A01721215C75B3DB_6041_UN,7.8010254,00000000000000000000000000000000000000000010000000000000000000000100000000010000000101110001010010101100010110010001101011100100110101110110001001011001010110101111010,GCZYJYKTCOLGBP-UHFFFAOYSA-N
NCCC1(CCNCC1)OC3=C2C=CC=C(C2=CC=C3)Br,AD5E607CD2742BCC_FEABE0D8F3242065_6035_DP,8.169681,00000000000000000000000000000000000000000000001000000000000000000010000000000000001010110001000001101100110100011100001001000111110110100110001101010001110101100111110,JYZWILZQTNOMBJ-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2CC3(C2)CCOCC3)F,DDCDE6567AE914FD_E2A7D87046CA746E_7022_UN,7.365969,00000000000100000000000000000000000000000010000000000000010000000010000000100000000001110001010000101000110101011001001000100000110011110110001011011111010111101111110,HWBPBBNISAGMKE-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC(CC)CN2CCCC2)Cl)C3CC3,002E8EC526C81195_849A28DCA68795E0_7022_UN,7.901266,00000000000000000000001000000000000000000000000000000000000000100000000000010001000101110001000010001001100110010010101001100000110001110110001010011111010110101111010,SWGRNKJFOPPZMX-UHFFFAOYSA-N
CC1=C(C3=C(N1CC2(N)CCC(F)(F)CC2)C=CC=C3)C4=CCNCC4,2ABA4A5F78BE266D_67067E3522047E70_6034_UN,8.103795,00000000000000000000000000000000000000000010000000100000000000100110000000011001001111110011000010111100110110011000101011100100110101100110001011011011010110101111010,QYQPADXCDKUNCV-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(C3=CC(=N[N]3C)C4=CC=C(C=C4)F)=O,E684D0368447B3CB_A56ABE0F68D8F468_6038_UN,8.028508,00000000000000000001000000000000000000000010000000001000010000100100000000010001101100010010111111101000010100100000011011101100110010100100001011011011111111111111110,GFRSZINJBZULBM-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CC2(CCCN(C)C2)C)C=CC(=C3)C)C4,752ECD2568703AA9_EA141B101B385986_6034_UN,7.9734726,00000000000000000000000000000000000000000000000000000000000000000110000000010000100101100000010010101100010010011011101011100100110000000110011011011100010110101111010,XYXJPBDRWIMRHL-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CCCCC3)C4=CC=C(C=C4)F,46AD97BDCE2BD6C9_2FB81CA1B9C73C97_6041_UN,7.675811,00000000000000000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,MLGYYPVZWCHJGY-NRFANRHFSA-N
FC1=CC(=C(C=C1)NCC2CC3CCC2N(C)C3)C=C,06E8221928B7B4BD_881EF52596AAFA28_6041_UN,8.335236,00000000000000000000000000000000001000000010000000000000000000000000000000010000101001110011010000111000010110010001101001100000110001110110001011011011010110101111010,WHFRUFWHJNUICE-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CC3(CN2)CC3)Cl)C4CC4,AB2519122753B73E_0094FFA605A04E34_7022_DP,7.8213873,00000000000000000000001000000000000000000000000000000010000000100010000000000001001100010011000010001001110110011000001001000000110101110110001010010011010110101111010,IEIMPQDJEZRNFE-UHFFFAOYSA-N
CC1=C(C=CC(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,A8AF05B1773DEDCA_14B54761D10F8ADD_6041_DP,7.2825418,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110101111010,TVBYBESHWVQOQK-FXAWDEMLSA-N
CCC5CCC1=C(C4=C(N1CC2=CC(=NO2)C3CC3)C=CC(=C4)C)C5,F4043010300C12D3_8EE141246965356A_6034_UN,8.415291,00000000000000000000001000000000000000000000000000000000010000100100000100010000100101000000001111001110010010010010101011101100110010000100001011011100110110101111110,IIBCCOXTHNLBJS-UHFFFAOYSA-N
CCC(C)C1=NC(=CC(=N1)C)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,00D62DDD5F3BF3D1_BE0FEB1DC8AD2664_6041_DP,8.561425,00000000000000000000000000000000000000100010000000000100000000100100000000000100101000110011000000101000100100010011001011000100110101110110011001010111010110101111010,CEGIMHPRDUNGTB-DEGSQWPTSA-N
C2(=C(C=C1C=CC=CC1=C2)Br)NCC3CCCN(C)C3C4=CC=CS4,60E4DA6994C70FDB_574F386E522293F2_7022_UN,8.479888,00000000000000000000000000000000000010000000001000000000000000100000000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,ZFFUBRKOROOMKS-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NCC3CCCN(C)C3C4=CC=CS4,64833B6A94B812BE_07AF7058B9A9F784_7022_UN,8.47987,00000000000000000000000000000000000010000000000000000000000000100000000000010000111101111011010010101101010110010001101011100100110001110110001011011011010110101111010,IRZQOINYSMHUGF-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CC23CCOC3)Cl)C4CC4,0A2C629C0ABD8F96_A9E9468C252F84CE_7022_UN,7.435735,00000000000000000000001000000000000000000000000000000000010000100010000000000000001100110011000010001001010111001000001000000000110011110110000010010011010111101111110,AWAHPXZTKFBWHJ-UHFFFAOYSA-N
N4CC1=C(C=C(C=C1)NC(C#N)C2=C(C=C(C=C2)F)F)C3(CC3)C4,C75A0D01FF9185F1_CFABAC6C9E226C5E_6041_DP,7.73032,00000000000000000000001000000000000000000110000000000000000000000010000000000001001000110011000000101100010100001000000001000100110101110110001011010011010010100111010,YBZNBKHXNSVPJB-UHFFFAOYSA-N
N(CC1C2CCC(C1)CC2)C(C(C)(F)C3=CC=C(C=C3)F)=O,C7F00F9D602CC69F_27178C94C944445D_6038_UN,7.9876795,00000000000000000000000000000000000000000010000000000000000000000010000000000000001000010011100000001000010110101000011000000000110000100000000001010001011110101111110,ONAOETFVFVPTPF-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4=CC(=C(C(=C4)F)N5CCOCC5)F,F59468F2E428CBA5_167E41111074D705_6041_DP,8.071692,00000000000000000001000001000000000000100010000000000000010000100100000000010100100101110011010110101000111101010000101011100100110111110110001011011011010011101111110,FSBQUGDLNZNHTH-SCAQPMJSSA-N
C1CC(CN1)C3=CC2=C(C=CC=C2)N3C[C@H]4[C@@H](CNC4)C5=CC=C(C=C5)Cl,490FEA63F4F5A494_D7811CD11888326E_6034_UN,8.848664,00000000000000000000000000000000000000000000000000000000000000100100000000010000101101110011000010001101110100010000001011100100110100100110001011011011010110100111010,YYLQPHCMTQRJEM-ZDZADGERSA-N
CN(CC1CNC1)C2=NC(=NC=C2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,7FD37357BEAEAB2D_D9096F68CFF3E254_6041_DP,7.993252,00000000100100000000001001000000000000100010000000000000000000100100000000000100101001110011010000101000001110000001000011100100110101110110001011001011010110101111010,RUECGBNERQRFJH-UONOGXRCSA-N
C[N]1C=CC2=C1C=C(C=C2)NC35CC(OC34CCNCC4)(C)C5,913171B7B4959C82_F57525E284937838_6041_DP,7.3439064,00000000000100000000000000000000000000000000000000000000010000000110000000010000101101100011010111101100110010011001001011100100110111010110001001011101110011101111110,PNJXNSDCJWKNRI-UHFFFAOYSA-N
CC2=C1C=C[NH]C1=C(C=C2)NCC4(C)CCOC3(CCC3)C4,9269B208046FB3B3_5CA80AD754F5E754_6041_UN,7.723981,00000000000100000000000000000000000000000000000000000010010000000110000000000001001100000011000010101100010011001001101011000100110111010110001001010101110111101111110,HOAZYWGBKBLDPJ-UHFFFAOYSA-N
FC1=CC3=C(C=C1)N(C2=C(CNCC2)C3=O)C[C@H]5N[C@H]4CCCC[C@H]4C5,867299507017A049_286BF5CD67339ADD_6034_UN,8.421972,00000000000000000000000000000000000000000010000000000000000000000100000000010001101101110011000011101100110100010100001011100101110100100110001111011001111110100111110,NOWXCJSZWWFXHT-YEWWUXTCSA-N
CN5CC(C1=NN=C(C)N1CC3(C)CCN(CC2=CC=CC=C2)CC3)C4(CNC4)C5,12A5676DA0E2BC29_2258D6E57F22162D_6034_UN,7.8408103,00000000100100000000000000000000000000100000000000001000000000100110000000010101101101100011011010101000010010011001101011101100110000000110011011011111010110101111010,ZDAVMILJQPTIJT-UHFFFAOYSA-N
CC1=C(N(C(=N1)C2CNCCC2)C[C@@H]4CN(CC3=CC=CC=C3)C[C@H]4F)C,E98943CF6713F427_8D0B5E15D707310C_6034_UN,8.344027,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101000100110010000101011100100110000100110001011011111010110101111010,SQGJVJFPSGSGIP-GJGLBJJNSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=NC=C3)NC4C5CC6CC4CC(C5)(F)C6,5B3A5A3E74257B8D_7DCFCBF716742D98_6041_DP,7.685076,00000000000000000000001001000000000000100010000000000000000000000110000000000100101101110011010010101100011110001000000011100000110101110110001001001001010010101111010,POCJINKEQSRVRH-OQNKQVNISA-N
CC1=C(C=C(C(=C1)NCC2N(C)CC3(CC2)CC3)F)F,E7B98AAEF1F9D979_4C789858D1B8D233_7022_UN,8.024268,00000000000000000000001000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011111010110101111010,WOWOGZZSYQFQES-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3CCCC3C4CCCC4,9C72F83C6E34A1E0_955CEAF3B884CC89_6041_UN,8.146005,00000000000000000000000001000000000000000010000000000000000000100100000000010101000101010011010010000100111100010000001011100100110001110100001010011011000010101111010,CJMWAQMTFZOHQB-UHFFFAOYSA-N
CN1CCCC1C2=CC=C(C=C2)NCC3(CCC3)C4=C(C=NC=C4)F,3C7FDBF438EF6B37_F01A51E54358E44F_6041_UN,7.8687477,00000000000100000000000000000000000000000010000000000000000000100110000000010000001101110011010010101000000110011001101011100100110001110110001011011011010110101111010,PJIOCEVPKVXZBM-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC2=NC=C[N]2CC3CNCC34CCNCC4,80A692D54B2723B3_2FE1DB90A564F124_6034_DP,8.287812,00000000000000000000000000000000000000100000000000000000000000000110000000010101101101110011000010101001110110011000001011100100110101110110001011011011010110101111010,OUKKPFVMNJNMOB-UHFFFAOYSA-N
CC1=C(N(C(=N1)C2CNCCC2)CC(CC3=CC=C(C=C3)Br)C#N)C,9FCF5085B3F0BFE7_D700002EAF262135_6034_UN,8.144869,00000000000000000000000000000000000000100100001000000000000000100100000000010101101101110011000010101000100110010000101011100100110000100110001011011111010110101111010,XJNMHMBEXUJUEH-UHFFFAOYSA-N
O(C3CCOC2(CCN(CC1=CC=CC=C1)CC2)C3)CC(C4CCNCC4)F,A1F86D4D15987E42_ADABD0CBEA9DE3C6_6039_DP,8.145574,00000000000000000000000000000000000000000010000000000000010000000010000000010000001001100101000001101000110101011000001011100011110010100110001101011001110101110111110,RGUWIEQLJLSXPG-UHFFFAOYSA-N
CC1=C(N(C(=N1)C2CNCCC2)CC(CC3=CC=C(C=C3)F)C#N)C,651CC2FC4C0E155D_648E9C4080B67632_6034_UN,8.144852,00000000000000000000000000000000000000100110000000000000000000100100000000010101101101110011000010101000100110010000101011100100110000100110001011011111010110101111010,RHRBHXBQIIEITM-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CC2(CCN(C)CC2)C)C=CC(=C3)C)C4,1B7FCFC4548883AF_5EECEE8647D1DA9C_6034_UN,8.133861,00000000000000000000000000000000000000000000000000000000000000000110000000010000000101100000010010101100010010011011101011100100110000000110011011011100010110101111010,OBTTVVHAXNSBIW-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(C3=CC(=N[N]3C)C4=CC=C(C=C4)F)=O,9D91D0802B140426_A1E44C913AF09D47_6038_UN,8.381523,00000000000000000000000000000000000000000010000000001000000000100100000000010001101100010011111111001000010100100000011011101100110000100100001011011011011110101111110,DEYTXNVFKGUEFP-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C(=CC=C2)NC[C@H]3[C@@H](C3)C4CCOCC4)C,698A157180C11CDE_FE9F4A8E018290FA_6041_UN,7.605194,00000000000000000000001000000000000000000000000000000010010000100100000000000001001100100011000010101100010001000000001011000100110111010110001011010111010111101111110,OJZNCLVVKDNLOI-RDJZCZTQSA-N
N(CC1C2CCC(C1)C2)C(=O)CCCC3=CC(=C(C=C3)Cl)Cl,F39995E53698925C_D72516AC23ABAA50_6038_UN,7.806901,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010011100010001001110100110000011000000000110010100000000011010011011110100111110,PMMDVKYEHOFFAL-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CCCC3=CC(=C(C=C3)F)F,DADBAF1DA1EA2F23_4BD9743195D786C3_6038_UN,7.8068924,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001000110100110000011000000000110010100000000011010011011110100111110,CGMZBHFKTIVSOA-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NCC2=C(C=N[N]2C)C3CCC3)C4CC4,C048DC81F1801DEB_B684DA4B26154364_6041_UN,8.140583,00000000000100000000001000000000000000000010000000001000000000100100000000010001101100010001011010001000000100010000101011101100100001110100001010011011010110101111010,FKNVRTHQCNQMAY-UHFFFAOYSA-N
C(C2CCCC1(CC1)C2)=CC4=CC3=C(C=C(C)C=C3)N=C4Cl,9FB8B8FA3F9E9178_CAFAC8FA38CF4B4D_7019_UN,8.694953,00000000000000000000001000000000000000000000000000000000000000000110000000000000000000010000000000110101010100001000001001000100110000100100000011010010000010001111010,HVBAWDPBXBFFIT-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CC=N2)NC3(CCOCC3)C4=CC=C(C=C4)F,5040ED09A8AB7364_1727FA59811060C3_6041_UN,7.735695,00000000000000000000000000000000000000000010000000000000010000100110000000010001100101110010010011100100110101011000001011100100110011110110001001011001010011101111110,VIAGJZLHYMSSDR-UHFFFAOYSA-N
FC2=C1C=CN(C1=C(C=C2)F)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,55204FA74EB40B69_C99B1D0CF6590752_6034_UN,8.6746025,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,DTKWNVUFKFSTGY-VLIAUNLRSA-N
N1C4CCC1C(C=CC3=CC2=C(C=CC(=C2)C)N=C3Cl)C4,C592D2D2ED807A5F_08BEDFE04BA53274_7019_DP,8.776961,00000000000000000000000000000000000000000000000000000000000000000100000000000000000100010010000010110101110100010000001011000100110000100100001011010011000010101111010,WWWKXUZVKDIDJY-UHFFFAOYSA-N
CC(OCC[C@]12C[C@H]1CCC2)C3=C(C=CC=C3F)N4CCOCC4,1970E2C6A17C3738_DADF276D5157EA99_6039_UN,8.144432,00000000000000000000001000000000000000000010000000000000010000100010000000010000000001110000000111101000010111011000101011100010110011110110000011011010110111111111110,HACOUVPOXIAQPU-KOIGGSBLSA-N
FC1=C(C(=CC=C1)NC2=CC=CC(=C2)C3CCN(C)CC3)C4CC4,22C1562F8A04E4B6_492CA1D2670438B5_6041_UN,7.9057293,00000000000000000000001000000000000000000010000000000000000000100000000000010000000001110001010000101000000100010001101001100100110001110110001011011011010010101111010,UDYXTJFXSHRRBD-UHFFFAOYSA-N
NCCC(OC1=CC=C(C=C1)C2CNCC2)C3=CC(=C(C=C3)Cl)Cl,31C8129BBD1BEF92_D57368E1E98116EC_6035_UN,8.377477,00000000000000000000000000000000000000000000000000000000000000100000000000000000001110110011000011001001100100010100001001000111010110100110001111010011110101100111110,UCDARCAKVOFKEV-UHFFFAOYSA-N
ClC2=C1N(C=CC(C1=CC(=C2)Br)=O)C[C@H]3[C@@H](CNC3)C4CCOCC4,BEF68FEA5211053D_BBC633920FD5208F_6034_UN,8.557363,00000000000000000000000000000000000000000000001000000000010000100100000000010000101101110011000011101101010101000100001011100101110010100110001101011011111111110111110,VLDVZPSQQSUCNY-BBRMVZONSA-N
FC2=C1N(C=CC(C1=CC(=C2)Br)=O)C[C@H]3[C@@H](CNC3)C4CCOCC4,FBA0FFD9EC2E4B4B_68A012894EE3D1F6_6034_UN,8.557356,00000000000000000000000000000000000000000010001000000000010000100100000000010000101101110011000011101100010101000100001011100101110010100110001101011011111111110111110,MCLRYHIWESSJLB-BBRMVZONSA-N
N3CC[C@@H]([C@H](CNC(=O)C12CCC(F)(CC1)C2)C3)C4=CC=C(C=C4)F,C64681FE12C6482F_EF011BDD07D5C00D_6038_DP,7.5571647,00000000000000000000000000000000000000000010000000000100000000100010000000000000101000110011100010101000110100111000011001000000110100100110001001010011011110100111110,MRYYZTBQCVFPLC-CIELIIMNSA-N
CN(C)CC1=C(C=C(C=C1)NC4=NC2=C(CC3(CC2)CCOCC3)S4)F,7BD749AC899BD81D_7E5F9427886BEAB4_7022_UN,7.260154,00000000000000000000000000000000000010000010000100000000010000000110000000100100010101111001010010101100011101011001001011100100110011110110001011011111010111101111110,DXSVHFMBHKUASQ-UHFFFAOYSA-N
FC2=C1N=CC=C(C1=CC=C2)NC3CN(C)C4(C3)CCCC4,3AC4CFCC781AC7D0_3866DCBACE8C3495_6041_UN,7.9168935,00000000000000000000000000000000000000000010000000000000000000000110000000010001100101110001010010101100110110011001101011100100110001110100001001011001010010101111010,AKJFSWZUVDQGHV-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NCCC3CCN(C2CCN(C)CC2)CC3)C,2202202D169AB28B_F0392C9BA7D039A7_6041_UN,7.8040047,00000000000000000000000000000000000000000000000000000000000000100000000000010000101001100001010000101000100000010001101011100000110001010110011011011111010110101111010,XZKOEQARPMRLBA-UHFFFAOYSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)NC5CC4(CCN(C)CC4)OC6=C5C=CC=C6)F,33A1DEBA48C36B39_31E6C32A19DDBCC8_6041_UN,7.1554155,00000000000000000000000000000000000000000010000000000000010000000110000000010000100001110011010001101100110100011101101011100100110011110110001011011111110011101111110,PTSBKLJPODLEOW-UHFFFAOYSA-N
CC1=C(C=CC(=C1)N[C@@H]2CCO[C@H]2C3=CC(=C(C=C3)F)F)OC4CCOC4,2282B4E330046256_C14026DE4656DB8E_7022_UN,8.240726,00000000000000000000000000000000000000000010000000000000010000100000000010000000000100110111000111000000100101010100001010000111010011110110000111110011110011111111110,NNGBREWJBZPEHL-MDFYDDKXSA-N
CC[C@H](OCC1CC2(CO1)CCOCC2)C3=CC(=C(C=C3)C)F,5E02D6A404BD5813_05F8C97AF2D77EA5_6039_UN,7.616149,00000000000000000000000000000000000000000010000000000000010000000010000010000000000100110000000010100000010111001010001010000010110010100110000011110110110101011011110,LOGKHPBTKYQTTG-DAFXYXGESA-N
CC1=C(C=CC(=C1)N[C@@H]2CCO[C@H]2C3=CC(=C(C=C3)Cl)F)OC4CCOC4,BD8ECF5C241F3D71_F6CD5469550540B3_7022_UN,8.240713,00000000000000000000000000000000000000000010000000000000010000100000000010000000000100110111000111000001100101010100001010000111010011110110000111110011110011111111110,RRVSBKMBHLQNLV-MDFYDDKXSA-N
C2(=C1CC(CCC1=CC=C2)=O)NC3CCOC4=C3C=C(SC)C=C4,C70DAD39A215438D_2939571BBDE8B3C6_6041_UN,8.919397,00000000000000000000000000000000000000000000000000000000010100001000000000000000010000001011010001100100110001010100001000000101110011010100000111010001111011111111110,PAAOXIATGSJKLQ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N=C(S2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,BB254B9F1F8B3738_F2BA904A23085CB1_6041_UN,8.171039,00000000000000000000001000000000000010000010000100001000000000100100000000010101111101011011011010101100011100010000001011101100110001110110001011011011010110101111010,IZXVZVIHSSNNTB-YJYMSZOUSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3CN2CCCCC2CO3)F)CC4,896BD3DF45D02C8F_E197C1F056AED689_6041_UN,7.429644,00000000000000000001000000000000000000000010000000000000010000000000000000010001101001110011010100101100010111010001101011100000110011110110001011011011110111101111110,IQWCWVFEDNQURC-UHFFFAOYSA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=N3)CC4=CC(=C(C=C4)N5CCCCC5)F,ED9F0BB6FD07678A_6D9E5CBDD453151B_6034_UN,8.819168,00000000000000000000000000000000000000100010000000000000000000100100000000010100001101110011000010101100110100010000001011100100110001110110001011011011010110100111010,XFTNGMNQJZVSAQ-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)C[C@H]3[C@@H](CNC3)C4=CC(=CC=C4)F)CC#N)F,64865D0C8732D536_DEAA7971782F8802_6034_UN,7.8213444,00000000000000000000000000000000000000000110000000000000000000100100000000010000101101110011000010001100010100010000000011100100110000100110001011001011010110100111010,AJURGYRSYQNYAB-YJBOKZPZSA-N
FC1=C(C=CC(=C1)NCC2N(C)CC3(CC2)CC3)C#C,A0AAD02ECCA40B2A_1180C7BB907055E8_6041_UN,7.4687943,00000000000000000100001000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011011010110101111010,BWADGIKYODYNIE-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC4(CC3=CC=C(C=C3)F)CC4,35B73131FF807A7C_7D63337E0839379E_6041_UN,8.062339,00000000000000000000001000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100010001110110001001011011010110101111010,SVTUAVJAXMELOU-IBGZPJMESA-N
CN(CC1CNC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=C(C(=CC=C4)F)F,690F5D3D490CFB30_5A828E341DA40A5C_6041_DP,8.20908,00000000100100000000001000000000000000100010000000000000000000100100000000000101101001110010010000101000100110010001000011100100100101110110001011001011010110101111010,IUZXBWKWNYPFES-DZGCQCFKSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CCCC(O2)C3CC3)F,27B2E2831BA61723_109A0B83722C1D4F_7022_UN,7.694572,00000000000000000000001000000000000000000010000000000000010000100000000000100000001001110011010100101000000100000001001000100000110011110110001011011111110111101111110,WJALYENTVQLSDB-UHFFFAOYSA-N
N(CC12CCC(CC1)O2)C(=O)C3(CCCC3)C4=C(C=C(C=C4)F)F,2CD01C7C3D4A68A3_1DF1205E847E9ACA_6038_UN,7.6764083,00000000000000000000000000000000000000000010000000000000010000100010000000000000001100010011100110001000010100101000011000000000110010100100000011010011111111110111110,NMGNUGLRXBCBJB-UHFFFAOYSA-N
N2C[C@@H](OC1=C(C(C)C)C=C(C(=C1)C)Cl)[C@H](CC#N)C2,099D323AC59DFF33_ACD5BE4DEC255237_6035_DP,8.813742,00000000000000000000000000000000000000000100000000000000000000000000000000100000001100110011000111001001000100010100000001000011110010100110011110000111110101101111110,NRSWHQLDPZRQGE-MLGOLLRUSA-N
CC1=CC=C(C=C1)C3=C2C6=C(SC2=NC(=N3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F)CCC6,C8F7ADCA55BD25B1_14A2643867710D29_6041_UN,8.493639,00000000000000000000000001000000000010000010000100000000000000100100000000010101110101111011010010101100111110010001101011100100010001110100001011011111010010101111010,JMPPJEMBWBPCEU-BWKNWUBXSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC3=CC2=C(CCCC2)S3,CCD68FC88DAC2008_9C94932128B9D948_6041_UN,7.6684318,00000000000000000000100000000010000010000000000000000000000000000100000000100001011100101000010010101100010000001000001011000100110001010100011011011111010110101111010,WZUOCUMSEUVITG-UHFFFAOYSA-N
CC1=N[N](C(=C1)C)C2=CC=C(C=C2)NC35CC4CC(C3)CC(C4(F)F)C5,787B92EF971C5338_D514822B282FD077_7022_UN,8.08333,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010001001010000100110100011000000011101100100001110100001011001111000010101111010,SEPZHSNHGOANOK-UHFFFAOYSA-N
CC(C)C2=C1N=C(C=C(C1=CC=C2)C)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F,601FC4D5B1DA887A_F489B2A3B5547481_6041_DP,8.700257,00000000000000000000000000000000000000100010000000000010000000100100000000100101001000110011000000101100110100010000001011000100110101110110011011010111010010101111010,YLJRBMRVUPYECR-DENIHFKCSA-N
CCC4CCC1=C(C3=C(N1CCC2NCCC2)C=CC(=C3)C)C4,9EB102292FABD5AA_85E088E6CD25D71B_6034_UN,8.563625,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101000011000010001100110010010010101011100100110000000110001011011101010110101111010,RLYUNECODXMOGZ-UHFFFAOYSA-N
CN(C)CC1=CC(=NC=C1)N[C@@H]2C4=C(OC3(C2)CCC3)C=CC(=C4)F,56692A15409839B8_52F8203C5AFF99E1_6041_UN,7.770821,00000000000100000000000000000000000000100010000000000000010000000110000000100100000001110001010001101100110100011101001011100100110011110100001011011101110111101111110,UQLIFFIJTOQYIS-KRWDZBQOSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3C(CCC)CCC3)C4,8A34542249B4F12D_BA032B41931117F9_6041_UN,7.7635956,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101100011010010101100110010010011101011100100110101010110001011011111010110101111010,LPNBFHIGZYYMAQ-UHFFFAOYSA-N
C2CC1C3=C(CCC1NC2)N(C=N3)CC(CC)NCC4=C(C=CC=C4)Br,C5D9E9F85E270062_07ED0E2B44D23A5A_6034_UN,8.123111,00000000000000000000000000000000000000000000001000000000000000000100000000010101101101010011000010101100110110010010101011100100110100100110001011011011010110101111010,GSOPMGWRQVKZEN-UHFFFAOYSA-N
CN1CCN(CC1)C2=CC(=CN=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,98F8150897448F1C_56925316D0664944_6041_DP,7.577669,00000000000000000000000000000000000000000010000000000100000000100100000000010001101001110011010000101000100100010001101011100100110101110110001001011011010110101111010,CEZWVPMMTOLWHY-PGRDOPGGSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC[C@H]3[C@@H](C3)C4CCOCC4,849C34B7545C6B4D_54EDFA8324BB0D26_6041_UN,8.112777,00000000000000000000001000000000000000000010000000001000010000100100000000010000101100110011011010101100010101000000001011101100110011110110001001011011010111101111110,BUEHKKKTDNMPJX-WFASDCNBSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NC4(CC3=CC(=C(C=C3)F)C)CC4)C5,2BA62D4B13FEF567_CD34F38ED2319DAA_6041_UN,8.128912,00000000000000000000001000000000000000000010000000000000000000000110000000010000100101110011010010101100110110011001101011100100110101110110001011011111010110101111010,LPBRJEOIPXAYFK-UHFFFAOYSA-N
CC1=C(C3=C(N1CCC2CCCN(C)C2)C=CC=C3)C4CCNCC4,DE779F3C4ED065EE_F92ED93499F10F2B_6034_UN,7.9094114,00000000000000000000000000000000000000000000000000000000000000100100000000010000001101100001010010101100110010010001101011100100110000000110001011011111010110101111010,MGSLKEDGMHQABF-UHFFFAOYSA-N
O(C(=O)[C@@H]1[C@H]2C[C@@]1(CC2)C3=CC=C(C=C3)C(F)(F)F)CC4NCC=CC4,EE6D22B94A6E36F5_14D545C9F23E46F8_6031_UN,7.743165,00000000000100000000000000000000000000000010000000000000000000100010000000000000001000000001000110111000111101011000001001010010110000100110000001010011011111110111110,SUYRSLPOZAIXFT-MBWSXKIYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CC3)C4=CC(=C(C=C4)F)F,42CC5176C8CEE644_439358943084B155_6041_UN,8.781082,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100000001110100001010011011000010101111010,RKIBRSZBJZDLBE-UHFFFAOYSA-N
ClC1=CC=C(C=C1)N2C=CN(C2=O)C[C@H]3[C@@H](CNC3)C4CCOCC4,C8903E725778EAC6_40EF5F367DC096BC_6034_UN,8.154101,00000000000000000000000000000000000001000000000000000000010000100100000000010101101101110011000010101001001101100100011011100101110011110110001111011011011111110111110,VQQBRDZSWDKMFJ-YJBOKZPZSA-N
BrC1=CC=C(C=C1)N2C=CN(C2=O)C[C@H]3[C@@H](CNC3)C4CCOCC4,A869438BE03C0208_3C4B5507977C8838_6034_UN,8.154088,00000000000000000000000000000000000001000000001000000000010000100100000000010101101101110011000010101000001101100100011011100101110011110110001111011011011111110111110,SIYTZFLAMYVPJU-YJBOKZPZSA-N
CC2=CC1=C(C=C(C=N1)Br)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,90C8A77B44875C89_CD2837B0E4CBFE81_6034_UN,8.199378,00000000000100000000000000000000000000000000001000000000000000000110000000110001100101010000000010101100010110001000101011100100110000100100011011011110010110101111010,JFXDUDSXDIRBNL-MHEXWIEDSA-N
C1(=C(C2=C(C=C1)C=CC=C2)F)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,EC2157C442E4187B_557229CB79BD9CE9_7022_UN,7.815849,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101100010111010001101011101100110011110110001011011111110111101111110,PTBCCUUQCOKFLI-ICSRJNTNSA-N
C(C1C2CCOCC12)=CC5=CC3=C([N](N=C3C)C4=CC=CC=C4)N=C5Cl,DCF9378FA9A839F5_A074B1CA3E786F6D_7019_UN,8.162791,00000000000000000001001000000000000000100000000000001000010000100100000000010101100100110000001010110101010101000000001011101100110011110110001011011010010011101111110,DFFRBSJXJMPFLA-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCCC(C)(C)C2)F)CC3,BBBA8D8E283B520D_F64A08E467479997_6041_UN,7.986768,00000000000000000001000000000000000000000010000000000000000000000010000000110001101001110011010000001000000110011001101011100000110001110110011011011111010110101111010,WTLIUUDLKJEKQE-UHFFFAOYSA-N
CC1=C(C(=CC=C1)F)NC2CCN(C)C23CCCNC3,F2BBE96FAD4F126C_5A5147465078984C_6041_DP,7.9001346,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101110011010010101000110110011001101011100000110101110110001011011111010010101111010,RLVAAMWONBQOFZ-UHFFFAOYSA-N
CC1=C(C(=CC=C1)Cl)NC2CCN(C)C23CCCNC3,68DBCFF4C4D57C11_E55F8DB499A0C29C_7022_DP,7.900126,00000000000000000000000000000000000000000000000000000100000000000010000000010001101101110011010010101001110110011001101011100000110101110110001011011111010010101111010,BCGIVSOYRXGJHG-UHFFFAOYSA-N
CN5CCC1=C(C(N(C(=N1)C2=CC=CC=C2)C[C@H]4N[C@H]3CCO[C@H]3C4)=O)C5,AE64E22B1BBC2622_AD97466B22BA9285_6034_UN,7.764112,00000000000000000000000000000000000000100000000000000000010000100100000000010101100101100011110111101100110001110101111011100101110010000110001111011011111111111111110,DRYAFYATPXVALG-SNRMKQJTSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)C[C@@]34CCCN[C@H]3CCCC4,E57E92332F9FB994_DB4AD290B37EF6D9_6034_DP,8.4769745,00000000000000000000000000000000000010000000000100000000000000100110000000010110111101011011000010101101111100011011001111100100110001110110001011011111010110101111010,SOZAIPCVJUVDBK-GCXSUNMLSA-N
FC1=C(C(=CC=C1)NCC3=C(CN(C)C2CCCCC2)C=CC=C3)C4CC4,AC91D6146C5E0A77_70B511F16C7DD4B9_6041_UN,8.229103,00000000000000000000001000000000000000000010000000000000000000100000000000000000001001110001010000001000000110010001101000100100110001110010001011011011010110101111010,JBHHYJIYWFDGFH-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NCC3=CN=C(N2CCCN(C)CC2)C=C3)C4OCCO4,3FD833CB4E355047_4EB57F813CF48A4B_6041_UN,7.6868834,00000000000000000001000000000000000000100010000000000000010000100100000010010101101101110000010010101000000111010001101011110100110011110110001011011011010111111111110,ITXHWPYDFFBECV-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3=CC(=CC=C3)F)C=CC(=C4)Br)C5,3EB677A9EC729346_696ABA83CA4C8F6D_6034_UN,8.10049,00000000000000000000000000000000000000000010001000000000000000100110000000110000101101110011000010001100010100011001101011100100110000100110001011011111010110101111010,KGLQFGUTPNZVHT-JTSKRJEESA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NCC(CC)C3CCOCC3,40810B5B7448B43B_883E0DC6D2BD32CF_6041_UN,7.907432,00000000000000000000000000000000000000000010000000000000010000000100000000000000101000110011000000101100010111000010101011000100110011110110001011010111010111101111110,KNKDIRMTBGDFFO-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC3CC2(CCNCC2)C3)F,59E5292D41B2267E_4368102CC27B5311_7022_DP,7.66058,00000000000100000000000000000000000000000010000000000000000000000010000000100000001001110011010000101000110100011001001001100000110101110110001011011111010110101111010,LQRCQVPSKVUCQU-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)Br)C)NCC2=NC=C[N]2CC3CNCC34CNC4,BE164524B7004D82_6275B7C5FB992CE7_6034_DP,8.034665,00000000100100000000000000000000000000100000001000000100000000000110000000010101101101110011000010001000010110011000000011100100110101110110001010001111010110101111010,QZEUQYIVZZVWJD-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(C)CCCCN3CC4=CC=CC=C4)C5CCNCC5,8D3E200504E8C3C8_8258846DF3D70C8A_6034_UN,8.375886,00000000000000000000000000000000000000000010000000000000000000100110000000010001001101110001000010101100110110011001101011100100110000100110001001011011010110101111010,CRCVMDVMQSRKQS-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC3CCOC2(CCCCC2)C3)F,7E35D5CFB96ABAE3_FBC174A1138BB98D_7022_UN,7.278284,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110011010001101000110101011001001000100000110011110110001011011111110111101111110,JIKBUZOQWQVAHJ-UHFFFAOYSA-N
CN5CCCN(CC1=C(C=C(C=C1)NC[C@H]2[C@@]3(C2)C4=C(OCC3)C=CC=C4)F)CC5,54D4EE54C37B955F_31330C998B3E8902_6041_UN,7.593791,00000000000000000001001000000000000000000010000000000000010000000010000000010001101001110011010000101100010111011101101011100100110011110110001011011011110111101111110,CAYRJFYHVAGSII-NBGIEHNGSA-N
CCC2=C1N(C=C(C1=CC=C2)C3=CCNCC3)CC4CC4(C)C5=NC=C(C=C5)F,FDF683522B35F721_D2146C0DA6DC4BB6_6034_UN,8.6356735,00000000000000000000001000000000000000000010000000100000000000100110000000011000001101110001000010111100110110011011101011100100110000100110001001011111010110101111010,YOUDJAZJQPTZSK-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C3CCC2O3)NCC4(C(C)(C4)C)C5=C(C=C(C=C5)F)F,D43EE0BAE81A6036_23B77475C22E0026_6041_UN,7.8140187,00000000000000000000001000000000000000000010000000000000010000100010000000100000001100010011000010001100010110001001101000000100010011110100000011010111110111101111110,FEROGUSAUSADKD-UHFFFAOYSA-N
CN4CCN(CC1=C(C=CC=C1)NC[C]2(C[C]3(C2)C[CH2]C3)CF)CC4,945086229F949BA0_761CB0321BB59208_7022_UN,7.3936744,00000000000100000000000000000000000000000010000000000000000000000010000000010001101001100010010000101000010000011001101011100000110001110110001011011011010110101111010,SDGRGFDQCBMOOU-UHFFFAOYSA-N
C1(=C(C=C2C(=N1)C3(CCC2)CCC3)C#N)NC[C@H]4[C@H](CCNC4)C5=CC=C(C=C5)F,53DC7F43F08FD0FC_B0A807C70915A87C_6041_DP,7.0146823,00000000000100000000000000000000000000100110000000000100000000100110000000000100101000110011000000101100110100011000001011000100110101110110001011010011010110100111010,HKJYFMGZHUNGAY-RBBKRZOGSA-N
CC1=C(C(=CC=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)CC#N,C3EF98E8A6BA09E4_0AB5644859E60C4A_6041_DP,7.546742,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000101001000100110101110110001011010011010110101111010,FUDVAAFWLZPMIG-FXAWDEMLSA-N
N(CC1C2CC(C1)C3CC23)C(C4=C(C=CC5=C4[N](C)N=C5)F)=O,469D5CFB1E02D8F2_4C7E868C438E9D7F_6038_UN,8.369857,00000000000000000001001000000000000000000010000000001000000000000100000000010000101100010011111011001100010100100000010011101100110000100100001011001011011110101111110,KSRNJDFYVZUJMD-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)C4CC3=C(C(=CC=C3)F)O4,1048C42B8313F15B_AF0AEB5F375D588D_6038_UN,8.086689,00000000000000000000000000000000000000000010000000000000010000000000000010010000101101110011110110101100010110110101111011100000110010100110001011011001111111111111110,DIGQXDYLRVYVIQ-UHFFFAOYSA-N
CCOC(OCC)C1=C[N](N=N1)C2=CC(=C(C=C2)F)NC[C@@H]3[C@H](CN3)C4=CC=CC=C4,006C70BBDA3F1A83_0F84230EE5B9DADD_6041_DP,8.310404,00000000100100000000000000000000000000000010000000001010000000100100001000010101101100010011001111001000100101010010000011111110111101110110001011001111010111111111110,FUJIVLDFMYQIFC-WIYYLYMNSA-N
C[N]1N=C(C=C1N[C@@H]2CCO[C@H]2C3=CC(=C(C=C3)F)F)C4CCCC4,4C93E7376B84E402_4A3C708141469860_6041_UN,8.70527,00000000000000000000000000000000000000100010000000001000010000100100000000010101100100010011011111000000100101010000001011101100010011110100001010011011110011101111110,SKVHQNXKWCZUJJ-APWZRJJASA-N
FC2=C(C=C1C(=CN(C1=C2)CCC3NCCNC3)CC#N)F,14FBC4659D62280B_9A7E514398601E37_6034_UN,8.524616,00000000000000000000000000000000000000000110000000000010000000000100000000010001101101110011000010101100110100010000001011100100110100100110001011011011010110100111010,XAKKZMJRHKDIAN-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC3CCCN(CC2CC2)C3)Cl)C4CC4,06D16B1BD9DA1D8D_CB07ECDAB3DE33CA_7022_UN,7.5464363,00000000000000000000001000000000000000000000000000000000000000100000000000010000101001110011000000101001000110010000001001100000110001110110001011011011010110101111010,YNNAQUFFPWAFRP-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC34CCNC3CCCC4,8F0BEC5637232D19_917A0EC2F3E99076_6041_DP,8.206469,00000000000000000000000001000000000000000010000000000100000000000110000000010101101101010011010010001100111110011000001011100100110101110110001011011011010110101111010,PVZWUCFGHKRMFW-UHFFFAOYSA-N
C[C@@H](OCC2CC1COCCC1O2)C3=C(C=CC(=C3)F)C,350FB6945ADC0E61_5A522662042F534B_6039_UN,7.917421,00000000000000000000000000000000000000000010000000000000010000000000000010000000000100110100000010100100010101000000101010000010110010100110000011110110110101011011110,XEGSRWHSSNWTBR-DYWZDEHMSA-N
CC1=C(C(=CC(=C1)Br)C)NCC2=NC=CN2CC34C(C3)CNC4,D24A59B1ACE28EBB_85CD8DB5279A13EA_6034_UN,8.212822,00000000000000000000001000000000000000100000001000000000000000000110000000010101101101110011000010101000010110011000000011100100110101110110001011001111010110101111010,BCTPEKGBKBRDLW-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2C(CCCC2)N3CCCC3)F,18779D3FF1ABD1FA_01C9438E9A60783F_6041_UN,7.804474,00000000000000000000000000000000000000000010000000000000000000100000000000110000101101110011010010001000000100010001001001100000110001110110001011011111010110101111010,LZBFNVCDVKFYJV-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3=C4C(=CC(=C3)F)COCO4,EE9C29EB71E01737_EFDA39449EE56444_6041_UN,7.5554094,00000000000000000000000000001000000000100010000000000000010000100100000000010100101101110100010011101100010111010101101011110100110001110110001011011011110111111111110,YVDMSCZETKJQHN-KRWDZBQOSA-N
FC2=C1OC=CC1=C(C=C2)NC4CCC3(CCN(C)CC3)CC4,1A1F779F6AE92A54_FC9FC730380B6512_6041_UN,7.821481,00000000000000000000000000000000000000000010000000000000010000000010000000010000000101110010010011101100110100011001101011100100110001110110001001011001110010101111110,NBCREPVUCVRFNO-UHFFFAOYSA-N
C(C1CC2CC1C3CC23)=CC5=CC4=CC=CC(=C4N=C5Cl)C,8F0BAA6CAF2E33D5_AB24C59E35E7BC73_7019_UN,8.803316,00000000000000000001001000000000000000000000000000000000000000000100000000000000000000010000000010110101010100000000000001000100110000100100000011000010000010001111010,IQXSJTNPIQHZHE-UHFFFAOYSA-N
NCC1=CC2=C(C=C1)C(=O)C=CN2CC3=CC=CC4=C3CNCC4,C4A76FFEEC365662_9FBF6BA36B388C2C_6034_DP,8.797258,00000000000000000000000000000000000000000000000000000000000000000100000000010000001011100001000001101100110000010100001011100101110100000110001111011001111110100111110,XXAKIGUSEOBYAC-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[CH]2CC[C]3(CC2)CC[CH2]CC3)Cl)C4CC4,D679DF63431F3B30_CE9D2EEE48698920_7022_UN,7.4799585,00000000000000000000001000000000000000000000000000000000000000100010000000000000000000010010000000000001110110011000001000000000110001110000000011010011000010101111010,OFUJMFBXPWRSFS-UHFFFAOYSA-N
FC1=CC=C(C=C1)CC2=NN=C([NH]2)NCC3(C)C4CCC(C3)O4,BBF863A021D8F5F6_CFC55F378E46EAA3_6041_UN,8.26989,00000000000000000000000001000000000000100011000000001000010000000110000000000101101100010011001011001000111110011001101011001100110111110100001001010001110111101111110,NQAIFKLPEDFCGO-UHFFFAOYSA-N
CC1=C(C(=CC=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)Br,186ED7E29810BEB9_3C9DFEF43683EBEC_7022_UN,8.340292,00000000000000000000000000000000000000000000001000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110011011011111110111101111110,VCONGVPAVRGSMZ-RDJZCZTQSA-N
CC1=C(C(=CC=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)F,D1801F639E087F56_34C58003BC93508C_6041_UN,8.340286,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110011011011111110111101111110,CQAWMFNYOROHQD-RDJZCZTQSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NC[C@@]34CCCN[C@H]3CCCC4,DFE673BB637BCE20_295627FDE6396D4E_6041_DP,7.419161,00000000000000000000000000000000000000100000000000001100000000100110000000010101101100000011011010101100110010011000001011101100110101010110001011011111010110101111010,LHVFHGFFWWXOFD-AZUAARDMSA-N
FC2=C1CCCC1=CC(=C2)NC3=C([N](C)N=C3)C4CC4,CA0985A5101CA17D_E2CB5390F66796E2_6041_UN,7.194375,00000000000000000000001000000000000000000010000000001000000000100100000000010001100100010001011010000100010110000000001011101100010001110100001010011011000010101111010,JVSQXQYUZPNMBZ-UHFFFAOYSA-N
CN4CCC1=C(C=C(N=N1)NC2C(C)(C2)C3=C(C=CC=C3)F)C4,680822810570DFB8_794432A88EA2AE81_6041_UN,7.654072,00000000000000000000001000000000000000100010000000001000000000100110000000010101100001110011011000101100110100011001101011101100110001110110001011011111010010101111010,BZXRVCJBGCCNMQ-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NC4CC3(CCN(C)CC3)OC5=C4C=CC=C5,7C2F1521AC47249D_1534302ECA25EE08_6041_UN,7.9568324,00000000000000000000001000000000000000000010000000000000010000100010000000010000000001110001010001101100110100011101101011100100110011110110001011011011110011101111110,RQWCOKZUXROYRA-UHFFFAOYSA-N
BrC1=CC(=CC=C1)C2=NC=CN2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,39107703230FE8D5_A8BDD8F07F8913DE_6034_UN,8.255539,00000000000000000000001000000000000000100000001000000000000000100100000000010101100101010000010010101000000100010000001011100100110001100110001011011010010110101111010,LURDKHJQFNUZRU-UTKZUKDTSA-N
FC1=C(C=C(C=C1)NCCC2CCN(C)C2)C3OCCO3,8790D156CA0E442C_EEDAB7408D92DD8F_6041_UN,6.963835,00000000000000000000000000000000000000000010000000000000010000100000000010010000001101110001010010001000100111010001101011110000110011110110001010011011010111111111110,YLFPMNHTVPQSLY-UHFFFAOYSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NCC4(C)CCOC3(CCC3)C4)C5,28276B4A644826B3_D169557D63C38C4B_6041_UN,7.0330763,00000000000100000000000000000000000000000000000000000000010000000110000000010000101101100011010010101100110011011001101011100100110111010110001011011101110111101111110,AUCFFQJMCVSYHD-UHFFFAOYSA-N
C2(=C1OC=CC1=CC(=C2)F)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,8DA5C44EB6EF9035_F99FA25681BD9116_7022_UN,7.9834185,00000000000000000000001000000000000000000010000000000000010000000010000000100000001100010011000110001100010100001001101000000100110001110100000011010101110110101111110,YAJUAMFERGWJMS-UHFFFAOYSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(C=CC4=CN=C[N]4C)=O,395E9EE6F4BD0310_A9CA09BC98EB9FDA_6038_UN,8.029755,00000000000000000000000000000000000000000000000000000000010000000100000000010101000101000001110011010100010000100000011011100100000011010100001011011011101011111111110,LBAMFGFLAMEUIU-UHFFFAOYSA-N
CC1=C(N=C(N1CCC2CCCCN2C)C3CCCN3)C4=CC=CC=C4,4C08362BE2DE3B18_69955D03D6C0647E_6034_UN,7.8988724,00000000000000000000000000000000000000100000000000000000000000100100000000010101101101100011010010101000100010010001101011100100110000000110001011011111010110101111010,FEHHJPZGSGQQSP-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCCN3CC4CCC(C3)O4,D12FED0E6D91EF68_3FBB58CD3D09A918_6041_UN,7.693608,00000000000000000001000000000000000000100000000000000000010000000100000000010101001101100001000110101100110010010000001011100100110011010110011011011111110111101111110,QRDTYTCTRQSVRU-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CN(C2=O)C[C@H]4N[C@H]3CCO[C@H]3C4,AF78831E735CFE03_29797B9E9196F388_6034_UN,8.314787,00000000000000000000000000000000000000000010000000000000010000000100000000010001000101010011100111101100110101110100011011100101110010100110001111011011111111110111110,BGQOCMRYBJBWEE-QEJZJMRPSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2=CC=CC3=C2CCNC3,8B2A6182539674F4_DB08F8AEC6090C98_6041_DP,7.426984,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100001010000101100110000011000001011000100110101010110011011011111010110101111010,QXFRUZHXMDANKP-UHFFFAOYSA-N
CN(CC1CCNCC1)C2=NC(=NC=C2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,412C12F358D42E52_44FD5463F1FFD048_6041_DP,8.12369,00000000000000000000001001000000000000100010000000000000000000100100000000000100101001110011010000101000101110010001001011100100110101110110001011011011010110101111010,DHAMQYKAPCUUIO-JKSUJKDBSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4(CCC4)C5=C(C=C(C=C5)F)F,C8E38A3117EE9402_4CABC8F7C951DFBC_6041_DP,8.232033,00000000000100000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010010101111010,RTSVCLPATLHMNA-FSWDVZBNSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC3NC2COCC2C3,B093BC0912ECA933_63BA863926CDAC2F_6041_DP,8.0549965,00000000000000000000100000000010000000000000000000000010010000000100000000100001001100100011010111101100110001011000000011000000110101010110011010001111010111101111110,JLEGNNSYTQMISB-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC(CC)C3CCOCC3,577F632EB025BE8C_6565BEBE510CF60E_6041_UN,7.7248635,00000000000000000000000000000000000000100000000000000000010000000100000000000100000000100011000000100100110011010010001011000100110011010110011011010111010111101111110,PAUAPUZRAWNYID-UHFFFAOYSA-N
N1CCC4(CC1)CCC2=C(C=CC(=C2)NC3=CC(=C(CN(C)C)C=C3)F)O4,074F1B6012E8D67F_3440FE905FF9B5A6_6041_DP,7.181329,00000000000000000000000000000000000000000010000000000000010000000010000000100000001001110001010001101100110100011101001011100100110111110110001011011111110111101111110,RUPBXPJOAVOPID-UHFFFAOYSA-N
C1(=CC=C(C=C1)CCN2CCCCC2)NCC3C[Si](C)(CC3)C,3F399D6D5EA111A2_8E34A731C5CC3815_7022_UN,7.96293,00000000000000000000100000000010000000000000000000000000000000000000000000110000001101100011010010101000000010011001101011100000110001010110001001011101010110101111010,KXIFSKSHUMJENZ-UHFFFAOYSA-N
FC1=C(C=CC=C1NC[C@@H]2CNCC(O2)(C)C)CC#N,BC28228C81472EA6_0F27144DF7FF3096_6041_DP,7.6080914,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110011000100101000000110011001000011000000100111110110001011000111110111101111110,JVVVDOCJTMHUAS-LBPRGKRZSA-N
CN(C)CC1=C(C=CC(=C1)NCC3CCC2(CC2)C3)F,20F206012BFFEF86_290450250C92F93B_6041_UN,7.430194,00000000000000000000001000000000000000000010000000000000000000000010000000100000001001110011010010001000010100001001001000100000110001110010001010011111010110101111010,BJTTZYZJYDXIGE-UHFFFAOYSA-N
N(CCC1=C(C=CC=C1F)F)C(C23CCC(C)(C2)CO3)=O,D832EA189283B9AA_50FAF3ADEEABFA7B_6038_UN,7.8918805,00000000000000000000000000000000000000000010000000000000010000000010000010000000001100010011100110101000110111111001111000000000110010100110000011010011111111111111110,POCCSTYDLFTLDX-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2OC3(CCC2)CCC3)F,FFEC25CC57FD5968_58A8FCD2B7377BA3_6041_UN,7.0819693,00000000000100000000000000000000000000000010000000000000010000000010000000100000001001110011010100101000010100001001001000100000110011110110001011011111110111101111110,LZGRUWAWZPVPLG-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CCN(C)C3C4=CC=CS4,B7FB36B2FDE125FD_3B5748252A6DA43A_6041_UN,8.426412,00000000000000000000000000000000000010100000000000000000000000100100000000010100111101101011010010101100010010010001101011100100110001010110011011011111010110101111010,HASYHPVYXAGQGB-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N(C=C2C3CCNCC3)CC4(CC)CNC4,8D40522C29EF08E0_C7AFDF1C9F98EC96_6034_UN,8.536149,00000000100100000000000000000000000000000010000000000000000000100110000000010000101101110011000010101100110100011010101011100100110100100110001001011001010110101111010,CNWDFNKQZJPDPG-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NCC(C2CCNCC2)C3=CC=CC=C3,C74A356A9DFDA75C_7CCB06993FC41C32_7022_DP,7.9406486,00000000000000000000000000000000000000000110000000000000000000000000000000000000001000110001000000101001100100010000001001000100110101110110001011010011010110100111010,DXDWTKFIHNNFCM-UHFFFAOYSA-N
CC2=C1N=C(C=C(C1=CC=C2)C)NCC3N(C)CC4(CC3)CC4,1DBCDDA378D99272_CD2BED98ABF250FF_6041_UN,7.968052,00000000000000000000001000000000000000100000000000000000000000000110000000010101001001100011010000101100010010011001101011100100110001010110011001011111010110101111010,IIIPIIGYNOZNNY-UHFFFAOYSA-N
CCC1=C(C=CC(=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)F,A986E32530005192_4767DE0736A7EEE8_6041_DP,7.867569,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101110011010010001000000110000010000011100100110101110110001010001111010110101111010,MRLCMXNBUQKZJG-DZGCQCFKSA-N
C[N]1C(=NC2=C1C=CC=C2F)NCC4OC3(CCC(C)(CC3)C)CC4,8124C8E1CD0EDFA9_62A684EBAFFA679F_6041_UN,7.6558046,00000000000000000000000001000000000000000010000000000000010000000110000000110101001101010011010110001100011110001001101011100100110011110100011011011111110111101111110,FMBLJAOPNFLFRN-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(C4=C(C3=CC=CC(=C3[NH]4)CC)F)=O,A3FEC1B75B49B699_5B3ECF19C7748E02_6038_UN,8.273932,00000000000000000000000000000000000000000010000000000010000000000100000000000001001100010011100110011100010100100010011001000100110100100100001011010011011110101111110,GUKUUHSANJNCJB-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCC(C2)C3=CC=CC=C3)Cl)C4CC4,53A6230C78CE0E8D_D4E0B72CBCE00168_7022_UN,7.7915916,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010011000010001001000110000000001000000100110001110000000011010011010110101111010,IZZDVNQAYRXNGP-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC4C3=CC=CC(=C3OCC4)CC,501923012FC3EAF2_6DF5EBB390A0AA54_6041_DP,8.097999,00000000000000000000000000000000000000100000000000000000010000100100000000010101101101000011010011101100110011010110001011100100110111010110001011011111110111101111110,VLVWEDNHHQTGAT-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NCC2(CCC2)C3=CC=NC=C3)F)C4,984E4FBEAA08E1E3_8381D66635A26278_6041_UN,7.783973,00000000000100000000000000000000000000000010000000000000000000100110000000010000001001110011000000101100010110011010101011100100110001110110001011011001010110101111010,FVFBQXNIGGEONM-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC3CCOC(C2=CN=C[N]2C)C3)F,3770E450864A2491_F45C33F6A98FC1CC_7022_UN,7.7596474,00000000000000000000000000000000000000000010000000000000010000100100000000110101000101110010010111101000100111010001001011100100110011110110011011011111110111101111110,NNGGLBMBINWKDC-UHFFFAOYSA-N
C[N]1C=NC2=C1C=CC=C2NC3C4CC5CC3CC(C4)(F)C5,85694D7158790C6D_5EB606D60BEB1C8E_6041_UN,7.762005,00000000000000000000000000000000000000000010000000000000000000000110000000010101100101010010010010000100010100001000000011100100100001110100001001001001000010101111010,YMIYFLFNKAVXQL-UHFFFAOYSA-N
C([C@]12C[C@H]1COC23CCC3)=CC4=C[N](N=C4C)C5=CC=C(C=C5)F,FFB9DB422D291CE5_38F771C101501D25_7019_UN,8.234405,00000000000100000000001000000000000000000010000000001000010000100110000000010000100100010000001010110000010101001000001011101100110011110100001011011010110011101111110,XISLJCWQTBZTMP-LPHOPBHVSA-N
C([C@]12C[C@H]1COC23CCC3)=CC4=C[N](N=C4C)C5=CC=C(C=C5)Cl,9E555BB693ECEF9F_1A08C85FCC56F925_7019_UN,8.234406,00000000000100000000001000000000000000000000000000001000010000100110000000010000100100010000001010110001010101001000001011101100110011110100001011011010110011101111110,INOGYOMQTVHYIT-LPHOPBHVSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC4CN(CC2=CC=CC=C2)C3(CCC3)C4,CB86D8F092E1FB74_B8550F215707D934_6041_UN,7.8924885,00000000000100000000100000000010000000000000000000000000000000000110000000110001100101100001010010101000110000011000001011100100110001010110011011011111010110101111010,WVXRHYRWBQVARL-UHFFFAOYSA-N
C1(=C(C=CC(=C1)F)OCC2CCOC2)NC[C@@H]3CCCN(C)[C@H]3C4=C[N](N=C4)C,6E22665BA63F7369_A2F8DC3A9225D23B_7022_UN,8.085979,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110111011110101000000111010101101011101111110011110110001111011111110111111111110,IBRUKAZCGHKQEA-QUUZRVDCSA-N
CCNC4CCC1=C(C3=C([N]1C[C@@H]2CNCC(O2)(C)C)C=CC(=C3)Cl)C4,8AFA25E341C4BBC9_5017F83F99A5B30D_6034_DP,7.917158,00000000000000000000000000000000000000000000000000000000010000000110000000110000101101110010000110101101110110011011001011100100110111100110011011011101110111101111110,PNMCGAGAVBNZAP-LYKKTTPLSA-N
CN5CCC1=C(C4=C(N1C[C@]23[C@](C)(C2)CNC3)C=CC(=C4)Cl)C5,AA2656AB9AF837B1_D58AA85F43E35E00_6034_UN,7.5579295,00000000000000000000001000000000000000000000000000000000000000000110000000010000101101110011010010101101010110011001101011100100110000100110001011011111010110101111010,GJIWOJXESYXDSX-MOPGFXCFSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC3CCCC3C4CCCC4,3C576383B684F787_EDB2D45D5A8A47A2_6041_UN,8.082961,00000000000000000000000000000000000000000010000000000000000000100100000000100000100000010011000010100100110100010000001001000100110001110100011011010111000010101111010,IVZOMAYLENYEQJ-UHFFFAOYSA-N
NCC(C1=CN(C2=C1C=CC=C2)C[C@@H]3CNC[C@H]3C4=CN=C[N]4C)C5=C(C=CC=C5)Cl,C1928A05DFDCF32F_CD52688B7E35CA27_6034_UN,8.061096,00000000000000000000000000000000000000000000000000000000000000100100000000010101101111110011010010001101010110000000000011100100110100100110001011001011010110101111010,YCIHURDNSSKMFP-ADFYKPTQSA-N
CC1(C)[C@H]4CC[C@]1(C)[C@H](OCC3CCC2(CNC2)O3)C4,D54341C4F031FFAF_E67C8239401B3182_6039_DP,7.424242,00000000100100000000000000000000000000000000000000000000010000000010000010100000001100100011000110001000010011001001101011000011110010000110010100010111110101111101110,IESPEJQHBZGWPI-LKJGZXFDSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2N(C)CC3(CC2)CC3,2EAC411CBADA4FBC_5B60D174B7931418_6041_UN,7.9369,00000000000000000100101000000010000000000000000000000000000000000110000000110001001001100011010000101000010010011001101011100000110001010110011011011111010110101111010,RTUIQMJALFELPZ-UHFFFAOYSA-N
N(C1CC2CCC1O2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,1C3C835CBCFB57D5_38154717D31EE4E3_6038_UN,8.082297,00000000000000000000000000000000000000000010000000000000010000000100000000000000100100010011100111100100110100110010011011000100110011100100001011010011101111111111110,JSPGXGGMVSSYSW-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC(N3CCCC3)C4=CSC=C4,29A1DB5ABA039083_32A011F637A4E260_6041_UN,7.9026365,00000000000000000000000000000000000010100010000000000000000000000100000000010101001101111001000010101100010110010000001011100100110001110110001011011111010110101111010,QLLCRWPQHAYLBP-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC34CCC(CC3)CO4,924E5A9D8AC8FC19_6F0B381C8F911A1C_6041_UN,7.798573,00000000000000000000000000000000000000100010000000001000010000100110000000010101101100010011011110101000010101001000001011101100110011110110001011011011110111101111110,CUBNLRDRCXBYHA-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CC3(CCC2)CC3)F,40A6CDF8B5573C27_68303446F0EEF066_6041_UN,7.424266,00000000000000000000001000000000000000000010000000000000000000000010000000100000001001110011010000001000010100001001001000100000110001110010001011011111010110101111010,ZKEAGFKVQMCIOH-UHFFFAOYSA-N
C(C1CCNCC1)C2=CN(C=N2)CC(C)(N3CCNCC3)C4=CC=C(C=C4)Br,4F62B910F77EA67E_41A048B1DEF3F60E_6034_UN,7.890774,00000000000000000000000000000000000000000000001000000000000000000110000000010101001101110001000010101000100110011001101011100100110100100110001001011001010110101111010,PDVQUXFZYBDXOM-UHFFFAOYSA-N
C2(=C1CCCCC1=CC=C2)NC3=CN=CC(=C3)CN(C)C,37545D30C54685AF_C3FDDB526C6D6DAE_7022_UN,7.9159594,00000000000000000000000000000000000000000000000000000000000000000100000000100001100001100011010000101100010000000001001001100100110001010100001011011101010110101111010,LTGAMFWYZDYMOI-UHFFFAOYSA-N
N1CC2CCCC1C2C=CC3=C([N](C)C4=C3C=CC=C4)Cl,0D020520CDED0BF0_1FED596FA2CD865E_7019_DP,8.132246,00000000000000000001000000000000000000000000000000000000000000000100000000010000001101010011010010011101110100010000001011100100110000100100001011011011010010101111010,BJNORIFTAOEAPB-UHFFFAOYSA-N
BrC2=C1N(C3=C(C1=CC=C2)CSCC3)C[C@]45[C@](C)(C4)CNC5,0A6684182895A5D1_A0099B4B0C32C39F_6034_UN,8.607098,00000000000000000000001000000000000010000000001000000000000000000110000000010000101101111011000010101100010110011001101011100100110000100110001011011011010110101111010,ZMRAWIWFRXZQME-MSOLQXFVSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NC4CCC3(CCN(C)CC3)CC4,268847F918724C3C_9295EEA76A4A68A6_6041_UN,8.095201,00000000000000000000000000000000000000000010000000000000000000000110000000010001000001110010010000101100110100011001101011100100110001110110001011011011010010101111010,XRTZBJAIOWGYRD-UHFFFAOYSA-N
C1NCCN(C1)C2=C3C(=CC=C2)N(C=N3)C4=CC=COC4=O,691F4FD0FC2D524A_0FF2800E63544AFF_6034_UN,8.617679,00000000000000000000000000000000000000000000000000000000010000100100000000010101101101100001000110101100110000010100001011110101110001010110001111011011011010110111110,IULQYNSARDWHHU-UHFFFAOYSA-N
C1C(NC2CCCCC12)C4=NC3=C(C=CC=C3)N4CC(CC)NCC5=C(C=C(C=C5)Cl)Cl,1FBD64B9F0E84D75_D5F63BBFEE0FD025_6034_UN,8.092304,00000000000000000000000000000000000000100000000000000000000000100100000000010101001101010011000010001101110110010010101011100100110100100110001011011011010110101111010,WIQQJUZCSDPZFP-UHFFFAOYSA-N
C1(=C(N=CS1)C2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,F1670425BC5975B7_CB13669625DE6BB6_6041_UN,8.574727,00000000000000000000001000000000000010000010000100000000000000100100000000010001110101111011010010001000100110010001101011100100000001110100001010011011010010101111010,PGCOOAPGYYMCOZ-ZBFHGGJFSA-N
O[C@H](CBr)C1=C(C=CC=C1)NCC3OC2(CCC(C)(CC2)C)CC3,9E767A7D9395D6D4_20224EFB633B09A3_6041_UN,8.312901,00000000000000000000000000000000000000000000001000000100010000000010000000100000001100000011000111001000110000001001101000000000110111110111000011010111110111111111110,NNUQOFAMTLIWCN-KPMSDPLLSA-N
FC1=CC2=C(C=C1)N(C=C2C3=CCNCC3)CC45CC4COC5,91D7094969556216_2EF227B5FC88DDF6_6034_UN,8.679446,00000000000000000000001000000000000000000010000000100000010000100110000000011000001101110001000011111100110101011000001011100100110000100110001001011001010111100111110,AXVWZKDLRRGLGB-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C(CCCC2)C3CC3)F)[N]4C=CC=C4,A100FF0A9C4CF37C_BCB25F3C2F6D4B1B_6041_UN,7.818777,00000000000000000000001000000000000000000010000000000000000000100100000000010000001101010011000010001000000100000000001001100100110001110100001011011011010110101111010,XAZCLNDQXVRWAK-UHFFFAOYSA-N
C1CCC(NC1)C3=CC2=C(C=CC=C2)N3CC4CC4(C)C5=NC=C(C=C5)F,447522516B5AC868_10832BDE0A982E8C_6034_UN,8.350176,00000000000000000000001000000000000000000010000000000000000000100110000000010001001101010011000010101100110110011001101011100100110000100110001011011011010110101111010,XCKRRJZUEAZQGS-UHFFFAOYSA-N
CC4=CC1=C(C=C(C=N1)NCC2CCCN(C)C2C3=CC=CS3)[NH]4,570500FB74B403AD_8D627FDCACF12E84_6041_UN,8.363804,00000000000000000000000000000000000010000000000000000100000000100100000000010001111101101011010010101100010010010001101011100100110101010110001001011111010110101111010,PUOUKFJNSVYZSB-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NCC2(C)C3CCC(C2)O3)CC=C,1902016DE122061D_5181FA122B5EB6C8_6041_UN,7.8875337,00000000000000000000000000000000001000000000000000000000010000000010000000000000001100000011000011011000010010001001101000000000110011010100000011010111110111101111110,DRLNQDXLAFPFDQ-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C2CC2)NCC3(C)C(OCC3)C4CC4,FA8549576A64F755_754862899FE7FD05_6041_UN,7.806756,00000000000000000000001000000000000000000010000000000000010000100010000000000000001100010011000011001000000111001001101000000000110011110110000010010011110111101111110,IDWAXIJCWXXICY-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NC2=CC(=N[N]2C)C3CCOCC3,76126097B8B5287C_6A124E8646A1CE9E_7022_UN,8.455002,00000000000000000000000000000000000000100010010000001000010000100100000000010101100100110000011010110000000101000000001011101100110011110110001011011011010011101111110,RLZLNTGMKDZXCY-UHFFFAOYSA-N
O(C1CCCC12CCOCC2)CCCCC3(C)OCCO3,6B97348907B9EC6E_13B9C857DF0CEC41_6039_UN,7.046559,00000000000000000000000000000000000000000000000000000000010000000010000010000000000100100000000010100000010011001001101010010011110010000110100100110000110101011001110,NJTNPKBGKICXKE-UHFFFAOYSA-N
C2(=CC=NC3=C1N=CC=CC1=CC=C23)NCC4C[Si](C)(CC4)C,2831050A6F28C819_8F6B43E8DCD95FC0_6041_UN,8.427574,00000000000000000000100000000010000000000000000000000000000000000100000000100001101100100011010010101100010010001001101011000100110001010110001001011101010110101111010,LLQLCKCBOUZEQL-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)C#N)N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)F,A0270D55BCE14A9D_411C6FBF9636A395_6041_DP,7.9629736,00000000000000000000000000000000000000000110000000000010000000100000000000000001101000110011000000101000100100010000001001000100110101110110001011010011010010100111010,YVBCAWIPOVPCAM-GDBMZVCRSA-N
FC1=C(C(=C(C=C1)NCCN(C)CC2COCCC2)F)F,174D115B0D3EC884_AD45D5E5F49CC8B0_6041_UN,7.737339,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001011011011010111101111110,JXJFIHMNMWOXSA-UHFFFAOYSA-N
C1CC(CCN1)C2=CN(C3=C2C=CC=N3)CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,C77A05EF13CE91C9_5B9738099E22A3C0_6034_UN,8.521126,00000000000000000000000000000000000000100000000000000000000000100100000000010101001101110001000010101101110110010010101011100100110100100110001011011011010110101111010,YOEVBCWSMOEAAU-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2C=CC=C(C2=NC=C3Cl)Br)C4,E3840A144B563816_338D16323F8BA821_6035_UN,8.109956,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000010011101101010100000101001001100111110000100100001111011110110111101111110,XVNRZNSGJKHKEK-WKZPIUISSA-N
C(C1CCCCC12CCC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,070EB0F03CD7D7F9_23E52B0EFF468844_7019_UN,7.893284,00000000000100000000000000000000000000000010000000000000000000000010000000000000000001010000010010010000010110011000101000100000110001110000000011011010000010101111010,QBQYGGUBJBCOCS-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2(CCC2)C3=CC=C(C=C3)F)C4CCCC4,8733019EC2FEAB86_E8BA1C60DB17F312_6041_UN,8.019262,00000000000100000000000000000000000000100010000000001000000000100110000000010101100100010011011010000000100100011000001011101100010001110100001010011011000010101111010,FPOYXVSMFIMFQT-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C(=O)NC=C2)C3=C(C=CC(=C3)C4(CC4)C#N)F,231C2C46E671A64F_0F835C1D66CACA5E_6006_UN,8.378213,00000000000000000000001000000000000000000110000000000000000000100110000000000000000000010000100000100100010100101100010001000101000000100100001111010011001010000111110,CRZQRGGAPBDJDW-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=CC=C2)NCC34COC(C)(CC3)C4,8762B175065F99E4_ABA225A492D76C0D_6041_UN,7.1554575,00000000000000000000000000000000000000000000000000000110010000000110000000000001101100000011000011101100010011001001101011000100110111010110001011010111110111101111110,VHADHOHIDBCJIE-UHFFFAOYSA-N
C2(=C1[NH]C3=C(C1=CC=C2)CCC3)NC4=C(C=C(C=C4)[N](=O)=O)F,BE5D96598E01160B_4DBC3D4C76A10C6A_6041_UN,8.696162,00000000000000000000000010000000000000000010000001000010100000010100001100000001000100010011001010000110110100010000001101101100011101110100001011011011000010110111110,XMAZYOVSGGKBCW-UHFFFAOYSA-N
NCC(OC1=C(C=C(C2=C1N=C(C)C=C2)Cl)Cl)CCC3CC3,82EEC2788388ACEC_D435F3EEB529049F_6035_UN,8.075521,00000000000000000000001000000000000000000000000000000000000000000100000000000000001010010011000100101101010100000100001001000111110010100100001111010011110111101111110,IEBOLPRRMDHSAA-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C#N)[N]2C=C(C=N2)NC3CNCC4(C3)CCOCC4,9423DF4C95495E82_10AC2CEC5D742C19_6041_DP,8.061338,00000000000000000000000000000000000000000110000000001010010000100110000000010001101100110011001010101000110101011000001011101100110111110110001011011011010011100111110,RSGLAXBYCZGVQF-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C(CCCO2)OCCN3CCOCC3)NCC4C(OC)COCC4,3D0EF12940D066C9_28F775D5A98AE043_6041_UN,7.7972565,00000000000000000001000000000000000000000000000000000000010000000000000010010000001001100111010101101100010011010100101011100011110011010110101111111011110111111111110,GCYYRPMKGJGZCB-UHFFFAOYSA-N
CN3CCO[C@@H](CNC(C2CC1CCC(N1C)C2)=O)[C@@H]3C4=CC=CC=C4,F0D169D125F4F113_92C23279A066853F_6038_UN,8.376831,00000000000000000001000000000000000000000000000000000000010000100000000000010000101101100011110110101000010011110001111011100000110010000110001001011111111111111111110,PAOCBWINWQBATA-OQPPHWFISA-N
N2CCC(OC1=CC(=C(C(=C1)F)C#N)F)CC2C3=CC=C(C=C3)F,6C9048066F28773F_D92620A78CB02018_6003_DP,7.983341,00000000000000000000000000000000000000000110000000000000000000100000000000000000001000010001000001101000100100010100001001000111110010100100001111010011110011100111110,GZFCMDNZNVGKFG-UHFFFAOYSA-N
C1CC(CCN1)C2=CN(C3=C2C=CC=C3)CC4CCCN4CCC,36ECFB41882EB60B_E877B495FB08AEB0_6034_UN,7.9857454,00000000000000000000000000000000000000000000000000000000000000100100000000010001001101100001000010101100110010010011001011100100110000000110001001011011010110101111010,MVFAZUXDTUTWPO-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC(CC)NCC3=C(C=CC=C3)Br)C4CCNCC4,E58B8FACFE41C145_E62F75E0C0B87B06_6034_UN,8.699715,00000000000000000000000000000000000000000010001000000000000000100100000000010001001101110001000010101100110110010010101011100100110100100110001011011011010110101111010,CTJXTANQGYAHRZ-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)F)F)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,A48058A2B414FB9B_D3455322617B5212_7022_UN,8.80175,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,GJZIJQRRBUSRNR-BLVKFPJESA-N
C1(=C(C(=C(C=C1)Cl)Cl)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,92BE061F1AAF9BFE_3E741E30BF398014_7022_UN,8.801749,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,AGULVFQLJFJHFF-BLVKFPJESA-N
C1(=C(C(=C(C=C1)Cl)F)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,95F222E1B55BBEEE_38557F681C93FC6F_7022_UN,8.801745,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,XCWXLVBWKAUHQU-BLVKFPJESA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OCCN2C(C)(COCC2)C)C3,D1C66F43574C683A_B869BCE64C00242B_6039_UN,6.997471,00000000000000000000000000000000000000000000000000000000010000000010000000110000000001100000010111101000010011011001101011100011110010000110011101011110110111111101110,IWPNETCQFREARS-VVLHAWIVSA-N
N(C1C2CC3CC1CC(C2)(F)C3)C(=O)C4(CCCC4)C5=C(C=C(C=C5)F)F,4E9C17544DD7D60C_CDD219CB086BD012_6038_UN,7.050241,00000000000000000000000000000000000000000010000000000000000000100010000000000000000000010011100010000100010100101000011000000000110001100000000011010011001010100111110,AWRLCGRPSITTMJ-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)N[C@H]3[C@@H](C3)C4=C5C(=CC=C4)OCCO5,1136BF35998A5BE8_EBBCE2DDDDF2F0BE_6041_UN,7.9913845,00000000000000000000001000000000000000100010000000001000010000100100000010010101100100010010011010100100110101010100001011101100000011110110001011011011110011111111110,SRKIRAKAVRKFFK-GOEBONIOSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC(C)C3CCCCC3,EC594AC7842737A5_4B36EA583FD5AF38_6041_UN,7.7817807,00000000000000000000000000000000000000100010000000000000000000000100000000000100001000010001000000101100010110000001101001000100110001110100011011010111010110101111010,UKYBMEDHUDRAIN-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)NC24CC(OC23CCNCC3)(C)C4,18FD4F91D4942995_737B93450FCB8C4E_6041_DP,7.9333854,00000000000100000000000000000000000000000010000000000000010000000010000000000000001100110011000111101000110110011001001011000000110111110110001011010111110011101111110,FNPGLRXCKSCKFK-UHFFFAOYSA-N
CC1=C(C=C(C=C1)Cl)NC24CC(OC23CCNCC3)(C)C4,D30686B4DE84DB9A_E2E262901D87E5D6_7022_DP,7.9333744,00000000000100000000000000000000000000000000000000000000010000000010000000000000001100110011000111101001110110011001001011000000110111110110001011010111110011101111110,NPVUACAXXXKXPQ-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4(COC4)C5=C(C=CC=C5F)F,AE222512EEED7D30_47774E30CC786F22_6041_DP,8.31824,00000000100100000001000001000000000000100010000000000000010000100110000000000100100101110011010110100000111101011000101011100100110101110110001011011011010011101111110,ZVZOVQVZTUHZBW-QDMKHBRRSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2(C)CCOCC2)F)CC3,5F659FDC1B8CBC2F_01C29098D4AA5DCC_6041_UN,7.2529974,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110010010001101000100111011001101011100000110011110110001011011111010111101111110,KRNAZFIYNHWMIC-UHFFFAOYSA-N
FC1=CC3=C(C(=C1)NCC2CCCCN(C)C2)C=NC=C3,BAB7555EE5C477E2_81D568DD7D619519_6041_UN,8.49784,00000000000000000001000000000000000000000010000000000000000000000100000000010000101001110011010000101100010110010001101011100100110001110110001001011001010110101111010,JAUAOKBRJHXNOT-UHFFFAOYSA-N
FC1=CC2=C(C=C1)[NH]C(=C2)NCC3CCCN(C)C3C4=CC=CS4,ACD3388857603002_5B10A32808DE129C_6041_UN,8.444708,00000000000000000000000000000000000010100011000000000000000000100100000000010100111101111011010010101100010110010001101011100100110101110110001001011011010110101111010,LSLRFMXLUHOQNI-UHFFFAOYSA-N
C(C1CCC2(CC1)OCCO2)=CC4=CC(=C(N3CCN(C)CC3)C=C4)F,427424E4C43F21DB_41E2B861996407D9_7019_UN,7.074561,00000000000000000000000000000000000000000010000000000000010000100000000010010001000101110000010010111000010101011001101011110000110011110110001011011010110011111111110,SBXIAFGZBPYOLY-UHFFFAOYSA-N
C(C=CC1CCCCC1)=CC2=C[N](C)N=C2C3=C(C=CC(=C3)F)F,2F73F69320CACF1C_E831FD2691BA0A88_7019_UN,8.592878,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010000000100000000001011101100110000100100001011011010000010101111010,SAMQMUBNVWNMSJ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3C[C@@H]2CSC[C@H]2C3)F)CC4,623F875CE4234326_DBE0A2529542DE76_6041_UN,7.6708965,00000000000000000001000000000000000010000010000000000000000000000000000000010001100101111001010010001100110110010001101011100000110001110110001010011011010110101111010,CNZUTDGOQQKCPF-IAGOWNOFSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3CC4CC3C5CCCC45,B2F839510785CE7D_6E7740C9EAD25DAF_6041_UN,8.364539,00000000000000000000000000000000000000000010000000001000000000000100000000010000100100010011011010000100110100010000001011101100110001110100001001011001000010101111010,VBJRMYGEMLMMFM-UHFFFAOYSA-N
BrC1=CN=C(N(C1=O)C[C@H]2[C@@H](CNC2)C3=CC(=CC=C3)F)C4CCC4,71BD38DAE44F6B81_F4844BF362BEFE4A_6034_UN,8.088126,00000000000100000000000000000000000000100010001000000000000000100100000000010100101101110011100011101000000100100100011011100101110000100110001111011011011110100111110,JDHIKEGWYXGWJS-HOCLYGCPSA-N
CCC4CCC1=C(C3=C(N1CC(C)CC2=CC=N[N]2C)C=CC(=C3)C)C4,B25C4FA5A2C45B00_368F5556E3DD75AF_6034_UN,8.53094,00000000000000000000000000000000000000000000000000001000000000000100000000010000100101000000011010001100010010010011101011101100110000000100011011011110010110101111010,QHWBNYZYNAMMSD-UHFFFAOYSA-N
N1CCC5(CC1)CCC2=C(C=CC(=C2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F)O5,7A8F565F464F7C38_A910C1E35409BE68_6041_DP,8.342504,00000000000000000000000000000000000000000010000000000000010000100010000000010001101101110011010011101100110110011101101011100100110111110110001011011011110011101111110,UVZBSWMHWLBGSV-GGAORHGYSA-N
CC1=C(C=CC(=C1F)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)C#N,6E74CA8533D3CF4A_9B89B7AD3677F371_6041_DP,8.401449,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010101111010,PNTLRIOMJNSQLE-RDTXWAMCSA-N
COC1=CC(=CC=C1)NC24CC3CC(C2)CC(C3(F)F)C4,CD91FB844E2C8EA0_0B4E6568DD444503_7022_UN,7.8352156,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010001010001000100110100011100000000000011100001110000000101000001100011101111110,ZXXIIPBORSRVCP-UHFFFAOYSA-N
FC1=NC2=C(C=C1)C=C(C=C2)NC3(CC3)C4CCCCC4,4CF7FF2EF94D4CFC_0784AB356EE0DADA_6041_UN,8.504783,00000000000000000000001000000000000000000010000000000000000000100110000000000000000000010011000000100100110100011000001001000100110001110100001001010001000010100111010,XERZTCHVNLAUPI-UHFFFAOYSA-N
CC1=N[NH]C(=N1)CC2=CC=C(C=C2)NC3CC4CCC(C3C)N4,831B0962E92C848F_78368D054EA7E449_6041_DP,8.295413,00000000000000000001000000000000000000100000000000001100000000000100010000000101100100000011001010100000110010010000101011001100110101010100001001010111000110101111010,UPJYNEBFNDLUQO-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CC2)N3CCOCC3)F)CC4,491B5CE5DC635BA9_54FB42D40B7DA512_6041_UN,7.997361,00000000000000000001001000000000000000000010000000000000010000100010000000010001101001110011010100101000000111011001101011100000110011110110001011011011010111101111110,IKCHXJIMGMOUPQ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2C[C@H]4C[C@@H]3CNC[C@@H]3N4C)C5CCNCC5)F,758C289A40DCA85E_6D2011E47A97B954_6034_UN,8.645547,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101100110110010000101011100100110100100110001011011011010110101111010,CQOXEUNWRRXZGS-HLIPFELVSA-N
CN(CC1=NC=C(N=C1)NC2C(C)(C2)C3=C(C=C(C=C3)F)F)C4[C@@H]5CNC[C@H]45,533B35B40E412B8D_F645E3FD7D678BB9_6041_DP,8.0442505,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011001100011100100110101110110001011001111010110101111010,XKOFYIRDAOKJBS-QYCBYKEFSA-N
CC1=C(C=C(C(=C1)NCC2CCNCCC2)Cl)C3CC3,ECB6ED0222285531_B004F706BF1CA48E_7022_DP,8.14655,00000000000000000001001000000000000000000000000000000000000000100000000000000000001000110011000000001001100110010000001001000000110101110110001010010011010110101111010,LRLIRNVFJZQEGA-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC(CC)NCC3=C(C=CC=C3)Br)C4=CCNCC4,EDA1BF279F0A603A_0377BFBBBC1EE72C_6034_UN,8.272339,00000000000000000000000000000000000000000000001000100000000000100100000000011001001101110001000010111100110110010010101011100100110100100110001011011111010110101111010,QLGCCXBJQJPKGP-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NCC4CCN(C4)C5=CC(=C(C=C5)F)F,A4E61E33A0E970D8_BF5235929F10761E_6041_DP,8.154024,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101110011010010101000010110010000001011100100110101110110001011011011010110101111010,FUAXUKCDDDGUOL-LHCFHALZSA-N
CC1=C(C=C(C(=C1)N[C@H]3[C@H](C2=CC=N[N]2C)C3)Cl)C4CC4,81221E170D642453_6D920A73806B12CB_7022_UN,8.5322895,00000000000000000000001000000000000000000000000000001000000000100100000000010000100100010010011010000001100110010000000011101100000001110100001010011111000010101111010,JRVPMXVVWLPHFK-UKRRQHHQSA-N
CC1=C(C3=C(N1CCC2CCCCN2C)C=CC=C3)C4=CCNCC4,996A53227BFC57D1_C81B3653624A029B_6034_UN,8.039877,00000000000000000000000000000000000000000000000000100000000000100100000000011000101101100001010010111100110010010001101011100100110000000110001011011111010110101111010,FHDSSMGGAFEHFY-UHFFFAOYSA-N
C2CC1C3=C(CCC1NC2)N(C=N3)CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,338A3AFDBB2423D3_F08374A005473C1A_6034_UN,8.271726,00000000000000000000000000000000000000000000000000000000000000000100000000010101101101010011000010101101110110010010101011100100110100100110001011011011010110101111010,HINLEYRQNPYRED-UHFFFAOYSA-N
C1(=CC=C(C=C1)CCN2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,6B2A93C6F1320324_8B16388E8F71CAC2_6041_UN,8.429936,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011010110101000100111010001101011100100110011110110001011011011010111101111110,TWMGHUYITHIETC-PKTZIBPZSA-N
FC2=C1C=NC=CC1=CC(=C2)NC3CN(C)C4(C3)CCCC4,890648AA085367D5_0961417423794DAC_6041_UN,8.072059,00000000000000000000000000000000000000000010000000000000000000000110000000010001100101110001010010101100110110011001101011100100110001110100001001011001010010101111010,ZKWHHZOFNNSJDD-UHFFFAOYSA-N
CN(C)CC[N]1C=CC2=C1C=C(C=C2)NCC3(CCC3)C4=C(C=CC=N4)F,EA4EEF6F75B62E3F_FCA0D2F3EDBCCE38_6041_UN,7.9217734,00000000000100000000000000000000000000000010000000000000000000100110000000110001101101110011010010101100010100011001101011100100110001110110001011011111010110101111010,LMVTWFSZXZFHSK-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NC3CCC(C)CC3N5CCC4=C(C=CC=C4)C5,D294031607D25126_B9711E5F85B611AF_7022_UN,8.492661,00000000000000000000000000000000000000000010000000001000000000100100000000010001100101110011001010101100110100010001101011101100110001110110001011011011010110101111010,IZQHQYFFNRJOBX-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NCC3(C2=CC=CC(=C2)C)CCCC3)F)C4,5437A5831EFD6E19_E63308AE5571DB2F_6041_UN,7.588972,00000000000000000000000000000000000000000010000000000000000000100010000000010000001001110011000010101100010110011010101001100100110001110110001011011101010110101111010,OJLONDDUINUWON-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NCC3=C(C=N[N]3C)C4CC4,F240335FF3989D82_4B7A408FFFD566BA_6041_UN,7.853129,00000000000000000000001000000000000000000010000000001000000000100100000000010001101100010011011010001100010100010000101011101100110001110100001010011011010110101111010,PXGUPTFFQCENSK-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC3=CC=CC4=C3CN(CCN(C)C)C4)F,ED104367FA924B2E_86E8BC642080A31D_6041_DP,7.367946,00000000000000000000000000000000000000000010000000000000000000000000000000110001101101110011010010101100110100010001101011100100110101110110001011011111010110101111010,KXIPMPQEWPWXDN-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CCCC23CCCC3)Cl)C4CC4,08E4392A61946CC9_8336885DCB6039E4_7022_UN,7.480972,00000000000000000000001000000000000000000000000000000000000000100010000000000000000000010011000010000001110110011000001000000000110001110000000010010011000010101111010,GSEQXTKVHDHBNW-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@H]3[C@H](C2=CC=N[N]2C)OCC3)Cl)C4CC4,1F947191F8461DFB_ED59F353A8F8CB27_7022_UN,8.77586,00000000000000000000001000000000000000000000000000001000010000100100000000010000100100010011011111000001100111010000001011101100000011110100001010011111110011101111110,LIHDBXWSQQEABD-CRAIPNDOSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC4CCCN(CC3=CC=CS3)C4,F24E5D5AA339902D_43A062C2EC34A3FC_6041_UN,7.9753494,00000000000000000000000000000000000010100010000000000000000000000100000000010100111101111011000010101100010110010000001011100100110001110110001011011111010110101111010,HFUNCUAKQYTREQ-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC(C3CCOCC3)C4=CC=C(C=C4)F,4B78C020DB4D9443_D8997E6ED9696994_6041_UN,8.049178,00000000000000000000000000000000000000000010000000001000010000000100000000010000100100110011011010100100010101000000001011101100110011110110001001011001010011101111110,JYMMPNQYTDJXGK-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCCC34CCOCC4,6C9B634FD1BD87BD_AE75D373FF42B112_6041_UN,7.243767,00000000000000000000000000000000000000100010000000000000010000000110000000000100001000110011000010101100010111001000001011000100110011110110001011010111010111101111110,UXAKGLSJGOBVQQ-UHFFFAOYSA-N
NCC23CCCC(CN(CC1=CC=CC=C1)C2)C3OC4=C(C(=CC=C4)C5=CN=CC=C5)F,FD81B265931C35F2_537F92D4A0CF422C_6035_UN,8.3655815,00000000000000000000000000000000000000000010000000000000000000100110000000010000101011110011000001101100010100001100001011100111110000100110001111011011110101100111110,HMODWUMNZIAXIF-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC3CCCN(CC2=CC=CS2)C3)F,07DC1F9BC5A8FCEA_65C210FEF263C17B_7022_UN,7.8237987,00000000000000000000000000000000000010000010000000000000000000000000000000110000111101111011010010101000000100010001001011100100110001110110001011011111010110101111010,GPPCOCSNWYMTMT-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C(=O)C3(CCC3)C4=C(C(=CC=C4)Cl)F,DA5C04CFD864820F_1453E79B486518AC_6038_UN,7.4859037,00000000000100000001000000000000000000000010000000000000010000100010000000010001001101110011100110101001110100111000011011100000110010100110001011011011111111110111110,GTUKMKIEVFIPOU-UHFFFAOYSA-N
C1(=C(C(=CC=C1Cl)Cl)Cl)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C,F6EECBA9AAEBC038_571286ECE87D0D36_7022_UN,8.848723,00000000000000000000000000000000000000000000000000000000000000100100000000010101101101110011010010101001000110010001101011100100110001110110001011011111010110101111010,OEPHCLVUCWZTRI-APPDUMDISA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CNC3)C4=NC=C(C=C4)F,CC13411D742AE0D2_510BECF8522A3B07_6041_DP,7.9242096,00000000100100000000000000000000000000100010000000000100000000100110000000010100101101110011010010101000000110011001101011100100110101110110001011011011010110101111010,OJBCBBKVLHWMSD-INIZCTEOSA-N
C(C1CN1CC2CC2)=CC3=C[N](C)C4=C3C=CC(=C4)Cl,4A3EBAE2166631F8_988978967BD869D9_7019_UN,8.763107,00000000000000001000001000000000000000000000000000000000000000000100000000010000000101110000010010011101010100000000000011100100110000100110001000011010010110101111010,IWLIPDXNJRSWMQ-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NCC2C3(CCNC2)CCC3,7C016D65458A83C9_6E9B45586B65CA6A_6041_DP,7.362502,00000000000100000000100000000010000000000000000000000100000000000010000000100000101000100011010000101000110000011000001001000000110101010110011001011101010110101111010,VDEJGQGNLFVCCT-UHFFFAOYSA-N
C(C1(CCC1)C2CCCCO2)=CC3=C[N](C)C4=C3C=CC(=C4)Cl,BAE6A2581DA6ADD2_E69E3FD6D2D16AA7_7019_UN,7.9907675,00000000000100000000000000000000000000000000000000000000010000100110000000010000000101010000010010110101010101001000001011100100110010100100000001011000110011101111110,QEDUOWSVDDQPGC-UHFFFAOYSA-N
CCC(C)C1=CN(C2=C1C=C(C=N2)Br)C[C@H]3[C@@H](CNC3)C4=CC(=CC=C4)F,7668C16B3A953A5F_B0142F12DE6A2B57_6034_UN,8.728563,00000000000000000000000000000000000000100010001000000000000000100100000000010100101101110011000010101100010100000011000011100100110000100110001001001111010110101111010,YHPSCOYHFIOYPZ-XAXWGMKYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=NC=C3)NCC(CC)(CC)C4=CC=C(C=C4)F,0AEB25D9B1C63743_C41C9B7F9C812175_6041_DP,8.331529,00000000000000000000001001000000000000100010000000000000000000000110000000000100101101110011010010101000011110001010100011100100110101110110011001001101010110101111010,QEDHYLFNCKZLQI-UFRUDQCGSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=CC=C5)F,CBA29BC2A385CD91_C89DC6244408A91C_6041_UN,7.5347967,00000000000000000000000000000000000000000010000000000000000000100100000000010001100101110011010010101100110110010001101011100100110001110100001011011111010010101111010,JISDRAAUOWZYJA-RDGATRHJSA-N
NC[C@H](OCC1OCCC12CCNCC2)C3=CC=C(C=C3)F,BFFDD72B3D3D3425_CCCA2BD16AEAC99A_6039_DP,8.113226,00000000000000000000000000000000000000000010000000000000010000000010000010000000001110110001000110101000110101011000001011000010110110100110001001010001110101110111110,IVCJOSIWLJPBCR-VYRBHSGPSA-N
CN(C)CC1=C(C=CC(=C1)NC3=NC=C2CCCCCC2=C3)F,3E04E3220D0A5677_8D7B2CC390D4CCE8_7022_UN,7.4459987,00000000000000000001000000000000000000100010000000000000000000000100000000100100000001110001010000101100010100000001001001100100110001110100001011011111010110101111010,BPSSEKYKFNYKQC-UHFFFAOYSA-N
N(CCC1=C[NH]C2=C1C=C(C(=C2)Cl)F)C(C34CCC(C)(C3)CO4)=O,42077619D1014A20_FEC0E0FBE6341DAD_6038_UN,8.348844,00000000000000000000000000000000000000000010000000000000010000000110000010000000001100010011100110101101110111111001111011000100110110100110001011010011111111111111110,QBVYBUHYUZZPMW-UHFFFAOYSA-N
N(CCC1=C[NH]C2=C1C=C(C(=C2)F)F)C(C34CCC(C)(C3)CO4)=O,AD3BED5185E066E1_7A8636626338412A_6038_UN,8.348844,00000000000000000000000000000000000000000010000000000000010000000110000010000000001100010011100110101100110111111001111011000100110110100110001011010011111111111111110,AUKCEYLDKXGGHG-UHFFFAOYSA-N
N(CCC1=C[NH]C2=C1C=C(C(=C2)F)Cl)C(C34CCC(C)(C3)CO4)=O,3157756990946D4F_9CF270E125DD32B3_6038_UN,8.348835,00000000000000000000000000000000000000000010000000000000010000000110000010000000001100010011100110101101110111111001111011000100110110100110001011010011111111111111110,GJGJQQMKCCMIQT-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CCC2CCCCCC2)C=CC(=C3)Br)C4,1A14099953DF3039_4C68D2E8647DA47D_6034_UN,7.3659925,00000000000000000001000000000000000000000000001000000000000000000110000000110000000101010000000010001100010100011001101001100100110000100100000011011100010110101111010,LNRMOYNESFGZHW-UHFFFAOYSA-N
BrC1=CC2=C(N=C1)N(C=C2C#N)CC4[C@@H]3C[C@@H](C3(C)C)CC4,5E3F6C1DBF8F5169_8C588EB8D03C543A_6034_UN,7.205207,00000000000100000000000000000000000000100100001000000000000000000110000000110100100101010000000010101100010110001000101011100100110000100100001001011100010110101111010,CSVLNSSWGGZDIP-DKGPUHFJSA-N
CC1=C(C=C(C(=C1)NCC2CCCC23CCNCC3)Cl)C4CC4,D7B59FDEA12017FE_E16E42AB6E452BAF_7022_DP,7.7212076,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000110011000010101001110110011000001001000000110101110110001011010011010110101111010,SLLFZWHZZZVXLH-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC3CCC2(CCNCC2)CC3)F,0D78A71847DECABB_0C0574DCB1713922_7022_DP,7.645445,00000000000000000000000000000000000000000010000000000000000000000010000000100000001001110011010000101000110100011001001001100000110101110110001011011111010110101111010,QERQQSBLVGXDOE-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2(CCCCCC2)C3CC3)Cl)C4CC4,8EF82D11E9D4A1E6_0DCED8E6C8BB3F8F_7022_UN,7.6362844,00000000000000000001001000000000000000000000000000000000000000100010000000000000000000010011000000000001100110011000001000000000110001110000000010010011000010101111010,BBASKUKEBQGYRW-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2C[C@@H]3CCCO[C@H]3C4=C[N](C)N=C4)C5=CCNCC5,D705B4C01493ACBD_42DBB60E0826AD50_6034_UN,8.273343,00000000000000000000000000000000000000000010000000101000010000100100000000011000101101110001011011111100110101010000001011101100110010100110001001011011110111101111110,QQIQLXOJCLZFHN-GAJHUEQPSA-N
FC1=C(C=CC=N1)NCC2CCCN(C)C2C3=CC=CS3,4ADF56EF4D0FD654_668056944A2A9E28_6041_UN,8.565437,00000000000000000000000000000000000010000010000000000000000000100100000000010001111101111011010010101000000110010001101011100100110001110110001011011011010110101111010,BQDNHXKQRGYBBW-UHFFFAOYSA-N
N(C1=CC(=CC(=C1)F)C#N)C(C2C3CCCC2CN3)=O,A92A03440B4BAC29_2DB16A13FB001C14_6038_DP,8.38741,00000000000000000001000000000000000000000110000000000100000000000000000000000000101100010011100011001000110100110000011001000000110101110100001001010001011010100111110,HBTWONBDIVXDDA-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(CCCC3)C4=CC=CS4,0E713B0D8B5E50DB_6A8C92F9BFFEE084_6041_UN,7.834288,00000000000000000000000000000000000010100000000000000000000000100110000000000100011100001011000010101100010010001000001011000100110001010100011011010111010110101111010,KUUIDEIFYDHNQC-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4=C(C=C(C(=C4)F)F)F,D7B016BD32D71B1C_35904DA2C7255CCB_6041_DP,8.28459,00000000000000000001000001000000000000100010000000000000000000000100000000000100100101010011010010100000111100010000101011100100110101110100001011011011000010101111010,RSQSAYQRVDWLAS-ZSBIGDGJSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)C[C@]34CCC[C@H]3NCC4)Cl,66E6B04663559469_AACAC09090337C05_6034_UN,7.433898,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101011011000010001101111110011000001111100100110101110110001010011011010110101111010,KMSMKGLXYYPMQR-VQIMIIECSA-N
CN1C(CCCC1)CC=CC3=CC(=C2OCOC2=C3)C4=CN=CC(=C4)F,C9AAE137B6CBD0CA_C80DF07CBA0E78C7_7019_UN,8.322403,00000000000000000000000000001000000000000010000000000000010000100100000010010000000101110000010010111100010111010101101011110100110000100110001011011010110111111111110,HFAQVXDQIWTDRL-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CCCCC23CCC3)Cl)C4CC4,2470A2A815BB5020_F719D54BA5416531_7022_UN,7.4712358,00000000000100000000001000000000000000000000000000000000000000100010000000000000000000010011000000000001110110011000001000000000110001110000000011010011000010101111010,ROPRIBUCHRECJV-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)NC2CCCC(C2)C3=CC(=C(C=C3)F)F)C4[C@@H]5CNC[C@H]45,42A95F1A9FDA63F7_1E30980EEAC19C02_6041_DP,7.8701377,00000000000000000000001000000000000000100010000000001000000000100100000000000101101101110011011010101000110110010001001011101100110101110110001011011011010110101111010,PNWBUINHGDVJEZ-XDOHPFIESA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NCC3CC4(C3)C5CCC(C4)C5)C,9882C3480E3C7D1F_0AA56BD6127EA022_6041_UN,7.795553,00000000000100000000000000000000000000000010000000000000000000000110000000000000101000010010000010101100010110001000001001000100110001110100001011010111010110101111010,FQDLAGVVUJEMIL-UHFFFAOYSA-N
CC(C)(C#N)C1=C(C=CC(=C1)NCC23CC2CNC3)F,E0AFEB50C9876D8F_6492D273D4BF9746_6041_DP,7.8076196,00000000000000000000001000000000000000000110000000000100000000000010000000100000101100110011000010101000010100001000000001000000110101110110001011000111010110101111010,MHCNBEUOFYIZJX-UHFFFAOYSA-N
CC1=NC4=C(C(=C1C2CC3CCC(C2)N3)CCN)C=CC=C4,BA3D8165DDDDEDE1_420ADA1D28987EB1_2201_DP,8.110849,00000000000000000001000000000000000000000000000000000000000000100100000000000000001110000011000010101100110010010000001011000100110100000100001011010011010110101111010,WKKWUFRYQGGZJE-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NCC(OC)C2CCCOC2)F)F,76C9CA8F4D3D0F90_3B29AD354D6DF79C_7022_UN,7.608098,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110101010100101000000111000000101000000010110011110110000011010111110111111111110,XGYPXRNHMMOTBQ-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)NC2CCOC(C2)C3=CC(=CC=C3)F)C4[C@@H]5CNC[C@H]45,2587328CAED58C9B_F06EF6ED7B163D8F_6041_DP,7.8618913,00000000000000000000001000000000000000100010000000000000010000100100000000000101101101110011010011101000110111010001001011100100110111110110001001011001110111101111110,DCMLFNBSIWLCGZ-FLANIQCISA-N
N4CC1=C(C=C(C=C1)NC(CC)CC2=CC=C(C=C2)F)C3(CC3)C4,5951E8183F213A1E_2F34FB8520717759_6041_DP,7.6461706,00000000000000000000001000000000000000000010000000000000000000000010000000000000001000110011000000101100110100011010100001000100110101110110001011010001010110101111010,NKOQRAIOBDYJCQ-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CO2)NCCC4CCN(C3CCN(C)CC3)CC4,F34AF4983CB43A13_92F7E0C6CC40176E_6041_UN,7.640617,00000000000000000000000000000000000000000010000000000000010000100000000000010000101101110001010110101100110100010001101011100100110001110110001011011011110110101111110,CVJKTIHWLAGYDN-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC[C@H]2OCCC2)F)CC3,628DCE06C2B57988_57563FD2D8C58998_6041_UN,7.084461,00000000000000000001000000000000000000000010000000000000010000000000000000010001101101110011010110001000000111010001101011100000110011110110001010011011110111101111110,RZFUQNYYPOSMQV-KRWDZBQOSA-N
CC1=C(C=C(C(=C1)N[C@H]2[C@@H](C2)C3=C4C(=CC=C3)OCCO4)Cl)C5CC5,EBC638589A7ECB00_FBEB7DAD6E41ECD7_7022_UN,8.5397415,00000000000000000000001000000000000000000000000000000000010000100000000010000000000000010010000000100101110111010100001010000100000011110110000011010011110011111111110,LRWCAZJYHDRTQB-FUHWJXTLSA-N
FC2=C1C(=C[NH]C1=CC=C2)NCC3CC4CCC3N(C)C4,C697B99A7271462B_A0A77F91A5D847C2_6041_UN,8.231592,00000000000000000000000000000000000000000010000000000110000000000100000000010001101101110011010010101100010110010001101011100100110101110110001001011001010110101111010,MTJFUIYISVKCEQ-UHFFFAOYSA-N
BrC1=CC2=C(N=C1)N(C(=N2)C3=NC=CC=C3)CC5[C@@H]4C[C@@H](C4(C)C)CC5,250CBF0B29A39AFB_41A193A84BBE189B_6034_UN,8.391018,00000000000100000000000000000000000000100000001000000000000000100110000000110101100101010000000010101100010110001000101011100100110000100100001011011110010110101111010,XRNUQTOYXNMRNF-DSUHRAPHSA-N
FC1=NC2=C(C=C1)C=C(C=C2)NC3CCN(C)C34CCCNC4,89780F9D44788024_144C29A97253DA99_6041_DP,8.164802,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,MIOCKJOBJNZNOH-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@H]3[C@@H](CNC3)F)Cl,32F4DAD79DBE44A7_A65E55677723E6A6_6034_UN,8.150887,00000000000000000000000000000000000010000010000100000000000000000100000000010110111101111011000010001001001100000000000111100100110101110110001010001011010110101111010,ZAQVBSYOBRNQNP-SWLSCSKDSA-N
CC1=C(C=C(C(=C1)NC2(CCCC2)C3CC3)Cl)C4CC4,AD28D84BB142A53B_0876725714D29E3B_7022_UN,7.993641,00000000000000000000001000000000000000000000000000000000000000100010000000000000000000010011000010000001100110011000001000000000110001110000000010010011000010101111010,QXHWBEBAMSBSTK-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC(C3CCOCC3)C4=CC=C(C=C4)F,C6989548FECA8BA8_E23B2353FD03FAD4_6041_UN,7.8382025,00000000000000000000001000000000000000000010000000001000010000100100000000010001100100110011011010100000000101000000001011101100110011110110001011011011010011101111110,TVDPARFAMQVLIA-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1C[C@@H]2[C@H](C)CCCN2)C=CC(=C3)C)C4,383EA58F5E23AF65_2B8DC78E42942961_6034_UN,8.451603,00000000000000000000000000000000000000000000000000000000000000000100000000010001001101000011000010101100110010010011101011100100110000000110011011011111010110101111010,MXNLVIFMMJPFQI-RMRANGLJSA-N
C[N]1N=CC(=C1)C4=NC2=C(C3=C(S2)CCCC3)C(=C4C5NCCC5)C6=CC(=CC=C6)F,2D4B86EAA2AA656E_E65198B972B7104E_2201_UN,7.610656,00000000000000000000000000000000000010000010000100001000000000100100000000010000111100011011011010101100110100010000001011101100110000100100001011011011010010101111010,PXLWXHMPHUOJHR-UHFFFAOYSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)CC4CC3(CCN3)C4,A425AEAEC2985204_C378D3385FED5F8C_6034_UN,8.579104,00000000100100000000000000000000000010000000000100000000000000100110000000010110011101011011000010001001111100011011001111100100110001110110001010011111010110101111010,QGNHJZUHPSBERS-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)C3=NC2=C(C=CC=C2)[N]3CC4C5(CCNC4)CCC5,6B590B04ABDDC6F1_91D640196DFA238A_6034_DP,8.005852,00000000000100000000000000000000000000100010000000000000000000100110000000010101101101110011000010101100110100011000001011100100110000100110001011011011010110101111010,NEOPKYRZCRFACL-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)C3=NC2=C(C=CC=C2)N3CC4C5(CCNC4)CCC5,6B590B04ABDDC6F1_35F41E6145CE8672_6034_UN,8.005839,00000000000100000000000000000000000000100010000000000000000000100110000000010101101101110011000010101100110100011000001011100100110000100110001011011011010110101111010,NEOPKYRZCRFACL-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)COCC2)[S](C4=CC3=C(C=C(C)[NH]3)C=C4)(=O)=O,675500C7966E4727_F80883F3F65E2F7B_6029_UN,8.633683,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100101001001010100110011001001000011011001100111111011110001011111001010011111111110,KWTSERAJZNYVEQ-UHFFFAOYSA-N
NCC(OC1=CC=C(C2=C1CN(C)CC2)F)C3CCOCC3,758CC9377C18F773_6AA0000DFD11118D_6035_UN,7.5813794,00000000000000000000000000000000000000000010000000000000010000000000000000010000001011110001010101101100010101010101101011100011110010100110001111011001110101111111110,YSHZTCUJGYERBL-UHFFFAOYSA-N
FC1=C(C=CC=C1NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)CC#N,69DB931C2468B7E2_3F5E5E32BDD40CBF_6041_DP,7.3712316,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110100111010,ARFFPJMJQCQOST-FUHWJXTLSA-N
CN(C)CC1=C(C=CC(=C1)NCC2=NOC(=C2)C3CCCC3)F,3AC86C17967A4EEE_098261B177169893_7022_UN,7.879305,00000000000000000000000000000000000000000010000000000000010000100100000100100001001101110001011011001010000100010001001011101100010001110110001010011111110110101111110,NGQITECZFUTMFA-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)N[C@H]3[C@H](OCCC(C)C)CCCC3,8DF844BCACA71F29_C065A49E487712E5_6041_UN,8.250565,00000000000000000000000000000000000000100010000000000000000000000100000000100100000000010011000100100100110101010001101001000111110011110100011111010111110111101111110,NTJCSPQVIZKDMF-WOJBJXKFSA-N
CCC2OC1=C(C=C(C=C1C2=O)NCC4C3CCC(CN3)C4)F,6E794CD625556242_F4D16E20C2FB29F1_6041_DP,8.171437,00000000000000000000000000000000000000000010000000000100010000000000000010000000101100010111000010101100110100010110001011000001110111110110001111010011111111111111110,OTDFTFKBXKSQAI-UHFFFAOYSA-N
N3CC[C@@H]([C@H](NC(=O)C1CC2OC1C=C2)C3)C4=CC(=C(C=C4)F)F,7E012C4720C2151B_6845D171A6D7D5C9_6038_DP,7.925619,00000000000000000000000000000000000000000010000000000010010000100000000000000001001100110111100011111000110100110000011011000000110111100110001011010011111011110111110,VXJZKQIEVDZCBG-FTAIOWLKSA-N
C[N]1C(=CN=C1C2CCCCN2)NCC3(C)C=CCCC3,14FEA19C19AD1F70_9119DDC4B7B98E56_6041_DP,7.772759,00000000000000000000000000000000000000100000000000000000000000100110000000010101101101000011010010111000100010011001101011100000110101010110001011011111010110101111010,WGHMJQHCIIKOMO-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)COCC2)[S](C4=CC3=C(C(=C[NH]3)CC)C=C4)(=O)=O,B87F21BA8664E248_A3D099E17CB961DF_6029_UN,8.474619,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100101011001010100110011001001010011011001100111111011110001011111001010111111111110,RDXLOJVYWDRGHY-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3(C)CCC4(CC3)CC4,6EAD3C6A9A168232_91B6D7F76F5B74D7_6041_UN,7.5790443,00000000000000000000001000000000000000000010000000000000000000000110000000000001001000010011000000101100010110001001101001000100110001110100001011010111010110101111010,QZSGHTHJESDGPO-UHFFFAOYSA-N
C(C2C1CC3CC(C1)CC2C3)=CC5=NC4=C(CC)C=CC=C4C=C5,0347236E81D82BA0_F86816276818B4B4_7019_UN,8.8019,00000000000000000000000000000000000000000000000000000000000000000100000000000000000000000000000000110100010000000010000001000100100000000100000001000000000110001111010,AGGWNBXGHUAFGY-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3=C2CCCC2=CN=C3)F)CC4,2DECB5E45F23E8D5_2FCD90BF3B6CD8EA_6041_UN,7.334731,00000000000000000001000000000000000000000010000000000000000000000100000000010001100001110011010010101100010110010001101011100100110001110110001011011011010110101111010,WOQZIVOOAWXVDE-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC3=C2CCCC2=CN=C3,75B8B1859E132C7D_956F6C112A5C930E_7022_UN,7.6756253,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100011010010100100010000001000001001000100010001010100011011011101000010101111010,KOXKGBQMYLHERW-UHFFFAOYSA-N
FC1=C(C=CC(=N1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,C0A154EE0607C80B_EBBF3F9F9637754E_6041_DP,7.380761,00000000000000000000000000000000000000100110000000000100000000100100000000000100101000110011000000101000100100010000001011000100110101110110001011010011010110100111010,BFCIVOGVJRIPRT-GOEBONIOSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3CCC(C)C3,0F55152DCB0E0B8C_9FCD43DA7A8A82C3_6041_UN,8.43001,00000000000000000000000000000000000000000010000000000000000000000100000000000001001000010011000010101100010110000001101001000100110001110100001011010111010110101111010,PCXINZHCLOIBTK-UHFFFAOYSA-N
N4CC1=C(C=C(C=C1)NC[C@@H]2CCCN(C)[C@H]2C3=C[N](N=C3)C)C4,3662E2AF57209916_E6B73329B2A20FBA_6041_DP,7.920266,00000000000000000000000000000000000000000000000000001000000000100100000000010000101101100011011010101100010010010001101011101100110101010110001011011111010110101111010,SJHPFNIAABRRHL-HNAYVOBHSA-N
CC1=C(C=C(C(=C1)NCC2C(CC2)C3=CC=CC=C3)Cl)C4CC4,115956DCB263AAC0_230C9DEF04DC1FEF_7022_UN,7.898975,00000000000100000000001000000000000000000000000000000000000000100000000000000000001000010011000000001001000110000000001000000100110001110000000011010011010110101111010,UWHCFJOEJUMKEL-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC3=CC2=C(NCCC2)C=C3,37345DB8BE622A74_DFF06BA881BB871F_6041_DP,7.510628,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100011010000101100110000011000001011000100100101010110011011011111010110101111010,PRNHXDQYUKBWTN-UHFFFAOYSA-N
NCCC(OC1=CC(=CC=C1)C2CNCC2)C3=CC=C(C=C3)Br,1544785F98684511_6DE56C6F06C3CD7E_6035_UN,8.23985,00000000000000000000000000000000000000000000001000000000000000100000000000000000001110110011000011001000100100010100001001000111010110100110001101010001110101100111110,YCPYZJSWAAWUEE-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)[NH]C=N2)NC3CCN(C)C34CCCNC4,B127A3C5C63262FC_3073C70B02133272_6041_DP,8.416801,00000000000000000000000000000000000000000000000000000100000000000110000000010101101101100011010010101100110010011001101011100100110101010110001011011111010010101111010,CNTKIVMPPIBPTI-UHFFFAOYSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC3=CC(=CC=C3)C4=CCCNC4,2EBFFD8D2D462606_F94BD6A2FD2007CB_6035_UN,8.313287,00000000000000000000001000000000000000000010000000100000000000100010000000001000001010110011000001111000100101011100001001000111110100100110001101010011110101100111110,OWJAWNKTAMJOMA-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NCC23OC(C)(C)C(C2)C3)CC=C,6BF28D7BEB0DE217_C98EC33378F26EF6_6041_UN,7.3804393,00000000000100000000000000000000001000000000000000000000010000000010000000100000001100000011000110011000010010001000100000000000100011010100010010000111110111101111110,HQEFSVYWNMTPCU-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NC2CN(C)C3(C2)CCOCC3)C=C,8F4F4138EA647A4E_960E5CCB53519EDD_6041_UN,7.1961584,00000000000000000000000000000000001000000010000000000000010000000010000000010001100101110001010011111000110111011001101011100000110011110110001011011011010011101111110,PTQUVCKFIMUFOR-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC4CC3CCOCC3CC4,031C16C7EAB33107_3F7EFEB12C87FE6C_6041_UN,8.751972,00000000000000000000000000000000000000000010000000001000010000000100000000010000100100110011011010100100110101010000001011101100110011110110001001011001010011101111110,ICMIEYBJCXSZNR-UHFFFAOYSA-N
C1(=CC2=C(C=C1)CC3CCC(C2)C3=O)NC4=CC(=C(C=C4F)F)C,6DFB56101EE0FD5E_04ED525846064B22_6041_UN,7.741491,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000010001000010000100010100000000001000000101110001110000000111010011101010101111110,QMVTVWSFHPNHEM-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NC3C4(C(O)C3)CCOCC4,1C84C86505E9EE72_C4F5042AC49721E5_6041_DP,7.949826,00000000000100000000000000000000000000100000000000001100010000100110000000010101100100100011011011100000110001011000001011101101110111010111001111011111110011111111110,BGAXUIRHNGFEEV-UHFFFAOYSA-N
NCC(COC1=C(C(=CC=C1)C2CNCCC2)F)CC3CCOCC3,9BE385684924368C_55DE7E2530FFD5B8_6035_UN,8.305042,00000000000000000000000000000000000000000010000000000000010000100000000000000000001010110011000001101000100101010100001011000011110110100110001111010011110101110111110,WKZGWNULFAYFNM-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NCC4C3CCCCC3NC4,B88641198B5BFC49_FF6C9DF99AC82EDD_6041_DP,8.567359,00000000000000000000000001000000000000000010000000000100000000000100000000010101101101010011010010001100111110010000001011100100110101110110001011011011010110101111010,MXJMDMXGPAMJHR-UHFFFAOYSA-N
O(C(CC1=C(C=C(C=C1)F)F)C#N)CC3OCC2(CCNCC2)C3,A3F1A88088A71276_D34F20D06FA548EA_6039_DP,8.141209,00000000000000000000000000000000000000000110000000000000010000000010000010000000001100110001000110101000110101011000001011000010110010100110001011010011110101110111110,DVAHGSCCXXYJFG-UHFFFAOYSA-N
CCNC5CCC1=C(C4=C(N1CC2CC2(C)C3=NC=C(C=C3)F)C=CC(=C4)Cl)C5,A24AE78C2D18A642_687357D168EF078D_6034_UN,8.49048,00000000000000000000001000000000000000000010000000000000000000100110000000010000001101010010000010101101110110011011101011100100110001100110001011011111010110101111010,XSZLBHCYBKXSIG-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)N[C@H]4[C@@H](CCC4)C5=CC=C(C=C5)F,2E84A72B78BFDA51_7F61565979EEF310_6041_DP,7.9711037,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000110110010000001011100100110101110110001001011011010010101111010,KYFQAWXLCBBLLI-PERVXXQJSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[CH]3C[C]4(C3)CC[CH2]CC4,8E9F25CE347043BC_290391BBD4CB6185_6041_UN,6.994542,00000000000100000000000000000000000000100010000000000000000000000110000000000100001000010010000000101100010110001000001001000100110001110100001011010111010110101111010,SIZZXLMIGYXPEL-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC3C4(CCC3)CCCCC4,7F874CC277D15BAD_3EC506C4B18D1E6E_6041_UN,8.303986,00000000000000000000000000000000000000000010000000000000000000000110000000000000100000010011000010100100110100011000001001000100110001110100001011010011000010101111010,CVAAROLRMUSVQX-UHFFFAOYSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC[C]3(C[C]2(C[CH2]C2)C3)C4=NC=CC=C4,9152DA456FC53BF9_F7C04CA1768D79C4_6041_UN,8.061613,00000000000100000000100000000010000000000000000000000000000000100110000000100000101000100010010000101000010000001001001001000100110001010110011011011111010110101111010,NWGSVPCBZBKMSZ-UHFFFAOYSA-N
FC1=CC=C(C=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,D3610BE899516104_35AF317F3D4A3F29_6041_UN,7.9655633,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,YMHPAYYNIRGWHF-KUHUBIRLSA-N
N1CCC5(CC1)CCC2=C(C=CC(=C2)NC3=CC(=C(C=C3)N4CCCC4)F)O5,B31500F652E85D61_013E1B20755EDFD0_6041_DP,8.161352,00000000000000000000000000000000000000000010000000000000010000100010000000010000001101110001000011101100110100011100001011100100110111110110001011011011110011100111110,IGWGKVQKDVQNHR-UHFFFAOYSA-N
C[N]1N=C(N=C1NC2(CCCC2)CC3=C(C=CC=C3)F)C4CCOCC4,504158AE960B97EC_C75A08D862AD7771_6041_UN,7.988513,00000000000000000000000001000000000000100010000000001000010000100110000000010101100100110011011010100000101101011000001011101100110011110110001011011011010111101111110,ZSRWAJQTXGOPSJ-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1C[C@H]2CCCNC2)C=CC(=C3)C)C4,34E31B0114D40894_CCB156FDC4D68636_6034_UN,8.428599,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101100011000010101100110010010010101011100100110000000110001011011101010110101111010,KINVCEVMYSSQQZ-DJNXLDHESA-N
CCC4CCC1=C(C3=C([N]1C[C@H]2CCCNC2)C=CC(=C3)C)C4,34E31B0114D40894_8AC2EB9A2EB24BA7_6034_DP,8.428593,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101100011000010101100110010010010101011100100110000000110001011011101010110101111010,KINVCEVMYSSQQZ-DJNXLDHESA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OCC2=C(F)N=CC=C2)C3,4939AEF015E9F976_EB4FC6413C5206D1_6039_UN,7.4858723,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010011101000010101000001001001100011110000100110001111011110110111101111110,SNZLBBDPZYBHCC-MYZSUADSSA-N
CN(C)CC1=C(C=C(C=C1)N[C@@H]2C4=C(OC3(C2)CCCC3)C=CC(=C4)F)F,019AAE8971CE344F_C07DA96948C5C31D_7022_UN,7.4340672,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110001010011101100110100011101001000100100110011110100001011011111110111101111110,JAGLQTUMDSMIJV-FQEVSTJZSA-N
FC1=C(C=CC=C1)C2=NC(=CS2)C=CC3=C(C=N[N]3C)C4CC4,14CB0C36E7D27B5F_18C260A5BAD7425D_7019_UN,8.329646,00000000000000000000001000000000000010000010000100001000000000100100000000010000110100011000011010010000000100000000000011101100000000100100001010011010000010101111010,MLUKNIYWYZBUCR-UHFFFAOYSA-N
C(C1=CSC(=N1)C2CC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,1D8A328D54F8A09B_CE55A75573ABFAED_7019_UN,8.187162,00000000000000000000001000000000000010000010000100000000000000100100000000000000010101011000010010010000000110010000101011100100010001110100001010011010000010101111010,JDBDGEODDYYGDF-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)N[C@@H]2C4=C(OC3(C2)CCCC3)C=CC(=C4)Cl)F,ED0662D2F6CCCAFB_FBD06E2F832838ED_7022_UN,7.4340487,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110001010011101101110100011101001000100100110011110100001011011111110111101111110,MAJUJPIWHWFOSE-FQEVSTJZSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC34CC(C)(CO3)CCC4,7BA79ADD116B19D7_5FDC556560387226_6041_UN,7.4041643,00000000000000000001000000000000000000000010000000000000010000000110000000000000101100010011000110101100010111001001101011000100110011110110001011010111110111101111110,KEGFMXAAXXJANK-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)C3=COC4=C3C=C(C=C4F)F,CEB1C382CB4D62A3_C71A560CB74F29F7_6038_UN,7.8989553,00000000000000000000000000000000000000000010000000000000010000000000000000000000001100010111100011001100010100100000011000000100110000100100000001010001111110110111110,YSGXZTJYZGZXFJ-UHFFFAOYSA-N
FC2=C1C=C(N=CC1=CC=C2)NCC3CCN(C(CC)C)C3,B24FC055717301B7_990C61B9D814C537_6041_UN,8.435647,00000000000000000000000000000000000000100010000000000000000000000100000000010100101101110011000010101100010110010011101011100100110001110110001001011101010110101111010,NYYFQCZWPOLQCM-UHFFFAOYSA-N
FC2=C(C=C1C=C[NH]C1=C2)NCC3CCN(C)C3C4=CC=CS4,7C528B9C84354E44_E58885C107D35581_6041_UN,8.6446705,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010001100010110010001101011100100110101110110001010011011010110101111010,COKFJPUCSQOJGU-UHFFFAOYSA-N
N4CCC1=C(C(=CC=C1)NC[C@@H]2CCCN(C)[C@H]2C3=C[N](N=C3)C)C4,26C2B5A58C8436D3_238E27E61FC0D2A4_6041_DP,7.9116673,00000000000000000000000000000000000000000000000000001100000000100100000000010000101101100011011010101100110010010001101011101100110101010110001011011111010110101111010,GSDVLZUAEHUZHS-OXJNMPFZSA-N
OC(CF)C=CC2=C(N(C)C1CCCC1)C=CC(=C2)F,EEDDA7BCF9FB4A7E_11CF606E0A2D7C76_7019_UN,8.4114,00000000000000000000000000000000000000000010000000000000000000000000000000000000000001010000010010010000100110010000101000100000010011110001000010011010110111101111110,QZQKUHAKMSOJRD-UHFFFAOYSA-N
CC3=CC1=C(C=C(C=C1C)NCC(F)C2CCCCC2)[NH]3,F8F04846F02B5C53_7CCC9050AF360DBC_6041_UN,8.301964,00000000000000000000000000000000000000000010000000000100000000000100000000000000101100000001000010001100010100000000001001000100110101110100001001010101010110101111010,QQIUPVUCIBFYSI-UHFFFAOYSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3C4=C(CC3)C=C(C=C4)F)C5,00131CB082FF4AEE_809FB85298C4B042_6041_UN,7.647497,00000000000000000000000000000000000000000010000000000000000000000100000000010000101101110011010010101100110100010001101011100100110101110110001011011001010110101111010,RBIYIXXEZLAITH-UHFFFAOYSA-N
COC1(COC1)C2=CC=C(C=C2)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,5EFFE8324E9B531C_07B92445B593D3AD_6041_UN,7.025374,00000000100100000000000000000000000000000010000000000000010000100010000010000000001100110011010011001000000101001000101010000111110011110110000101110011110111111111110,LPAHXGYEKNOVTL-JXFKEZNVSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CC3)C4=CCOCC4,E02C2EE0F4617EE9_212627A61297426F_6041_UN,7.972007,00000000000000000000001000000000000000000010000000101000010000100110000000011000101100110011011010111100010101001000001011101100110011110110001001011001010111101111110,PMXUCWBNTWXNSQ-UHFFFAOYSA-N
FC1=CC(=CC(=C1)N[C@@H]2C[C@H]3CC[C@@]2(C3(C)C)C)C[N]4C=CN=C4,AFDB01631A50C7FA_39BFF741D1F1AFCA_6041_UN,7.9018116,00000000000000000000000000000000000000000010000000000000000000000110000000110101000101010011000010001000110110011001101011100100110001110100011001011111010110101111010,DEDKPWCIRRHSMY-ZTNFWEORSA-N
CC1CCOC1CC=CC2=C[N](C)N=C2C3=C(C=CC(=C3)F)F,1D9308D544D9AE51_D1B2FFFFF3AC7D9F_7019_UN,7.721553,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010000011010010000000111000001101011101100110010100100001010011110110111101111110,BLUZPTBMFOWWEG-UHFFFAOYSA-N
FC2=C1C=CC(=NC1=C(C=C2)F)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,926BAEE796668621_C70AB8BF3F3894E7_6041_UN,8.359625,00000000000000000000001000000000000000100010000000001000000000100100000000010101101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,DFKCMIJUTXOGTN-PEBXRYMYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[C@@H]3CNC[C@H]3C,B8EA118C4A4AA938_0776F534AEA878D7_6041_DP,8.74432,00000000000000000000000000000000000000000010000000000100000000000100000000000001101100110011000010101100010110000001100011000100110101110110001011000111010110101111010,DHVWDAPGMDSUKQ-MFKMUULPSA-N
N(CC1CC2CCC(C1)O2)C(C3=C(N=CC(=C3)C)F)=O,A952DBB65713E458_11D4D01D6BFBB9AE_6038_UN,7.983901,00000000000000000001000000000000000000000010000000000000010000000100000000000000101100010010100011101000010100100000011011000000110010100100001011010011111111111111110,YLTCXVZEDIDEAI-UHFFFAOYSA-N
C(C1CCC2(CC1)OCCO2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,CDFE308F7340257B_F03582F6A47F7A01_7019_UN,7.812576,00000000000000000000000000000000000000000010000000000000010000000000000010000000000101010000010010010000010111011000101010110000110011110110000011011010110011111111110,CBXIFPAUGQEJNP-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCC(C)(CC2)N3CCOCC3)F)CC4,CAA9CC2E8B0CB411_24B087A79118FFDC_6041_UN,7.6545534,00000000000000000001000000000000000000000010000000000000010000100010000000010001100001110010010100101000100111011001101011100000110011110110001011011111010111101111110,IUVKEXGAEBVNQQ-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CO2)NCC3(CCN(C)CC3)N4CCOCC4,1EA40F59051ABA39_BC1D08DEED5F817F_6041_UN,7.752301,00000000000000000000000000000000000000000010000000000000010000100010000000010001101101110011010110101100010101011001101011100100110011110110001011011011110111111111110,PKUJPIULPDCTGP-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2=N[NH]C=C2NCC[C@@H]3CC[C@H]4C[C@@H]3C4(C)C,0F8142D9D4A38F43_9EA9DD0C966FB01F_6041_UN,8.301094,00000000000100000000000000000000000000000010000000001110000000100110010000100001101100010001001010001000110110011000101011001100110101110100001011010111010110101111010,SWFYJKNLWNPKMD-QRTARXTBSA-N
N(CC2=NC1=C(C=CC=C1F)O2)C(C5=C(C3C4CC3CN4)OC=N5)=O,9EE63B97D66E8384_4BCDF3987BA4FB17_6038_DP,8.354709,00000000000100000000000000000000000000000010000000000000010000100100000000000001001100010111100111001100110100110000010011000100110110100110001010100011111110110111110,LPEYXXBOMUUHSG-UHFFFAOYSA-N
FC2=C1N=C([NH]C1=CC=C2)NCC34OC(C)(C)C(C3)C4,5EAD8CDCDB403181_0640777A042E197E_6041_UN,7.436148,00000000000100000000000001000000000000000011000000000000010000000110000000100101001100010010000110001100011110001000100011000100100111110100001000000101110111101111110,GIRMSBBWFWZXON-UHFFFAOYSA-N
FC1=CC(=C(C(=C1)F)F)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,31BDECBFF2DE6C51_BF25AB883CB6F086_6041_UN,8.864891,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,WAHLRVCOAFUXDQ-BLVKFPJESA-N
C1(=C(C=CC2=C1OCO2)F)NC[C@@H]3CCCO[C@H]3C4=CC=N[N]4C,D85FAB16845D15A8_A54A2120DED0FE15_7022_UN,7.2431326,00000000000000000000000000001000000000000010000000001000010000100100000010010000101100010011011111101100010101000100001011111100110011110110001011111011110111111111110,MSQPAFPLLPNPAJ-MEDUHNTESA-N
FC1=CC3=C(C=C1)N(C2=C(CNCC2)C3=O)C[C@H]5N[C@H]4CCO[C@H]4C5,F6CFA444D0179C51_9927445894ED5CDB_6034_UN,8.35499,00000000000000000000000000000000000000000010000000000000010000000100000000010001101101110011000111101100110101010100001011100101110110100110001111011001111111110111110,YEDLUHKITFMGFG-QITLCBANSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3NCCC3)C[C@H]4[C@@H](CCNC4)C5=CC=C(C=C5)F,E0B46A124C2F5768_BE13CFE12D18DC67_6034_UN,8.037919,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101100110100010000001011100100110100100110001011011011010110101111010,BDXJBDMXNJIQPF-WZENJKSDSA-N
FC1=NC(=CC=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,0BC79EC3A7E7E478_3DDF4BBC64D543E7_6041_UN,8.392381,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,RGUFYGJCIZPVGX-ACJLOTCBSA-N
FC1=CC2=C(C=C1)C(=CN2C[C@@H]3C[C@@H](C)OCC3)C4=CCNCC4,F396844FE573AE4F_9B5AA52216208AA8_6034_UN,8.682345,00000000000000000000000000000000000000000010000000100000010000100100000000011000001101110001000010111100110111010001101011100100110010100110001001011001110111101111110,FMFUNMNNUGFGAY-CABCVRRESA-N
O(C(=O)CC1=C[NH]C2=C1C(=CC=C2)Cl)CC3CC4CCC3C=C4,A80D407EDEF2A161_5A816F313C6123E3_6031_UN,8.059172,00000000000000000000000000000000000000000000000000000000000000000100000000000000000100010011000010010101010101000000001001010110110010100100000001010001011111010111110,HZOVSUYRLZFQLV-UHFFFAOYSA-N
BrCC2=NC1=C(C=CC=C1)N(C2=O)CC4=CC3CCC(N3)C4,DF5B57D9D2D37D22_50B9235F776783FE_6034_DP,8.206157,00000000000000000001000000000000000000000000001000100000000000000100000000011001000101000011100110111100110000110100011011100101110000100110001111011011011110100111110,IQGLVPGHNMJTNQ-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3(CC)CNC3)Cl,09F408FEB75A02EC_CB37621B4015C61F_6034_UN,8.187508,00000000100100000000000000000000000010000000000100000000000000000110000000010110111101111011000010001001001110001010100111100100100101110110001010001111010110101111010,BMLOFADCFMONJT-UHFFFAOYSA-N
O(C(=O)CC1=C[NH]C2=C1C(=CC=C2)Br)CC3CC4CCC3C=C4,670F17DAC991B1D4_0725E9BF852AEBC4_6031_UN,8.059061,00000000000000000000000000000000000000000000001000000000000000000100000000000000000100010011000010010100010101000000001001010110110010100100000001010001011111010111110,FBHLSSSYZLDHFE-UHFFFAOYSA-N
FC2=C1CCCC1=CC(=C2)NC[C@H]4[C@H](C3=NC=C[N]3C)OCC4,7A3EFAEC2B427610_03651B5A28C90E84_6041_UN,7.260395,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101010011010111001100010101000000001011100100110011110110001010011011110111101111110,MBUOGYKLNSVKPY-SUMWQHHRSA-N
NCC34CCC(COC1=C(C(=CC=C1)C2CNCCC2)F)(CO3)C4,D44E3ABF26381998_5501698401AB694F_6035_UN,7.9060884,00000000000000000000000000000000000000000010000000000000010000100010000000000000001110110111000110101000110101011100001011000011110110100110001111010011110101110111110,FGKVXFGGMACSKW-UHFFFAOYSA-N
C([C@]12C[C@H]1COC23CCC3)=CC4=C[N](C)N=C4C5=CC(=CC=C5)F,D1FFD96F5CF22E34_0EC45CE5BCD54C61_7019_UN,7.40609,00000000000100000000001000000000000000000010000000001000010000100110000000010000100100010000011010110000010101001000001011101100110010100100001011011010110011101111110,KDXXQXZUFIVSAR-LPHOPBHVSA-N
CC1=C(C=C(C(=C1)NCC(OC)C2CCCOC2)F)[N]3C=CC=C3,96B3F3FC17E51303_B697E45C703DCC73_6041_UN,7.5496907,00000000000000000000000000000000000000000010000000000000010000100100000000010000001101110101010110101000000111000000101011100110110011110110001011011111110111111111110,VMKHXCIIROWGSI-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC(N3CCOCC3)C4=CC=C(C=C4)F,CF08DBF193B59EF6_A2A4035D25908C48_6041_UN,7.4713326,00000000000000000000001000000000000000000010000000001000010000100100000000010001101101110001011110101000000101010000001011101100110011110110001011011011010111101111110,BIIMROPTMYBISK-UHFFFAOYSA-N
CC1=C(C(=CC=C1)F)NCC(CN2CCCC2)C3CC3,59243DACDAEBFBE4_FE0E698C5925EF25_6041_UN,8.562221,00000000000000000000001000000000000000000010000000000000000000000000000000010000101101110011000010001000000110010000001001100000110001110110001010011011010110101111010,LMKQOOSWQDEMNX-UHFFFAOYSA-N
CC1=C(C(=CC=C1)Cl)NCC(CN2CCCC2)C3CC3,C59FAA5C27E0CE26_4100A37E90FDB5F5_7022_UN,8.562215,00000000000000000000001000000000000000000000000000000000000000000000000000010000101101110011000010001001000110010000001001100000110001110110001010011011010110101111010,UYOHWFFFWOWZIX-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=CC2=O)CC3CC4(CN3)CCCCC4,D043914CAA14F2BD_1843A6B6C973BF1B_6034_UN,8.496295,00000000000000000000000000000000000000000000001000000000000000000110000000010001001101010011000011101100110100011100001011100101110000100110001101011001111110100111110,ZMHCFQKEOBPNCB-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC3(CCN(C)CC3)N4CCOCC4,90132914CDDA39F5_2A8B99E608608AC5_7022_UN,8.082695,00000000000000000000000000000000000000000010000000001000010000100110000000010001101101110011011110101000000101011001101011101100110011110110001011011011010111101111110,ORHNKLVGZVFZMD-UHFFFAOYSA-N
N[C@@H]1[C@H]4CN[C@@H]1[C@@H](OC2=CC(=C(C)C=C2C3CNCC3)Cl)C4,F823BEC77F43C8CB_841726750682EE08_6035_DP,7.5607567,00000000000000000000000000000000000000000000000000000110000000100000000000000001101110110011000111101001110100010100001011000011110111100110001111010011110011101111110,PVIGLDFXJMNDQZ-PEADSTSGSA-N
FC1=C(C2=C(C=C1)CCC2)NCC(CC)C3CCOCC3,313E1EA43C4FACAE_F6FA79B13452AF06_6041_UN,7.426119,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110011000010101100010111000010101000000000110011110110000011010011010111101111110,JQEOWIFXEJZTHV-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC[C@@]34[C@@H](CCC3)OCC4,1EECA78FAACCCDE8_067EB0D53CE8BD4E_6041_UN,7.7947493,00000000000000000000000000000000000000000010000000000000010000000110000000100000101100010011000011101100010101001000001011000100110011110110011011010111110111101111110,BHNPJVGUKDUVEZ-DYESRHJHSA-N
CN(CC1CCNC1)C2=NC=C(N=C2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,F8FF324C8C410376_08837C7E9F0C916D_6041_DP,7.9707375,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000100110010001001011100100110101110110001011011011010110101111010,RRPFZTYVNDAPEN-NOYMGPGASA-N
FC1=C(C2=C(C=C1)CCC2)NCC3N(C)CC4(CC3)CCC4,84E52BDFF87F8ABD_7FCC9CE0A2ABCA1C_6041_UN,7.043388,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010010101100010110011001101001100000110001110110001011011011010110101111010,PYPJBEYWVFREBK-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC3CCC2(CCCC2)C3)Cl)C4CC4,93BE23FD1E7E420D_D8C325BFEEA6628C_7022_UN,7.713857,00000000000000000000001000000000000000000000000000000000000000100010000000000000000000010011000010000001110110011000001000000000110001110000000010010011000010101111010,CQRMTDIVKPWYQC-UHFFFAOYSA-N
N(CCC1=C(C(=CC=C1)Cl)F)C(C23CCC(C)(C2)CO3)=O,40CF1CCF2F096F7D_13590B6A1A31357C_6038_UN,7.9089966,00000000000000000000000000000000000000000010000000000000010000000010000010000000001100010011100110101001110111111001111000000000110010100110000011010011111111111111110,QMJQERWXKMDGJD-UHFFFAOYSA-N
CC1=C(C4=C([N]1CC2(CC23CCNCC3)C#N)C(=CC=C4)Br)C,300D2A99BEA5D6D5_003AB5D6A86CD6FF_6034_DP,8.276802,00000000000000000000001000000000000000000100001000000000000000000110000000010000101101110001000010101100110110011000101011100100110000100110001011011111010110101111010,VLXUPCVLMACDMV-UHFFFAOYSA-N
N(CCC1=C(C(=CC=C1)Cl)Cl)C(C23CCC(C)(C2)CO3)=O,07AA43BCB1DE751F_771AA8C14A2E2599_6038_UN,7.908989,00000000000000000000000000000000000000000000000000000000010000000010000010000000001100010011100110101001110111111001111000000000110010100110000011010011111111111111110,WHXUDTIZVQGRLU-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NCC2N(C)CC3(CC2)CCC3)C,1D4000E10A6FB982_717FFD8F9023AA87_6041_UN,7.6009474,00000000000100000000000000000000000000000000000000000000000000000010000000010001001001100011010000101000010010011001101001100000110001010110011011011111010110101111010,VTQBRTONFYJZJZ-UHFFFAOYSA-N
N(CCC1=C(C(=CC=C1)F)F)C(C23CCC(C)(C2)CO3)=O,E5A7A48C5A0CD84D_F0D469A4CDC2AFA3_6038_UN,7.908974,00000000000000000000000000000000000000000010000000000000010000000010000010000000001100010011100110101000110111111001111000000000110010100110000011010011111111111111110,ZNLPVPZRMMXOOE-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NC3CC(C2=CC=N[N]2C)OCC3)C=C,56DA3A3B8E20BEE6_0041AF210AE41F77_6041_UN,8.162901,00000000000000000000000000000000001000000010000000001000010000100100000000010000100100010010011111110000100111010000001011101100110011110100001011011011110011101111110,XQVZDCFBXCWNIQ-UHFFFAOYSA-N
N1CC4CCC1C(CNC(=O)CC2=C[NH]C3=C2C=C(C=C3)F)C4,EC9B49BD58F4508C_9C887C99D747E81D_6038_DP,7.721224,00000000000000000000000000000000000000000010000000000100000000000100000000000000101100010011100010101100110100110000011011000100110110100110001001010001011110100111110,ANRVZELHEYNULY-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CC2(C)CCCC2)C=CC(=C3)Cl)C4,9D964F5A00CBAED8_F9F7211CC0F00598_6034_UN,7.4636674,00000000000000000000000000000000000000000000000000000000000000000110000000010000001101010010000010001101110110011011101001100100110001100110001011011101010110101111010,TUXGYWXDIONXOU-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C2CC2)NC4CC3(CCN(C)CC3)OC5=C4C=CC=C5,38E9071C6C07AB8D_9F4FE8813E49BB8B_6041_UN,7.89615,00000000000000000000001000000000000000000010000000000000010000100010000000010000000001110001010001101100110100011101101011100100110011110110001011011011110011101111110,ANMQNCLFSWCGMO-UHFFFAOYSA-N
CN4CCC1=C(C3=C(N1CC2=CCSC2(C)C)C=CC(=C3)Cl)C4,E1A794C29770FE28_E8F0C6B36B47578B_6034_UN,7.878685,00000000000000000000000000000000000010000000000000100000000000000110000000111000110101111000010010111101010110011001101011100100110000100110011011011110010110101111010,BNAXAMDKRCEMRM-UHFFFAOYSA-N
C1(=CC3=C2C(=C1)CCC(N2CCC3)=O)NCC4=CC=C[N]4C,7E441947F9743742_B2681EF79B0FDF6C_6041_UN,8.746958,00000000000000000000000000000000000000000000000000000000000000000100000000010001001101000001110010101100010000110000111011100101110011010110001111011011011110101111110,LFWZSSRMMUGIBN-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC23CCCC2OCC3)C=CC(=C4)Cl)C5,CE8D67DEC5BAFF41_AF8A91AAA54C19E5_6034_UN,7.1714473,00000000000000000000000000000000000000000000000000000000010000000110000000010000100101110000010011101101010101011001101011100100110010100110001011011000110111101111110,YBMMALYDDBTSMQ-UHFFFAOYSA-N
FC1=NC2=C(C=C1)C=C(C=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,1B1CD126FBE01B9F_9E0EADB345688E56_6041_UN,8.018052,00000000000000000000000000000000000000000010000000000000000000000100000000000000100001110010010000101100010110010001101001100100110001110100001011011011010110101111010,DBCQADLLSKZLPP-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C3CCC2O3)NC4=CC(=CN(C)C4=O)Br,6DC6D4D2DE96B829_B6286824ACE43B08_6041_UN,8.193152,00000000000000000000000000000000000000000000001000000000010000000100000000010001000101010000110110100100010100100100011011100101000011110100001111011011101011111111110,YQDSOPPYVAVWIT-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NC3=N[N](C)C(=C3)C4CCOCC4,33CCE6AEA1AB62C6_C87DECC634C18460_7022_UN,7.5911455,00000000000000000000000000000000000000100000000000001000010000100100000000010101100100110000011010100101010111000000001011101100110011110110001011011011010011101111110,DVLBNPWPNVEQJY-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Br)NC3=N[N](C)C(=C3)C4CCOCC4,2C4747DD8A06A3B2_989DA4F0DF4AE016_7022_UN,7.5911446,00000000000000000000000000000000000000100000001000001000010000100100000000010101100100110000011010100100010111000000001011101100110011110110001011011011010011101111110,RXCZAAMRYKQEJF-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC4CC3CCC(N3C)C4,83A74DED31183DC6_46BE5DE29ADB212C_6041_UN,7.3430004,00000000000000000001000000000000000000000010000000000000010000100000000010010000100101010001010010100000110111010000101011110000110011110110001011011011010011111111110,AOOBRECIOMMERB-UHFFFAOYSA-N
BrC2=C1N=CN(C1=CC=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,555972BA17F95A25_FD6EE23D6DF65373_6034_UN,8.367829,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,DYHXCXVQDMSYDV-VLIAUNLRSA-N
FC2=C(C(=C1N=CC(=C(C1=C2)NC[C@@H]3CNC[C@H]3C)C#N)F)F,184FE9D4A59EF317_D9D9A0DBD763C777_6041_DP,8.343465,00000000000000000000000000000000000000000110000000000100000000000100000000000000101100110011000010101100010110000001100011000100110101110110001011000011010110101111010,ZERJTJCYEGKPGV-SCZZXKLOSA-N
N(CCC1CC2CCC1O2)C(C4=C(CC)N=C3C=C(C=CC3=C4)F)=O,A6EEF6F8C6F7B71F_1504E1276A6B8838_6038_UN,8.020839,00000000000000000000000000000000000000000010000000000000010000000100000000000000101100010001100011101100110100110010011011000100110010100100001011010011111111111111110,DIQSWLVFVGENSB-UHFFFAOYSA-N
FC2=C1N=CN(C1=CC=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,AB260CEE044CAFAE_8F8C7449AF747051_6034_UN,8.367817,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,ISYVXGTYMQWEFB-VLIAUNLRSA-N
CC2=C1N=C[N](C1=CC(=C2)NC3C4CC5CC3CC(C4)(F)C5)C,990238FC5234D0D3_4763CDAC79BDC60C_6041_UN,8.413742,00000000000000000000000000000000000000000010000000000000000000000110000000010101100101010010010010000100010100001000000011100100100001110100001001001101000010101111010,MTNADNUYJZHYRP-UHFFFAOYSA-N
CCNC5CCC1=C(C4=C(N1CC3=CC2=C(C)C=CC=C2[NH]3)C=CC(=C4)Cl)C5,090634FA1612DB5E_4FA0548AE07CFF16_6034_UN,8.118325,00000000000000000000000000000000000000000000000000000000000000000100000000010001001101010010000010001101110110010010001011100100110101100110001011011101010110101111010,ZOOMZLKMGIUPLB-UHFFFAOYSA-N
CN(C)CC1=CN=C(C=C1)N[C@@H]2C4=C(OC3(C2)CCCC3)C=CC(=C4)F,C360637DCE3C3001_E732E8EDBCFF385E_6041_UN,7.7906694,00000000000000000000000000000000000000100010000000000000010000000110000000100100100001110001010011101100110100011101001011100100110011110100001011011101110111101111110,MSLSHLXBTILSLS-SFHVURJKSA-N
FC1(F)CC14CCC(C=CC2=C[N](N=C2C(C)(C)C)C3=C(C=CC=C3)Cl)C4,C01490FC553213F8_7A3EF100C5F559CF_7019_UN,8.143773,00000000000000000000001000000000000000000010000000001000000000100110000000110000100100010000001010010001010100001000001011101100110001110100011010011110000010101111010,BMJDHSQOCBSGFK-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)Br)C)NCC2=NC=CN2C[C@H]4[C@H]3CNC[C@H]3C4,6FEB1E608DFEC021_08176959757CAEFE_6034_UN,7.9520416,00000000000100000001000000000000000000100000001000000000000000000100000000010101001101110011000010001000010110010000000011100100110101110110001010001111010110101111010,PEGHTQGPEOLIRU-VYDXJSESSA-N
CC1OC(CN(C1)CC2=CC=C(C=C2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F)C,B784F06A20DB7453_3453139EF6C4EB3D_6041_UN,8.69264,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011010110101000100110010001101011100100100011110110011011011111110111101111110,CXKSKIPAFJHOJL-ODHCCTKASA-N
N(CC1CC2CCC(C1)S2)C(=O)CC3=CC(=C(C=C3)Br)Cl,E02C454B9B106703_13FFD7B6A5AF1EA3_6038_UN,7.543291,00000000000000000001000000000000000010000000001000000000000000000000000000000000011100011010100010101001110100110000011000000000110010100100000011010011011110100111110,YGHWOSCFTNPBAU-UHFFFAOYSA-N
N(CC1CC2CCC(C1)S2)C(=O)CC3=CC(=C(C=C3)Br)Br,2843D2782A2C4DDF_555ABDAAEF1DE89C_6038_UN,7.5432863,00000000000000000001000000000000000010000000001000000000000000000000000000000000011100011010100010101000110100110000011000000000110010100100000011010011011110100111110,RQPWYJVBWFMFMR-UHFFFAOYSA-N
N(CC1CC2CCC(C1)S2)C(=O)CC3=CC(=C(C=C3)F)F,2AA367AAB25E1276_8ACBC290AD0F691A_6038_UN,7.543289,00000000000000000001000000000000000010000010000000000000000000000000000000000000011100011010100010101000110100110000011000000000110010100100000011010011011110100111110,OOCWNSBVVAKEBL-UHFFFAOYSA-N
N(CC1CC2CCC(C1)S2)C(=O)CC3=CC(=C(C=C3)Cl)F,CAD227C46F514540_A29A1E16736EEF66_6038_UN,7.543285,00000000000000000001000000000000000010000010000000000000000000000000000000000000011100011010100010101001110100110000011000000000110010100100000011010011011110100111110,ITNXMMGMTFNLJQ-UHFFFAOYSA-N
N(CC1CC2CCC(C1)S2)C(=O)CC3=CC(=C(C=C3)F)Br,5A5D7FF7639BF119_CE2575C41971ED73_6038_UN,7.5432816,00000000000000000001000000000000000010000010001000000000000000000000000000000000011100011010100010101000110100110000011000000000110010100100000011010011011110100111110,SCLPYBHNHRJBIR-UHFFFAOYSA-N
N(CC1CC2CCC(C1)S2)C(=O)CC3=CC(=C(C=C3)F)Cl,851793050DE07630_C796CC68C6A68A59_6038_UN,7.5432825,00000000000000000001000000000000000010000010000000000000000000000000000000000000011100011010100010101001110100110000011000000000110010100100000011010011011110100111110,QNJFOAXIDUHCLH-UHFFFAOYSA-N
N(CC1CC2CCC(C1)S2)C(=O)CC3=CC(=C(C=C3)Br)F,41C87364E3337F65_C7D7061CD84F2B66_6038_UN,7.5432816,00000000000000000001000000000000000010000010001000000000000000000000000000000000011100011010100010101000110100110000011000000000110010100100000011010011011110100111110,CBWROOOXJADVEH-UHFFFAOYSA-N
N(CC1CC2CCC(C1)S2)C(=O)CC3=CC(=C(C=C3)Cl)Cl,0B84B200FE6349BD_02785AC89F98BEEE_6038_UN,7.543273,00000000000000000001000000000000000010000000000000000000000000000000000000000000011100011010100010101001110100110000011000000000110010100100000011010011011110100111110,DLOCHVJIQLGGTB-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)N[C@H]3CO[C@H]4CNC[C@@H]34,D6B1F20AF18F6C2D_46E1BD02F94D8867_7022_DP,7.6100054,00000000000000000000001000000000000000000110000000000100010000100010000000000000101100110011000111001100110101011000000011000000110111110110001010010011110011100111110,WVYGHOBKHJZKHJ-CQDKDKBSSA-N
CN(CC1CCNC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=C(C(=CC=C4)F)F,C82F9BFDC650B1DD_90A209720CDE5A89_6041_DP,8.221809,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000100110010001001011100100110101110110001011011011010110101111010,PGMVSMZVYOXMLF-OTZYVQGASA-N
IC1=CN(C2=C1C=CC=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,01C3A03FA6B0CBEF_9DA043E9B8AE907B_6034_UN,8.475708,00000000000000000000001000010000000000000000000000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,LTAALLSEGBWRDS-VFNWGFHPSA-N
BrC1=CN(C2=C1C=CC=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,8C91B6DF6F3D9DFF_EE3454867FFD00E7_6034_UN,8.475709,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,ISBDDOQUPWTHRB-VFNWGFHPSA-N
N(C1=CC=C(C=C1)N2CC3CCC(C2)O3)C(=O)C4(CCC4)C5=CC(=C(C=C5)Cl)F,D0F04600EF69F178_BE23B75784C06DB8_6038_UN,7.669069,00000000000100000001000000000000000000000010000000000000010000100010000000010000000101110011100110101001010100101000011011100100110011110110001011011011111011110111110,YHDPCANNBVAMNR-UHFFFAOYSA-N
ClC1=CN(C2=C1C=CC=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,3DB74D2F199D9151_0DB8D8E24BB57FEB_6034_UN,8.4756975,00000000000000000000001000000000000000000000000000000000000000100100000000010101100101010000010010101101010100010000001011100100110001100110001011011010010110101111010,DWZIAJDGHHUARE-VFNWGFHPSA-N
N(C1=CC=C(C=C1)N2CC3CCC(C2)O3)C(=O)C4(CCC4)C5=CC(=C(C=C5)Cl)Cl,EDD979DDDBCF9D8E_71C6ED5F5FF6149E_6038_UN,7.669055,00000000000100000001000000000000000000000000000000000000010000100010000000010000000101110011100110101001010100101000011011100100110011110110001011011011111011110111110,DVYKTWROTXODIY-UHFFFAOYSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)CC3CC5(C3)CC4(CCC4)C5,C73376F71B02C7A9_F5BA43BA4205850B_6034_UN,8.1125145,00000000000100000000000000000000000010000000000100000000000000100110000000010110010101011000000010001001011100011011001111100100110001110100001010011110010110101111010,XWWVNPVCLYKAMV-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)F)NC2CN(C)C3(C2)CCCC3)F,6429353835BDCB33_60FC41D8480FB161_7022_UN,7.5030165,00000000000000000000000000000000000000000010000000000000000000000010000000010001100101110001010010001000110110011001101001100000110001110100001010011111010010101111010,QPHSFAHGNOMKOH-UHFFFAOYSA-N
CC1=CC2=C(C=C1)[N](C(=N2)C3CNCCC3)C[C@@]45CCN(C)C[C@H]4CNC5,5E00C4C634BCC65B_E25C5BD35F48EB53_6034_DP,8.154514,00000000000000000000000000000000000000100000000000000000000000100110000000010101101101100011010010101100110010011001101011100100110100000110001011011111010110101111010,ZSKBZOFPIBVJHF-CZCIXBEGSA-N
CC5(C)CCC1=C(C4=C([N]1CC2[C@@H]3CNC[C@H]23)C=CC(=C4)Br)C5,F269E7A79E35E98B_4C98EF0A178BBF7C_6034_DP,8.103006,00000000000000000000001000000000000000000000001000000000000000000110000000110000001101110001000010101100010100011001101011100100110000100110001011011101010110101111010,KGJUKEOVTQHMCW-SJPCQFCGSA-N
CC5(C)CCC1=C(C4=C(N1CC2[C@@H]3CNC[C@H]23)C=CC(=C4)Br)C5,F269E7A79E35E98B_B615F20ABF1F25BB_6034_UN,8.102995,00000000000000000000001000000000000000000000001000000000000000000110000000110000001101110001000010101100010100011001101011100100110000100110001011011101010110101111010,KGJUKEOVTQHMCW-SJPCQFCGSA-N
CC1=CC2=C(C=C1)C(=CN2CC3CC3=CC4=C(C=CC=C4)Cl)C5CCNCC5,97150C2A8D75F36A_70D8F033B259BF48_6034_UN,8.515526,00000000000000000000001000000000000000000000000000100000000000100100000000011000001101110001000010111101110100010000001011100100110000100110001011011011010110101111010,XNRFUZOGFMBSJB-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3CC4(CN3)CCOCC4,312ACE5584846CE5_5BBD0C369C6EC9B4_6041_DP,7.050009,00000000000000000000000000000000000000100000000000001010010000100110000000010101101101100011011010101000110011011000001011101100110111010110001011011111010111101111110,DDZYWQNVGJSDPZ-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC(N3CCOCC3)C4=C(C=CC=C4)F,933617C995571EE2_3A8FD8C25F854B74_6041_UN,7.51623,00000000000000000000001000000000000000000010000000001000010000100100000000010001101101110001011110101000000101010000001011101100110011110110001011011011010111101111110,INKRPHYDDYMSFV-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)C3=CC=C(C=C3)CCF,3D22788C2D11949E_6BB77FA1F12381A0_6038_UN,7.7794514,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000000011100010001000010000100000011000000000110000100010000001010001011110100111110,VBSNNFMROYKTCA-UHFFFAOYSA-N
O(C1=CC2=C(C=C1)OCCC2)C(C4=CC3=C(C=C[N]3C)[NH]4)=O,6ECBC2CCCC3633CB_B8C2A6D3707BB3BF_6038_UN,8.458998,00000000000000000000000000000000000000000000000000000000010000000100000000010001100101000000010110100100010001000100001011110111100010000100001111111001111011111111110,GROIYRAFRQDPEZ-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC3CCOC(C)(C3)C,1436DEC9A0A8F490_518E7679B3F9378A_6041_UN,7.924506,00000000000000000000000000000000000000000010000000000000010000000110000000100000101000010011000000101100010111001001101011000100110011110110011011010111110111101111110,VKZIXZNWDWJYSJ-UHFFFAOYSA-N
FC2=C1N=C([NH]C1=CC=C2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,4D165FAA69D1511A_B0219A66B8218632_6041_UN,8.166202,00000000000000000000001001000000000000000011000000000000000000000110000000100101001100010011000010001100011100001001101011000100110101110100001011010101010110101111010,UORJELBCKBDZCP-UHFFFAOYSA-N
CC1=C(C(=CC=C1)Cl)NC24CC(OC23CCNCC3)(C)C4,1BACF55382C58411_30B8D75E70DA99A2_7022_DP,7.9598756,00000000000100000000000000000000000000000000000000000000010000000010000000000000001100110011000111101001110110011001001011000000110111110110001011010111110011101111110,LIBCCXOFQPVWIR-UHFFFAOYSA-N
CC1=C(C(=CC=C1)F)NC24CC(OC23CCNCC3)(C)C4,3865343B081FCBCF_8FB61DACB902C372_6041_DP,7.95987,00000000000100000000000000000000000000000010000000000000010000000010000000000000001100110011000111101000110110011001001011000000110111110110001011010111110011101111110,QFJUXXLNLRYJMZ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2N([C@H](C)CC2)C)Cl)C3CC3,15C2AE6B41EAAF2E_B343CF0E416F3784_7022_UN,8.403383,00000000000000000000001000000000000000000000000000000000000000100000000000010001001101010011010010001001000110010001101001100000110001110100011010011111010110101111010,PGFFHHPUFVYMPQ-TZMCWYRMSA-N
FC2=C1N=CC=C(C1=C(C=C2)F)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,692E9811D173E747_4BBCAA58A0FE6209_6041_UN,8.467963,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,XAWVGMPYDOKHRM-PEBXRYMYSA-N
CN1CCC2=C1C=CC(=C2)NC3C(CCC4(CC3)OCCO4)(F)F,E28671DE10E285B6_7D9A0E04544DB810_7022_UN,7.247048,00000000000000000001000000000000000000000010000000000000010000000000000010010000000101110011010010001100110111011001101011110000110011110110001010011011110011111111110,OOVUMOYMLDKSPD-UHFFFAOYSA-N
CN(C1CCNCC1)C2=NC(=CN=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,A67C486B71B8AB1F_29C62E23577B985D_6041_DP,8.396459,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100110101110110001001011111010010101111010,YWUOCGCMEJVIDD-NQIIRXRSSA-N
NCC4(OC2=C1CNCCC1=C(C=C2)F)CCC3=C(C=CC=C3)C4,65BD97433AD20975_4A08FC7E8D3D2861_6035_UN,7.9871273,00000000000000000000000000000000000000000010000000000000000000000010000000000000001010110011000101101100110100011100001001000111110110100110001111010001110101100111110,HBPRYMRXSGXVGL-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C=CC2)NC3=C[N](C[Si](C)(C)C)N=C3,61AE1F76600F999F_63E964C997A52AF8_6041_UN,7.618435,00000000000000000000100000001010000000000000000000001000000000000100000000110001100100100001011010011100010000011001000011101100000001010100011010001101010110101111010,OIEPAKSOIRIYSH-UHFFFAOYSA-N
C2(=C1COCC1=CC=C2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,8E73B0363AEE3406_4E78CBABC7F4D4BF_6041_UN,7.269557,00000000000000000000000000000000000000000010000000000000010000000000000000010001000101110011010011101100010101010001101011100100110001110110001011011011010111101111110,SOALQOCWAJSWKQ-UHFFFAOYSA-N
FC2=C1N=CC(=CC1=CC=C2)NCC3CCCC(CC)CC3,08EDDCB362C03CFD_EC29B6C43AC9F4B7_6041_UN,8.269006,00000000000000000001000000000000000000000010000000000000000000000100000000000001001000010011000000101100010110000010101001000100110001110100001001010001010110101111010,OITKHYWQVYDLIN-UHFFFAOYSA-N
ClC1=CC2=C(C=C1)C(=O)N(C=C2)CC3(N)CCCC4=C3C=CC=C4,C12918BECFF90016_53BBE752E345A1B2_6034_UN,9.165514,00000000000000000000000000000000000000000000000000000000000000000110000000010001000011010011100000101101110100111100011001100101110001100100001111011011011110100111110,QEFAVEIGVYVECN-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=O)N(C=C2)CC3(N)CCCC4=C3C=CC=C4,0796244E78ACE87D_111DB154A297AFD4_6034_UN,9.165503,00000000000000000000000000000000000000000010000000000000000000000110000000010001000011010011100000101100110100111100011001100101110001100100001111011011011110100111110,DZUJZTDIMMIVNM-UHFFFAOYSA-N
CCNC5CCC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3=CC(=CC=C3)F)C=CC(=C4)Cl)C5,7D40AB11384FD18D_B4E5FA106CCE489F_6034_UN,8.117562,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010001101110110010010001011100100110101100110001011011011010110101111010,GDBJUZJFUDVTTC-FLOOPIEZSA-N
CCCC(NC(=O)CC1CC2CCC1O2)C3=C(C=CC(=C3)F)F,7FDA5E934997D89A_095A82CEE0980580_6038_UN,7.9144897,00000000000000000000000000000000000000000010000000000000010000000000000000000000000100010011100010000000110100110011011000000000110010100100000011010011101111111111110,VRTFLXKWDBAZPC-UHFFFAOYSA-N
O(C2=C1OCCC1=CC=C2)C(C4=CC3=C(C=C(SC)C=C3)[NH]4)=O,F4B44D3F4BFCB684_6089AC527B49973C_6038_UN,8.751635,00000000000000000000000000000000000000000000000000000000010100001100000010000000010100001000010110000100010001000100001011010111000010000100000111110001111011011111110,DCWKXEFBDFZCFA-UHFFFAOYSA-N
C1(=CN=C(N=C1)C2CCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,8F9DCCD17981CDBF_2EF10E9A1F8F6873_6041_UN,8.899817,00000000000100000000000000000000000000100010000000000000000000100100000000010101100101110011010010101000100110010001101011100100000001110100001011011011010010101111010,WBOCHQCZEWFMFG-MSOLQXFVSA-N
FC2=C1[NH]C=CC1=CC=C2NC(CC)C3CCOCC3,699E394E5270FA98_0E0303422B90A1DC_6041_UN,8.324244,00000000000000000000000000000000000000000010000000000100010000000100000000000000100100110011000010100100110111010010001011000100110111110110001011010011010111101111110,OJZDDWJCDLJJCQ-UHFFFAOYSA-N
CCC4=CC1=C(C=CN(C1=O)CC2C3CCC(C2)CN3)O4,618E242984FF8695_3C1CB55FB9E91DB3_6034_UN,8.695804,00000000000000000000000000000000000000000000000000000000010000000100000000010000101101000111100011101100110000110110011011100101110010000110001111011011111110111111110,SLRUDCSHFHRPAA-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=CC2=O)C[C@]34CCC[C@H]3NCC4,19F94316171B50D6_395ECF3D8EC6D7E6_6034_UN,8.926846,00000000000000000000000000000000000000000000001000000000000000000110000000010000101101010011000011101100110100011100001011100101110000100110001101011001111110100111110,SNMODGQULOHMJY-IAGOWNOFSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC(C)[CH]3C[C]4(C3)C[CH2]C4,92ABA4D5BC66629E_1ADD1D17ACEC722D_6041_UN,8.201608,00000000000100000000000000000000000000000010000000001000000000000110000000010000100100010010011010000100010100001000101011101100110001110100001000011101000010101111010,MJYDNDRRGZNFGF-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCCC2CC)Cl)C3CC3,45709E92C617A5FA_6145BCDBF230076B_7022_UN,7.950495,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010011000010001001000110000010101000000000110001110000000010010111010110101111010,QFLVQISPBLPTIJ-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=NC=C1)NCCC2CCCCN2,9CD1AC86646ED6B7_1F046AE5FE1E12FA_6041_DP,8.258705,00000000000000000100100000000010000000100000000000000100000000000100000000100100101000100011010000101000100000011000001011000000110101010110011001011101010110101111010,NPYWJXZOXQOEET-UHFFFAOYSA-N
CC3(C)CCCC(C=CC1=C(F)C=CC2=C1C=C[NH]2)C3,C93584A106C4AC99_10BD488CA81ACD68_7019_UN,8.266922,00000000000000000000000000000000000000000010000000000000000000000110000000100000000100010000000010010100010110001001101001000100110000100100000011010111000010001111010,ZVNXAIVLYWWOLK-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCCCC3)C4=CC(=CC=C4)F,EEFC85B4CF158764_1E56CCDA841BE3A0_6041_UN,7.4943357,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100110001110100001011011011000010101111010,ZFCAWQQBQZFVJV-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4=C(C=C(C=C4)F)C5=CC=C(C=C5)F,5E0730A245B44927_C1966D17B4C3C9CC_6041_DP,8.018376,00000000000000000001000001000000000000100010000000000000000000100100000000000100100101010011010010100000111100010000101011100100110101110100001011011011000010101111010,QHXFQYDXXSOAQR-ACDBMABISA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NC(CC3CCCC3)CC4CCCC4,E2375690384AC292_0DEEE13118F457F3_6041_UN,7.7932787,00000000000000000000000000000000000000000010000000000000000000000100000000000000100000010001000010100100110100010000001001000100110001110100001011010011000110101111010,WHJYSJHDOLZSDI-UHFFFAOYSA-N
CC(C)C1=CC(=C(C=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)F,4425A19C09E049E5_27FB3D31D771D9DD_7022_UN,8.451058,00000000000000000000000000000000000000000010000000001000010000100100000000110000101101110001011110101000000111010001101011101100110011110110011011011111110111101111110,MFZJFTOHSYCPDO-OALUTQOASA-N
CC1=C(C=CC(=C1F)NCC2CC3(CN2)CCOCC3)C#N,168CDEB977DA63BF_D89C01680978F445_6041_DP,7.967167,00000000000000000000000000000000000000000110000000000010010000000010000000000001001100110011000010101000110101011000001011000000110111110110001011010011010111101111110,MOXGVAPMHNUEIG-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CCC(C)C3CCNCC3)Cl,D3C7CB956D2F6E08_50292E50EE7F984C_6034_DP,7.981433,00000000000000000000000000000000000010000000000100000000000000000100000000010110011101111011000010101001101110010001101111100100110101110110001011011111010110101111010,CTLBDUWUTOLFSN-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@]23C[C@H]2COC34CCC4)Cl)C5CC5,2B76CDEA181383C7_C0D12D6B02388B22_7022_UN,7.579338,00000000000100000000001000000000000000000000000000000000010000100010000000000000001100010011000011101001010111001000001000000000110011110110000011010011110111101111110,XWQNRDWPMACRLL-KBXCAEBGSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)N[C@H]3[C@@H](OCC3)C4=C[N](N=C4)CC5CC5)C,65F3AC1E545387DF_1F13A7FB3BBC6F6E_6041_UN,8.608002,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011001111101100110101010000001011101100010011110110001011011111110111101111110,NVEVCYLPHSNUJG-IRLDBZIGSA-N
CC1=C(C=C(C(=C1)NC(COC)C2CCCOC2)F)F,CA1A1082D1AE7368_F662EDC7EFD2DC4E_7022_UN,7.355399,00000000000000000000000000000000000000000010000000000000010000000000000000000000000000110011010101100000100101010001001000000010110011110110000011010111010111111111110,JGDMEOLDJQSPLY-UHFFFAOYSA-N
CC1=NC(=NC(=C1)NC[C@H]2[C@@H](OCC2)C3=CC=C(C=C3)F)CC4CC4,3721FF141369DF52_BB666C865503A00F_6041_UN,7.802954,00000000000000000000001000000000000000100010000000000000010000100100000000000100101100010011000011101000000111010000001011000100110011110110001001010011110111101111110,QMMYBELRUQLDAS-JXFKEZNVSA-N
FC1=CC2=C(C=C1)C=CN(C2=O)C[C@H]4[C@H]3CNC[C@H]3OC4,41E24D04561B1C11_1A732F47A992353D_6034_UN,8.68308,00000000000000000000000000000000000000000010000000000000010000000100000000010000001101110001100111101100010101100100010011100101110010100110001111001011111111110111110,WTDUVASHIIZPRI-KCPJHIHWSA-N
CC1=C(C(=CC=C1)F)NCC2C(CCCC2)N3CCCC3,841CDCACB1C79B28_4D72D3E603EB240D_6041_UN,8.464542,00000000000000000000000000000000000000000010000000000000000000100000000000010000101101110011000010001000000110010000001001100000110001110110001011011011010110101111010,OLTWRQNREQFHPH-UHFFFAOYSA-N
CC1=C(C(=CC=C1)Cl)NCC2C(CCCC2)N3CCCC3,1AEC3B85894C26EB_2CD1A3FFCBD1029B_7022_UN,8.464544,00000000000000000000000000000000000000000000000000000000000000100000000000010000101101110011000010001001000110010000001001100000110001110110001011011011010110101111010,JSWWKOGZORSHES-UHFFFAOYSA-N
CN(CC1CNC1)C2=NC(=CN=C2)N[C@H]3[C@@H](CCC3)C4=CC=C(C=C4)F,C7C967F8619F30B4_A784B7CD5A6C4CE6_6041_DP,7.976349,00000000100100000000000000000000000000100010000000000000000000100100000000000101101001110011010010101000100110010001001011100100110101110110001001011011010110101111010,HZCULFZWZCANLL-ZWKOTPCHSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCC3CCN(CC2=CC=NC=C2)CC3,605012D6D183D987_9B9B854953AE3D71_6041_UN,7.9744005,00000000000000000000100000000010000010000000000000000000000000000100000000110000011101101011010010101000000000011000001011100100110001010110011011011111010110101111010,HWZXMURHQAPFBJ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC(C2=NC=CC(=C2)C)C3CCOCC3)F)CC4,9A3D9080AF365864_8DC728B6835DA076_6041_UN,8.026597,00000000000000000001000000000000000000000010000000000000010000000100000000010001100001110011010000101000000111010001101011100100110011110110001011011111010111101111110,LBMSQONCSWCEPC-UHFFFAOYSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC2=C[N](N=C2)CC3CCCO3,D1CE03460F94D493_B9ECFB09A62562C2_6041_UN,8.082431,00000000000000000000100000000010000000000000000000001000010000000100000000110001100100100011011111001000000001011001001011101100110011010110011010011111110111101111110,DOJYOPYIMUCNDD-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(C5=C(CC)N=C4C=C(C=CC4=C5)F)=O,48547FDD893CD772_059E9305502E6489_6038_UN,7.863943,00000000000100000000000000000000000000000010000000000000000000000110000000000000101000010011100011101100010100111010011001000100110000100100001011010011011110101111110,RGKXRJXRVDZYEG-UHFFFAOYSA-N
N(CC23CC(CC1=CC=CC=C1)(C2)CO3)[S](C4=CC=CC5=C4N=C(Cl)C=C5Cl)(=O)=O,90DF996A5B0A3F2B_6385EFEC1363C7DD_6029_UN,7.6592083,00000000000100000000000000000000110000000000000000010001011111001111010001000000111100011011001111101111011101001000010011001100111010101110001001101001110111110111110,JMQZOAHJJIDLRG-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC3C4(CCCC3)CCCCC4,FC73040BA39871C7_37491D7F3DC92897_6041_UN,8.200599,00000000000000000000000000000000000000000010000000000000000000000110000000000000100000010011000000100100110100011000001001000100110001110100001011010011000010101111010,LQPJTACHMCVTLB-UHFFFAOYSA-N
FC1=C(C=CC=C1)C2=C[N](C(=N2)C3CCCN3)C[C@@]45CCCN[C@H]4CCCC5,10F332581E0C3BDB_3E9617E1A74024B8_6034_DP,8.437235,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101010011000010101100110100011000001011100100110100100110001011011011010110100111010,FXXUVHQZHPUBAL-YTVKWDEWSA-N
CC1=C(C=C(C(=C1)NCC2(CCCC2)C3=CC=CS3)Cl)C4CC4,B227861EA0D5B9A7_5144AC4352FACCB9_7022_UN,7.509594,00000000000000000000001000000000000010000000000000000000000000100010000000000000011100011011000010001001000110001000001000000100110001110100000010010011010110101111010,QRMOOIIELFBZGP-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3NCC(C)(C)C3)Cl,945379F24A790554_AD11AE5D91156856_6034_UN,8.614386,00000000000000000000000000000000000010000000000100000000000000000110000000110111011101011011000010001001101110011001000111100100110101110110011010001111010110101111010,QRCTYNKNIJJVTE-UHFFFAOYSA-N
CN(CC1CCNC1)C2=NC(=CN=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,37AABF1D747A2B35_D3E1138A486FA1BB_6041_DP,8.283115,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100110101110110001001011111010110101111010,ISECUQRLZALKEL-BAMDKVGYSA-N
CCN3CCO[C@@H](CNC(C=C2CC1CCC(N1C)C2)=O)[C@@H]3C4=CC=CC=C4,66D9FA20079FCADB_F45E5228C8AD314E_6038_UN,8.365208,00000000000000000001000000000000000000000000000000100000010000100000000000011000101101100001110110111000010011110010111011100000110010000110001001011111111111111111110,RFTVHCBHLASULB-JRJYRQGGSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCOCC23CCCCC3)F)CC4,3398DFBAFF1866B8_07E4C1FDA625F85C_6041_UN,6.885264,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110011010001101000110111011001101011100000110011110110001011011011010111101111110,MVHKJWCXTFGCJW-UHFFFAOYSA-N
BrC2=C1N(C(C=CC1=CC=C2)=O)CC45OC3(CCNCC3)C(C4)(N)C5,456568F6F963428E_477B6822C2A4DAD9_6034_DP,8.071959,00000000000100000000000000000000000000000000001000000000010000000110000000010000001111110011100111101100110100111100011011100101110111100110001111011011111111110111110,HUQVGELRTWZUQT-UHFFFAOYSA-N
C[N]1N=CC(=C1)C4=NC2=C(C3=C(S2)CCCC3)C(=C4C5NCCC5)C6=CC=C(C=C6)Cl,22AB4036364B96C5_5398BE1D837B0C93_2201_UN,7.6295,00000000000000000000000000000000000010000000000100001000000000100100000000010000111100011011011010101101110100010000001011101100110000100100001011011011010010101111010,CRXWSTVTRIPXSU-UHFFFAOYSA-N
N1C5CCC1C(C=CC4=CC2=C([N](N=C2C)C3=CC=CC=C3)N=C4Cl)C5,E81152A845FC6451_4CF815656D1AE041_7019_DP,8.3817005,00000000000000000000000000000000000000100000000000001000000000100100000000010101100100010010001010110101110100010000001011101100110001110100001011011011000010101111010,YCEBEMAGERZJMJ-UHFFFAOYSA-N
C[N]1N=CC(=C1)C4=NC2=C(C3=C(S2)CCCC3)C(=C4C5NCCC5)C6=CC=C(C=C6)Br,B8AF84B345A7A77F_AE5CE2289CB119DA_2201_UN,7.629476,00000000000000000000000000000000000010000000001100001000000000100100000000010000111100011011011010101100110100010000001011101100110000100100001011011011010010101111010,NIDQIKOBJINKST-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NC3C[C@H]2CCC[C@H](N2C)C3)C=NC=C4,1437DC043A3D74A9_88E6BFF66F723850_6041_UN,8.2243805,00000000000000000000000000000000000000000010000000000000000000000100000000010000100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,LHPIRXWMJPPBFY-MQVJKMGUSA-N
CC1=C(C(=CC(=C1)C#N)C)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,4F6E8914D76FDAEC_AC85DE4152CA2437_6041_DP,7.343973,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100110010000001001000100110101110110001011010111010110101111010,DKUUCICYSGXVCT-AZUAARDMSA-N
N4CC1=C(C=C(C=C1)NC2=CC=C(CC[Si](C)(C)C)C=C2)C3(CC3)C4,30C1A683A58BE340_48E81CFAA65E7EB9_6041_DP,7.169264,00000000000000000000101000000010000000000000000000000000000000000010000000100000001000100011010000101100010000001001101001000100110101010110011011011101010110101111010,CGNCPNZWELJXGT-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CCCC3)C4=CC=C(C=C4)F,012B0D29B7DD0CD5_1EF8598E36CD6F51_6041_UN,7.701726,00000000000000000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,NQTMHNHLWKCJDH-FQEVSTJZSA-N
FC1=C(C2=C(C=C1)C=CO2)NCC3C(CC)CCCC3,2DB4165DB9593638_E473026EF00703E5_6041_UN,8.111117,00000000000000000000000000000000000000000010000000000000010000000000000000000000001100010011000110001100010110000010101000000100110001110100000011010011110110101111110,KYHXBAHBRUEFDZ-UHFFFAOYSA-N
FC1=CC(=CN=C1)C2=C4C(=CC(=C2)C=CC3CCOC3(C)C)OCO4,47B2905603C11BEA_73AC37E65DC30A17_7019_UN,8.046084,00000000000000000000000000001000000000000010000000000000010000100110000010100000000100010000000010110100010111001100101011010100000010100110000011110110110001011111110,RBKRWGONQOFSHX-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCCC(O3)C4CC4,904A9312DD2C5EF6_480DE0054F796217_6041_UN,7.9118834,00000000000000000000001000000000000000000010000000001000010000100100000000010000101100010011011110101100010100000000001011101100110011110100001001011001110111101111110,OEMVBRCFWJBLSQ-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)N[C@@H]2C4=C(OC3(C2)CCCC3)C=CC(=C4)F)F,A8B60CD4C86EEEE3_55F9886615BDA134_6041_UN,7.309407,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110001010011101100110100011101001000100100110011110100001011011111110111101111110,DYNIJGJVCLGVQW-FQEVSTJZSA-N
CN(C)CC1=C(C=CC(=C1)N[C@@H]2C4=C(OC3(C2)CCCC3)C=CC(=C4)Cl)F,538A3936DBF1E6B2_E39E0F541A4AAB7B_7022_UN,7.309413,00000000000000000000000000000000000000000010000000000000010000000010000000100000000001110001010011101101110100011101001000100100110011110100001011011111110111101111110,UFVWEBAMHYMCNY-FQEVSTJZSA-N
O(CC1CCCC2=C1N=CC=C2)CC3=CC=C([Si](C)(C)C)C=C3,41A461D76B796FC4_361DD12341600B00_6039_UN,7.8740396,00000000000000000000100000000010000000000000000000000000000000000100000000100000000000100000010001100100010001001000001001000110110000000110010011011100010111001111110,MZAQABOOIAHALK-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2=NN=C(C=C2)NC4C[C@H]3CCC[C@H](N3C)C4,46BB66A522C3ECDD_422E458D15C1AFC3_6041_UN,7.6911483,00000000000000000000000000000000000000100010000000001000000000100100000000010101100001010001011000100100110110010000101011101100110001110100001001011001000010101111010,QLVOCICAWOPLGG-ALOPSCKCSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCCOC23CCNCC3)F)CC4,6574156DE0CC56B2_3D12E7E78CC4CB6E_6041_DP,7.1551757,00000000000000000001000000000000000000000010000000000000010000000010000000010001101001110011010101101000110111011001101011100000110111110110001011011011110111101111110,ZOKJAPSJQZSXIZ-UHFFFAOYSA-N
CCC2=C1N(C=C(C1=CC=C2)C3=CCNCC3)CC5CCCN(CC4=CC=C(C=C4)I)C5,61FD6FC138DC964B_6F7E3B9E70478BC4_6034_UN,8.520589,00000000000000000000000000010000000000000000000000100000000000100100000000011000101101110001000010111100110100010010001011100100110000100110001001011001010110101111010,KEFIXIRYGSCQHN-UHFFFAOYSA-N
CC1=C(SC=N1)CCC=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,6236F9E047113254_E59591FE1452F427_7019_UN,7.8390713,00000000000000000000000000000000000010000010000100000000000000000100000000000000010101011000010010010000000110010000101011100100010001110100001010011110000110101111010,SFZSOZKUJHQENO-UHFFFAOYSA-N
CC2=C1N=CC(=C(C1=CC(=C2)F)NCC3CNCC4(O3)CCC4)C#N,2B2BCA3B9022EB24_929797E8067D3089_6041_DP,7.463725,00000000000100000000000000000000000000000110000000000100010000000110000000000000101000110011000100101100010100001000001011000100110111110110001011010011110111101111110,OIMJWBSXFAJLDE-UHFFFAOYSA-N
CC1=C(C(=NC(=N1)C2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F)F,A8672645AABD186C_80E0B5DD185520A6_6041_UN,8.920041,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101110011010010101000100110010001101011100100000001110100001011011111010010101111010,IMVLKQLGIHVUNE-WBVHZDCISA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4=C(C(=CC(=C4)F)F)F,D06961CFBCEDF61F_564B952126287053_6041_DP,8.283116,00000000000000000001000001000000000000100010000000000000000000000100000000000100100101010011010010100000111100010000101011100100110101110100001011011011000010101111010,ICCMRQBZTVYBDR-CLLJXQQHSA-N
NCCC(OC1=CC(=CC=C1)CC2CCNCC2)C3=CC(=C(C=C3)Cl)Cl,9E0E1099454E3E90_2FC7DA110E1CF2FC_6035_UN,8.263599,00000000000000000000000000000000000000000000000000000000000000000000000000000000001010110001000001101001100100010100001001000111110110100110001111010011110101100111110,MWIKRPHBEMTPRC-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,52FDC0ABF1BF9BA9_51A0EFED52643162_6041_UN,7.9809,00000000000000000000000000000000000000000010000000000000010000100100000000010000101001110001010100101100010111010001101011100100110011110110001011011111110111101111110,XAGAVPOGTJBOOJ-UNMCSNQZSA-N
FC2=C1C(=C[NH]C1=CC=C2)NCC3CCCCN(C)C3,5F218076F8AF40BA_CC416F451E8CD7E7_6041_UN,8.201952,00000000000000000001000000000000000000000010000000000110000000000100000000010001101101110011010010001100010110010001101011100100110101110110001000011001010110101111010,ATGMYTRSSPHDIN-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)C4=C(C5=C(C=C4)OCO5)F,9323FA04E4FF224B_41A231CDBE5964A8_6006_DP,8.378206,00000000000000000001000000001000000000100010000000000000010000100100000010000101100101010011010010100100110101010100101011110100110001110100001011011011110011111111110,QAHZUFIEDYNABT-CLLJXQQHSA-N
C1(=C(SC=C1)Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,25796D491B47D678_09AC29496D0571AC_7022_UN,7.896196,00000000000000000000001000000000000010000000000000001000000000100100000000010001111101011011011010101001000100010000001011101100110001110110001010011011010110101111010,QKDIEYHKTOHKFL-WBMJQRKESA-N
CCN4CCC1=C(C(=CC(=C1)NCC3(C2=C(C=C(C)C=C2)C)CCCC3)F)C4,CC526DFC42E30677_6392615EDCCA8283_6041_UN,7.8390718,00000000000000000000000000000000000000000010000000000000000000100010000000010000001001110011000010101100010110011010101001100100110001110110011011011111010110101111010,IVQYKUSRSLGMFS-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=CC3=C(C=C2)CCOC3,7D95B413E60C852B_2DFEB34379DC2971_6041_UN,7.61095,00000000000000000000100000000010000000000000000000000000010000000100000000100001000000100001010000100100010001001000001011000100110011010110011011011111010011101111110,XOGBAHJJYRNLMM-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3C(C(C)C)OCC3,81437B7F02F1FFE3_1BF197121387C825_6041_UN,8.164898,00000000000000000000000000000000000000100000000000000000010000000100000000100100001100000011000011101100010011000000001011000100110011010110011011010111110111101111110,PREPWJPFUOKIDV-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3C4(CCCC3)CCCCC4,2777EFF0346FD28E_5331F9BB7C25D89B_6041_UN,7.549197,00000000000000000000000000000000000000000010000000001000000000000110000000010000100100010011011010000100110100011000001011101100110001110100001001011001000010101111010,BJRQNSYOKFVRCT-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC3OC2(CCC(C)CC2)CC3)F)[N]4C=CC=C4,FE9C15D04E0624AB_15E3DDA89AAD82A4_6041_UN,7.888546,00000000000000000000000000000000000000000010000000000000010000100110000000010000001101010011000110001000010100001001101011100100110011110100001011011111110111101111110,QFVQOAWBKZZFNA-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC4CCN(CC2=CC=CC=C2)C3(CC3)C4)Cl)C5CC5,B10E49D0BCC0693F_B2029E774D01FF31_7022_UN,8.195115,00000000000000000000001000000000000000000000000000000000000000100010000000010000100001110011000000101001110110011000001001100100110001110110001011011011010110101111010,FBOFIULWLWSBKQ-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)N[C@H]4[C@H](C3=NC=C[N]3C)OCCC4,61B47D1344D7AF30_6F01C6C98AD74033_7022_UN,7.7869864,00000000000000000000001000000000000000100000000000000000010000100100000000010101100101010011010110100001100101010000001011100100100011110100001011011011110011101111110,GJBPVMPSRGGUNC-IAGOWNOFSA-N
FC2=C1SC=C(C1=CC=C2)NCC3CCN(C(CC)C)C3,665024F292596169_79C3E5E98BDF0DCB_6041_UN,8.269932,00000000000000000000000000000000000010000010000000000000000000000000000000010000111101111011000010001100010110010011101011100100110001110110001000011101010110101111010,FRJUKRJWEDDLTM-UHFFFAOYSA-N
C2(=C1CC(CCC1=CC=C2)=O)NC4=C(SC)C=C3OCCOC3=C4,ECBDE60D559AEB76_ACF7771C79E688AE_6041_UN,8.809741,00000000000000000000000000000000000000000000000000000000010100001000000010000000010000001011010001100100010001000100001010000101110011010110000111110011111011111111110,ZYJFXELAZITQBL-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NCC34CCC(C)(CC3)CO4,9E2A71C6C75E1D6E_EF9E247300634EE2_6041_UN,7.0666428,00000000000000000000000000000000000000000010000000000000010000100010000010000000001100010011000110101000010101001001101010010000110011110110000011110011110111111111110,OLPPGIFORVGTPM-UHFFFAOYSA-N
FC2=C(C=C1C=COC1=C2)NCC3CCCCN(C)C3,92325FCB6D44BAC5_21433B4759EBA9CB_6041_UN,8.007711,00000000000000000001000000000000000000000010000000000000010000000000000000010000101101110011010010001100010110010001101011100100110001110110001010011011110110101111110,JNVUVFOEPNQLOF-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CC3(CN2)CC3)F,8FDCEBA601391D94_A74DB595AA1AE2D2_7022_DP,7.380131,00000000000000000000001000000000000000000010000000000010000000000010000000100001001101110011010010001000110100011001000001100000110101110110001010011111010110101111010,ZLCQEXLXUNVAOK-UHFFFAOYSA-N
C(C1CCCC12CCOCC2)=CC4=C(N3CCN(C)CC3)C=CC=C4Cl,F9CFE0DAC94B17D8_A71FF21B7310786E_7019_UN,6.799961,00000000000000000000000000000000000000000000000000000000010000100010000000010001000001110000010010111001010101011001101011100000110011110110001011011010010011101111110,NBSGUWKDMXFLFY-UHFFFAOYSA-N
CN(C)[C@@H]1COC[C@H]1OC2=C(C=CC(=C2)C3CNCCC3)F,310C1467625371C5_6D5411C1440D747E_6035_UN,8.077609,00000000000000000000000000000000000000000010000000000000010000100000000010100000001101110111010111101000100111010100101011100011110011100110001111011111110011111111110,VZVIOGFWPNEEDE-RJPUVWTNSA-N
FC2=C(C=C1C(=NC=CC1=C2)NCCC(C3CC(C)(C)OCC3)CC4=CC=CC=C4)F,25DAE3027F690804_3619CBC73D9E9B9C_6041_UN,8.101123,00000000000000000000000000000000000000100010000000000000010000000110000000100100001000010001000000101100110111011001101011000100110011110110001011010111110111101111110,AXIKUEPBBIKCAW-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CC2(C)CCCCC2)C=CC(=C3)Cl)C4,36A0CA133610E1BE_72227DD385A82DB7_6034_UN,7.340558,00000000000000000000000000000000000000000000000000000000000000000110000000010000001101010010000010001101110110011011101001100100110001100110001011011101010110101111010,KINDGQBSZZDBEQ-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CCC=CCCC2,F7CAB13B331FCBFD_7428C0ACD3BF4CA1_6041_UN,8.041019,00000000000000000000100000000010000000000000000000000000000000000100000000100001001000100011010000111100000000001000001001000000110001010100011010011111010110101111010,BFZHPDUQYIQUPU-UHFFFAOYSA-N
C2(=CC1=C(C(=CC=C1)F)O2)NCC3N(C)CC4(CC3)CCC4,FF63A33CD8E4E5D9_D30724810FD82E17_7022_UN,7.51513,00000000000100000000000000000000000000000010000000000000010000000010000000010001001101110011110010101100010110111001111011100100110001110110001001011011110110101111110,SEIYRBCUQPMYFZ-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)F)CC#N)NCC2CC3(CN2)CCOCC3,1E822EDF9B8996D4_3CCCE932C8949342_6041_DP,8.078255,00000000000000000000000000000000000000000110000000000010010000000010000000000001001100110011000010101000110101011000001011000000110111110110001011010011010111100111110,LXCPQKYIUKESIA-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC34COC(C)(CC3)C4,7AF4138EA66D3317_2D16E9CA4AD6D671_6041_UN,7.244545,00000000000000000000000000000000000000000010000000000000010000000110000000000000101100010011000011101100010111001001101011000100110011110110001011010111110111101111110,ZZUNBAURMCBHSZ-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC(CCC)N3CCNCC3)Cl,2EA29FD85626129D_D94EF7382C893FB0_6034_UN,8.208728,00000000000000000000000000000000000010000000000100000000000000000100000000010111011101111011000010101001101110010011001111100100110101110110001011011111010110101111010,YOFPNBDSSSSIMC-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC[C@@H]2C[C@@H](OC)CN2CC3=CC=CC=C3)C4OCCO4,B12498FBFA5757C7_C904023CBF13BCB7_6041_UN,8.111877,00000000000000000000000000000000000000000010000000000000010000100000000010010001001101110011010111001000000101010000101011110111110011110110001111111011110111111111110,LFLJVCJLAYVQRB-RBUKOAKNSA-N
FC1=CC4=C(C(=C1)NC[C@@H]2CCCN(C)[C@H]2C3=C[N](N=C3)C)OC=C4,7110E7C51D3B97B5_B359CF7E4A10BC40_6041_UN,8.10751,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110011011110101100010110010001101011101100110001110110001001011111110110101111110,ZHSNREZMLHDOAU-KBXCAEBGSA-N
N3CCC1=C(C=CC(=C1)NCCC2=CSC(=N2)C(C)(C)C)C3,1E4127535B536D2D_CD6FBF0D53936F5A_6041_DP,7.770771,00000000000000000000000000000000000010000000000100000000000000000110000000100000111100101001000010101100110000011000001011000100110101010110011011010101010110101111010,XPKPYPNRDLWKNT-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NC[C@@H]2CCN(C)[C@H]2C3=CN=CC=C3,8A3A17BCD74F9F83_0A6DEB35EB4424B2_7022_UN,9.005632,00000000000000000000000000000000000000000010010000000000000000100100000000010000101101110011010010111000000110010001101011100100110000100110001001011011010110101111010,KVBVIZBYGRWHME-LPHOPBHVSA-N
C[N]1C=CN=C1C(NC(=O)C2CC3CCC2O3)C4=CC(=C(C=C4)F)F,DE4E5EBF2777425E_5863DA0A310C84D0_6038_UN,7.9715843,00000000000000000000000000000000000000100010000000000000010000000100000000010101000101010111110011000000010100100000011011100100110010100100001011011011101011111111110,DWVVCDKJFVGKML-UHFFFAOYSA-N
N(C1=C2C(=CC=C1)CCOC2)[S](C4=C(F)C=C3[NH]C=CC3=C4)(=O)=O,10A02EC10342CD1F_4095912159E5E062_6029_UN,8.381067,00000000000000000000000000000000110000000010000000010001011111001101010001000000010100111011001011100110011101001000011011001100111111111110001011111011010011110111110,BKZVIHMUHUZHMU-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C3=C2CCCCCC3)CC4(C)CCCNC4,4DE4A36AD1307C9C_A9973C186AAC260E_6034_UN,7.540111,00000000000000000000000000000000000000000000001000000000000000000110000000010000101101110011000010101100110110011001101011100100110000100110001011011001010110101111010,FVEJBLNUQKAORK-UHFFFAOYSA-N
N(C1=C2C(=CC=C1)CCOC2)[S](C4=C(Cl)C=C3[NH]C=CC3=C4)(=O)=O,E21C17AD33DE7513_DD8BC560E64A0E60_6029_UN,8.38106,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100111011001011100111011101001000011011001100111111111110001011111011010011110111110,SCPFKPQHLGJIPY-UHFFFAOYSA-N
O=[N](=O)C2=C1[NH]N=CC1=C(C=C2)NC4=CC3=C(N(C)CCO3)C=C4,99E342F812AEEF68_AA4036A1E9FB7C3E_6041_UN,8.356599,00000000000000000000000010000000000000000000000001001100110000010100011100010001100101100000011111101110010001010101101111101100001111010110001011111001110011111111110,YYMQVYIMWYOHNP-UHFFFAOYSA-N
C2(=NC1=C(C=CC=C1)[N]2C3CC3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,5CAAF33BBAD18662_2F8C293546866D52_6041_UN,8.476804,00000000000000000000001001000000000000000010000000000000000000100100000000010101100101110011010010001100111110010001101011100100000001110100001011011011010010101111010,FTAHHACJRLXOPD-QUCCMNQESA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC3(CCCO3)C4CC4,C2E59840BD27D02C_8F3C949048102E91_6041_UN,8.408997,00000000000000000000001000000000000000000010000000000000010000100110000000000000101100010011000110101100010101001000001011000100110011110110001011010011110111101111110,JHLFBCVVDCBROT-UHFFFAOYSA-N
FC1=NC2=C(C=C1)N=CC=C2NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,C33F5B13428F43E6_C894C575C7535D20_6041_UN,8.525938,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,UYCRQJWLXAARRH-SZNDQCEHSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3CCCCN(C)C3,1F2F84351FF5EA52_C27288DFD79175A9_6041_UN,7.732691,00000000000000000001000000000000000000000010000000000000000000000100000000010001101001110011010000101100010110010001101011100100110001110110001011011111010110101111010,RTEOJOBSUKRTFT-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)NCC3OCC2(CCNCC2)C3)C#N,81B0CE730E1F5AEA_1ADDD4B2799BFDA8_6041_DP,7.6992383,00000000000000000000000000000000000000000110000000000000010000000010000000000000101100110011000110101000110101011000001011000000110111110110001011010011110111101111110,ABBNQSOJEQWCNM-UHFFFAOYSA-N
N1C4CCC1C(C=CC2=C[N](C)N=C2C3=C(C=CC=C3)Cl)C4,664B620B0C25EF2F_C70F87E3CE69D841_7019_DP,8.233038,00000000000000000000000000000000000000000000000000001000000000100100000000010000100100010010011010010001110100010000001011101100110000100100001011011011000010101111010,SVYYZSGMBJJOIO-UHFFFAOYSA-N
N4CCC(C)(COCC3CC1(CC2(C1)OCCO2)CO3)C4,05739CE81FE72916_D15FE628BE7BEB8E_6039_DP,7.4111366,00000000000100000000000000000000000000000000000000000000010000000010000010000000001100100011000011001000110011011001101011010010110010000110100000110001110101111100110,XHWYRBFIFNHZPN-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C(C)(COCC2)C)Cl)C3CC3,C43D82D511B3557C_C252276D4C4940E9_7022_UN,7.8528676,00000000000000000000001000000000000000000000000000000000010000100010000000100000001000110011000000101001000111001001101000000000110011110110010011010111010111101111110,SBBOWVDIGSMNMP-UHFFFAOYSA-N
N(C1=CC(=CC=C1)CF)C(C34CC(C2CNC2)(C3)C4)=O,95E0853D44BB7802_B9C319C67BB31A56_6038_DP,7.874601,00000000100100000000000000000000000000000010000000000000000000100010000000000000001000100011100000001000010000101000010001000000010101110110001000000001011110100111110,KSXWUHMLLHPWHO-UHFFFAOYSA-N
N2CC[C@@H]1CN(C[C@@H]1C2)C3=NC(=NC=N3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,81E6B3A4058CEE09_9B3D7BE164B46D9F_6041_DP,8.485162,00000000000000000000000001000000000000000010000000000000000000100100000000010101101101110011010010101100111110010001101011100100110101110110001001011011010010101111010,GOLJFYYKDIQBOH-JFRXWTBNSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC[C@@H]2CNC[C@H]2C)F)CC3,D7E4B3611A45E26A_4669FC0AF9B091B2_6041_DP,7.7710457,00000000000000000001000000000000000000000010000000000100000000000000000000010001101101110011010010001000000110010001101011100000110101110110001010011111010110101111010,SAUGWNNULJJMMS-WBVHZDCISA-N
N1CC2CCCC1C2C=CC4=CC=C(C3=CC=C(CC)C=C3)O4,2A8B83F33BD5271E_6153E8AE7EB07C20_7019_DP,8.39049,00000000000000000001000000000000000000000000000000000000010000100000000000000000001100000011000010011000110000010010001011000100110000000100000001010001110110101111110,FLNRXSBNEHKOHU-UHFFFAOYSA-N
FC2=C(C=C1C=C[NH]C1=C2)NCC3C(N(C)CC3)C4=CC=CC=C4,C4F5824ED6EAC113_4E9036989E26AAE3_6041_UN,8.466705,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010001100010110010001101011100100110101110110001011011011010110101111010,JBZOQOYXJPEWSU-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC34CCC(C)(CC3)CO4,CEF46591D54B617F_83E8BC8A14091B01_7022_UN,8.082464,00000000000000000000000000000000000000000010000000001000010000000110000000010000101100010011001110101000010101011001101011101100110011110110001011011011110111101111110,SRQNNYNXUMBKJS-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCCC3CC(C)CC(C3)(C)C,902D52300B4CD578_74685B690EE175EC_7022_UN,8.00321,00000000000000000000000000000000000000000010000000001000000000000110000000110000101100010001001010001000100110011001001011101100110001110110011011011111010110101111010,UNLJZKIQDZWMBX-UHFFFAOYSA-N
FC1=CC(=C(C=C1)N[C@H]3[C@H](C2=CC=N[N]2C)OCC3)C4CC4,DE6EF1516DA5A67F_B3F6C4D0823F56C4_6041_UN,8.660445,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011011111000000100101010000001011101100000011110100001010011011110011101111110,KSMXNNMAONWYDM-NVXWUHKLSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3OCC4(C3)CCC4,A146358C842C604F_FA80CBF63A94452C_6041_UN,7.1004047,00000000000100000000000000000000000000100010000000000000010000000110000000000100001100010011000110101100010111001000001011000100110011110110001011010111110111101111110,CLMHHNZUNUCESF-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2OCC3(C2)CCC3,1EBECD044881162B_491551DC60FD0BD7_6041_UN,7.4063582,00000000000100000000100000000010000000000000000000000000010000000110000000100001001100100011010110101000010001001000001011000000110011010110011010011111110111101111110,OHXLONLSCJVDSJ-UHFFFAOYSA-N
NCCC1(C2CCC(C1)C2)OC3=C(C=CC(=C3)C4CNCCC4)F,B0DF42B727CB3C03_9C48CBB5A35A055B_6035_UN,7.976206,00000000000000000000000000000000000000000010000000000000000000100010000000000000001010110011000011101000110100011100001001000011110110100110001111010011110101100111110,DAWYZKXECQJHSI-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2(CCC2)C3=C(C=CC=C3)F)C4CCCC4,CA717789B326BA42_47EC986E9A9728F2_6041_UN,8.052089,00000000000100000000000000000000000000100010000000001000000000100110000000010101100100010011011010000000100100011000001011101100010001110100001010011011000010101111010,LDHUJQXJLHYHFP-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)N[C@H]3[C@@H](OCC3)C4=CN=CC=C4,37A05CF0F1F1B75F_E87F55626CB3991D_7022_UN,7.3527107,00000000000000000000001000000000000000000110000000000000010000100110000000000000000100010011000111100000100101011000001011000100000011110100001011010011110011100111110,DICOFYDIMLMWOO-AEFFLSMTSA-N
NCCC(OC1=CC=C(C=C1)C2CNCCC2)C3=CC(=C(C=C3)Cl)Cl,29055D80C6BC3FF8_2A3B52DEBE8622CF_6035_UN,8.346184,00000000000000000000000000000000000000000000000000000000000000100000000000000000001010110011000001101001100100010100001001000111110110100110001111010011110101100111110,HPYMADKHGYWKQN-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC5COC4=C(C=C(C=C4F)F)C5,6FF5C27CDAEDE686_245E238786E4CD7E_6041_DP,8.710115,00000000000000000000001000000000000000100010000000000000010000000100000000000101101101110001010110101100110111010100000011100100110101110110001011001001110011101111110,LSWSWWTZLVOTQL-MBIJGJCISA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=C(C=CC=C3F)F,440A19DCC4FB3CF4_170D580EA2D3CE69_6038_UN,7.338711,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,BKDORCJOTRPQSS-UHFFFAOYSA-N
CC1=C(C4=C(N1CC23CC(C2)OC3)C=CC=C4)C5CCNCC5,8D5FFA69DED6FBF4_C6772D0BBCFAB323_6034_UN,8.26597,00000000000100000000000000000000000000000000000000000000010000100110000000010000001101100001000011101100110011011000101011100100110010000110001011011011110111101111110,QXZQFGZVGVNWGW-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC3CCCCCN(CC2=CC=CC=C2)C3)Cl)C4CC4,D54143815F619341_33AEBC04DC0BD4F4_7022_UN,7.987424,00000000000000000000001000000000000000000000000000000000000000100000000000010001000001110011000000001101100110010000001001100100110001110110001011011011010110101111010,SSNNWDBKYBRSHX-UHFFFAOYSA-N
N2CC[C@@H]1CN(C[C@@H]1C2)C3=NC=C(N=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,7ACE07267AE89220_39B80029E546491C_6041_DP,8.573779,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101100110110010001101011100100110101110110001001011011010010101111010,CWQIREPDCZKFJS-MNDCFMPDSA-N
FC2=C1N=CC=CC1=CC=C2NCC3N(C)CC4(CC3)CCC4,65D404FC82992704_FA63D05344870A48_6041_UN,7.6957393,00000000000100000000000000000000000000000010000000000000000000000110000000010001101001110011010000101100010110011001101011100100110001110110001011011011010110101111010,OSAJELTTWNSONZ-UHFFFAOYSA-N
N4CCC1(CCCC1C=CC2=C[N](N=C2C)C3=C(C=CC=C3)F)CC4,BC0E53547D68CF70_26F9FBDFAE83F31D_7019_DP,8.144774,00000000000000000000000000000000000000000010000000001000000000100110000000010000101100110001001010111000110100011000001011101100110001110110001011011011010010101111010,WGPZTEODZFKDCW-UHFFFAOYSA-N
N4CCC1(CCCC1C=CC2=C[N](N=C2C)C3=C(C=CC=C3)Cl)CC4,962E95CA93517693_6B4F2107AC5FA224_7019_DP,8.144775,00000000000000000000000000000000000000000000000000001000000000100110000000010000101100110001001010111001110100011000001011101100110001110110001011011011010010101111010,CLVQXBJNXGSYJB-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CCCC(C(C)C)C2)Cl)C3CC3,B85259E9D11D2B6E_FE3BFC4888A268EC_7022_UN,8.027458,00000000000000000000001000000000000000000000000000000000000000100000000000100000000000010011000000000001100110010000101000000000110001110000010011010111000010101111010,MPJYJOXRSUKADA-UHFFFAOYSA-N
N(CC2=CC1=C(C=CC(=C1)F)S2)C(C45CC3(CC(CC(C)(C3)C4)(C)C5)F)=O,527B8B27FD9B9861_7A58A495F62C18AC_6038_UN,7.9130564,00000000000000000000000000000000000010000010000000000000000000000010000000000000011100011010100010001100010110101001010000000100100000100100000001000101011110101111110,NUBIWVZQXLYJID-UHFFFAOYSA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CC4=CC(=C(C=C4)F)Cl,F5F055FF3E338F8D_2A9CAA26426E3D66_6038_UN,7.0432806,00000000000000000000000000000000000000000010000000000000000000000000000000000000000000010010100000000101110100110000010000000000100011100000000011000011001110100111110,NAODYKCEGGJGPG-UHFFFAOYSA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CC4=CC(=C(C=C4)F)F,E26C21C1207978B3_67C1A4DE29C7DE25_6038_UN,7.0432777,00000000000000000000000000000000000000000010000000000000000000000000000000000000000000010010100000000100110100110000010000000000100011100000000011000011001110100111110,OLUZJHIBQPIFQS-UHFFFAOYSA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CC4=CC(=C(C=C4)Cl)Cl,818F7B0228E13BD7_EF723C861B5009D1_6038_UN,7.043267,00000000000000000000000000000000000000000000000000000000000000000000000000000000000000010010100000000101110100110000010000000000100011100000000011000011001110100111110,YESPMDYGBDZNCX-UHFFFAOYSA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CC4=CC(=C(C=C4)Br)F,000187B0D38CDA35_2ADD60525C879C59_6038_UN,7.043266,00000000000000000000000000000000000000000010001000000000000000000000000000000000000000010010100000000100110100110000010000000000100011100000000011000011001110100111110,UTCWBFQSEVBWKD-UHFFFAOYSA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CC4=CC(=C(C=C4)F)Br,F2247E1CEFFB91D3_232F138A9DB95A4C_6038_UN,7.043268,00000000000000000000000000000000000000000010001000000000000000000000000000000000000000010010100000000100110100110000010000000000100011100000000011000011001110100111110,PYKZWKKKJLFZPK-UHFFFAOYSA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CC4=CC(=C(C=C4)Br)Br,9D0306B872718C65_B850DBE46BD55FA3_6038_UN,7.043274,00000000000000000000000000000000000000000000001000000000000000000000000000000000000000010010100000000100110100110000010000000000100011100000000011000011001110100111110,KERXBRBSDQFDEI-UHFFFAOYSA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CC4=CC(=C(C=C4)Br)Cl,1539AA1060B61771_FEF5B1F82167A99C_6038_UN,7.0432677,00000000000000000000000000000000000000000000001000000000000000000000000000000000000000010010100000000101110100110000010000000000100011100000000011000011001110100111110,CETAVTQJLHBABD-UHFFFAOYSA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CC4=CC(=C(C=C4)Cl)F,07440B3AC896039F_4F907858F7A65859_6038_UN,7.0432553,00000000000000000000000000000000000000000010000000000000000000000000000000000000000000010010100000000101110100110000010000000000100011100000000011000011001110100111110,MUYXPFWJYBLRLD-UHFFFAOYSA-N
N2CC[C@@H]1CN(C[C@@H]1C2)C3=NC(=CN=C3)NCC5=C(N4CCCN(C)CC4)C=CC(=C5)F,B07E922381933326_167CFFB628BA6F54_6041_DP,8.501379,00000000000000000001000000000000000000100010000000000000000000100100000000010101101101110011010010101100110110010001101011100100110101110110001011011011010110101111010,JCERMAVBSPXZSL-QUCCMNQESA-N
CC1=C(C=C(C(=C1)NCC(CN2CCCC2)C3CC3)F)[N]4C=CC=C4,F04540409909F1AD_9E5F7BF330366B0E_6041_UN,8.243468,00000000000000000000001000000000000000000010000000000000000000100100000000010000101101110011000010001000000100010000001011100100110001110110001010011011010110101111010,JYEQLLKWMCBLSI-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC[C@@]23CCN[C@@H]2CCC3,5650BA9EB0E22EE2_BE24E54F69C8206C_6041_DP,7.843755,00000000000000000000100000000010000000000000000000000100000000000010000000100000101100100011010010001100110000011000001001000000110101010110011000011101010110101111010,IOTVRAVTWXHWCA-IAGOWNOFSA-N
C(=CC1=CC(=CC(=C1)F)F)NC3CCC2(COC(C)(C2)C)CC3,25AAE7B01ADB3ACE_DED9D1BE165630C2_7022_UN,8.326751,00000000000000000000000000000000000000000010010000000000010000000010000000100000000100010010000010010000110111011001101000000000110011100100000001010101110011101111110,DJTQQXIOXRPPHY-UHFFFAOYSA-N
NCCC(OC1=C(C=CC=C1)CC2CCNCC2)C3=CC=C(C=C3)Br,107933F5DC411DBE_358D20F3C1318517_6035_UN,8.242735,00000000000000000000000000000000000000000000001000000000000000000000000000000000001010110001000001101000100100010100001001000111110110100110001111010011110101100111110,KRBWFJQNYQGGGL-UHFFFAOYSA-N
CC(C)CC1=C(N=C(N=C1C)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C,47F409CD200CC513_64647752C7E9EC8B_6041_DP,8.126724,00000000000000000000000001000000000000000010000000000100000000100100000000100100101000110011000000101000101100010001101011000100110101110110011011010111010110101111010,GIBWCHRUICYBGH-AZUAARDMSA-N
O(C3CCN(CC1=CC=CC=C1)C2(CCC2)C3)C[C@@H]4CNCC(O4)(C)C,E3465696BE7FA939_894348C713D2683F_6039_DP,8.080575,00000000000100000000000000000000000000000000000000000000010000000010000010110000001001100010000101101000010011011001001011100011110010000110001101011101110111111111110,MVFBIGGDSFAKTC-ANYOKISRSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3C5CC4CC(CC3C4)C5,7E24FB96034EEE52_A56679217D0EFDB5_6041_UN,8.427241,00000000000000000000000000000000000000000010000000001000000000000100000000010000101100010001011010001100010100000000000011101100110001110100001001001001010110101111010,FARPKXVEPMXTHV-UHFFFAOYSA-N
CC1=C(C(=NO1)C2=CC=C(C=C2)F)NC[C@@H]3CN[C@@H]4CCCC[C@H]34,FAA60D903BF649F7_DC88C546383D1F75_6041_DP,8.437821,00000000000000000000000000000000000000000010000000000100010000100100000100000001101100010011001111001110110110010000001011001100110101110110001011010011110110101111110,YZSGHLPKIIUCPW-USXIJHARSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC23COC(C)(C2)CCC3)F)CC4,735D95F66FEEF601_4301A340953FAC6C_6041_UN,7.12698,00000000000000000001000000000000000000000010000000000000010000000010000000010001100101110011010111001000110111011001101011100000110011110110001011011111110111101111110,GRLMFCUYNYNLJN-UHFFFAOYSA-N
C(C12CN(CC1)CCC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,D82F5FCCD4B34CDB_E0D2B93659680042_7019_UN,8.303848,00000000000000000001000000000000000000000010000000000000000000000010000000000000000101110000010010111000010110011000101001100000110001110110001011011010010010101111010,YIXCFGOIAQOWRI-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC2=NC=C(C=C2)C3CCC3,C419D73E66B8A073_8C283761451AAD23_7022_UN,7.810258,00000000000100000000100000000010000000100000000000000000000000100100000000100100000000100000010000100000000000001000001001000100000001010100011001011101000010101111010,LPBQFWDJGIKQKF-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NCC4=C(CN3CCN(C)CC3)C=CC=C4,E4D32C2B9F067AA2_41A03C38894AD36A_6041_UN,7.740824,00000000000000000000000000000000000000000010000000000000000000000000000000010001001001110011010010101100010100010001101011100100110001110110001011011011010110101111010,HLQJVKCPOGRGIK-UHFFFAOYSA-N
FC1=CC2=C(C=C1)SC=C2NCC3N(C)CC4(CC3)CC4,F0DC8B76CB593431_632DCED8C4DD2B66_6041_UN,7.9799175,00000000000000000000001000000000000010000010000000000000000000000010000000010001011101111011010010101100010110011001101011100100110001110110001001011011010110101111010,OYVHESBGYAJERL-UHFFFAOYSA-N
O(C3CCN(CC1=CC=CC=C1)C2(CC2)C3)CC4COCC(C)(C)O4,ACA9DB58482DAAF1_6DE13E5C40984A98_6039_UN,8.306078,00000000000000000000001000000000000000000000000000000000010000000010000010110000000001100100000001101000010011011001001011100011110010000110000101111100110111111111110,CNSRSCNBBZMGFI-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCCC2CCCN(C)C2)F)CC3,AC658944CA0BE951_B4F3183068ECF8E0_6041_UN,7.697607,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110001010000101000100110010001101011100000110001110110001011011111010110101111010,ZGDIHXQOXTUCEM-UHFFFAOYSA-N
CC3=C2N=C1CCCCC1=C(C2=CC=C3)NC4=CC=C(CC[Si](C)(C)C)C=C4,A489F41E4771E183_123BA025B17F3CD4_6041_UN,7.8584957,00000000000000000000100000000010000000000000000000000000000000000100000000100000100000100011010000100100010000011001101001000100110001010100011011011101010110101111010,UJHGFNZJDRYDJU-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CCCC2CCCCC2)C=CC(=C3)Br)C4,14E3A481C1F7EB6D_46F71C47A803FE78_6034_UN,7.4086504,00000000000000000000000000000000000000000000001000000000000000000110000000110000000101010000000010001100010100011001101001100100110000100100000011011100010110101111010,IILXQLWTADSONI-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)N(C=N2)CC4(CC3=CC=C(C=C3)F)CCNC4)C,9DED4BEA5F160EC2_F52FCBCAAE76E86A_6034_UN,8.020482,00000000000000000000000000000000000000000010000000000000000000000110000000010101101101110011000010001100110100011000001011100100110000100110001011011111010110101111010,MHPXIXXTVFAZBU-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)NCC4=C(CN(C)C3CCCCC3)C=CC=C4,755891F13330382A_B7F2521B1E438EC2_6041_UN,7.7341375,00000000000000000000000000000000000000000010000000000000000000000000000000000000001001110001010010001100010110010001101000100100110001110010001011011011010110101111010,YDPSJHYHIPCXLD-UHFFFAOYSA-N
C2(=C1C=C[N](C1=CC=C2)CCN3CCCC3)NC4=C[N](C[Si](C)(C)C)N=C4,1FE62A7656AE8CD2_B127ACF354560225_6041_UN,7.6487656,00000000000000000000100000001010000000000000000000001000000000000100000000110001100101100001011010001100010000011001001011101100110001010110011000011101010110101111010,RLIISXXPZIZTAJ-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=C1)NCC2CC3(NCC2)CC3,E46866D470060640_3586C98295B28524_6041_DP,7.522869,00000000000000000000101000000010000000000000000000000000000000000010000000100000001000100011010000101000110000011000001001000000110101010110011011011111010110101111010,ZAHVUQMVOIZACM-UHFFFAOYSA-N
CN(C)[C@@H]1CCCC[C@H]1OCCN2CC3CCC(C2)O3,B5166364FFF7C5B6_F968D6C3D65AFA9C_6039_UN,7.0670347,00000000000000000001000000000000000000000000000000000000010000000000000000110000000101100000010110101000010011010000101011100011110011000110001101011110110111111101110,ZEDUBYNLOXRONF-QDIHITRGSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC(C3CCNCC3)C4=CC=CC=C4,41FA55D6B3F425F6_035B7CDD78B73D5F_6041_DP,7.8380017,00000000000000000000000000000000000000000010000000001000000000000100000000010000101100110001011010101100110100010000001011101100110101110110001001011001010110101111010,KRQQJYNYXANXFZ-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CC2CCC=CO2)C=CC(=C3)Br)C4,7CE2A1004D46F4A9_91B37B5D3A53E3BA_6034_UN,7.9868116,00000000000000000000000000000000000000000000001000000000010000000110000000110000000101010000000110111100010100011001101011100100110010100100000011011100110111101111110,AEAPYPDJLGNBHU-UHFFFAOYSA-N
C1(=C(C=CC=C1)C(C#N)N2CCOCC2)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F,3C98D73EBB2124A0_9F895311F4BB8158_6041_DP,7.9667454,00000000000000000000000000000000000000000110000000000010010000100000000000010001101001110011000100101000100101010000001011100100110111110110001011011011010011100111110,JPXRWJHZXGGJTH-SHVQYXQLSA-N
N(CC23CC(CC1=CC=CC=C1)(C2)CO3)[S](C5=CC4=NC(=C(CCl)C=C4C=C5)Cl)(=O)=O,E0EFA71E9058A8CE_9C04745CEA4A4B03_6029_UN,7.7764716,00000000000100000000000000000000110000000000000000010001011111001111010001000000011100011011001110101111011101001000010011001100111010101110001011101011110111110111110,SIJINUBMTWRJEV-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NCC3CC4CCC3N(C)C4,2B20BDD9A1F6D002_30B6826C89B70B28_6041_UN,7.5008245,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001110011010010101100010110010001101001100000110001110110001011011001010110101111010,LISPEBUFEPEDLT-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CC3CCC2N(C)C3)F)F,23C6616DBD5B7B73_EEC06D72A989EA65_7022_UN,8.213654,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001110011010000101000010110010001101001100000110001110110001011011111010110101111010,AJPNPVRPBAECGT-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NC[C@H]4[C@H](C3=NC=C[N]3C)OCCC4,F52D5616ADDDDEF5_00D7572CAD3D35C8_7022_UN,7.5426345,00000000000000000000001000000000000000100000000000000000010000100100000000010101001101010011010111101001000101000000001011100100110011110110001011011011110111101111110,FATLFRSEABPKLZ-MAUKXSAKSA-N
C1(=C(C=C(C=C1)C2CC2)F)NC[C@H]4[C@H](C3=NC=C[N]3C)OCCC4,C0928560B4BAE507_F417A521E57E9477_7022_UN,7.542632,00000000000000000000001000000000000000100010000000000000010000100100000000010101001101010011010111101000000101000000001011100100110011110110001011011011110111101111110,QHGRKJPGISCELM-MAUKXSAKSA-N
CC(C)CC1COCCC1OC3=CC2=C(CCN(C)C2)C=C3F,69CE73F54FA25D60_3D39B75034DC9CE8_6035_UN,7.2851434,00000000000000000000000000000000000000000010000000000000010000000000000000110000000001110100010000101100010111010101101011100011110010100110010111011110110101111111110,NUOHHRCJVOAJJS-UHFFFAOYSA-N
CC1=NC(=C(C=N1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C4CC4,9B4CDEB54BF52670_4C26B76CBBCC52C8_6041_DP,8.05355,00000000000000000000001000000000000000100010000000000100000000100100000000000101101000110011000000101000100100010000001011000100110101110110001011010011010110101111010,MWHQWFACCHNKIH-FUHWJXTLSA-N
FC1=CC4=C(C(=C1)NC[C@@H]2CCCN(C)[C@H]2C3=CC=N[N]3C)[NH]C=C4,853B9D1F1C5B9F50_6FC915F041A3E84B_6041_UN,8.060725,00000000000000000000000000000000000000000010000000001010000000100100000000010001101101110011011010101100010110010001101011101100110101110110001011011111010110101111010,JWUDNCIZBDAFFH-IFXJQAMLSA-N
N(CC1C2CCC(C1)C=C2)C(C3=C(C)[N](N=C3)C4=CC=C(C=C4)F)=O,68F63D35E8333956_1BEBCED221888591_6038_UN,8.336849,00000000000000000000000000000000000000000010000000001000000000100100000000010000101100010011101011011000010100100000011011101100110001110100001011011011011110101111110,YSKQJQJTMCWTLB-UHFFFAOYSA-N
CC1=CC(=C(C=C1)C)[C@@H]2CCCC[C@H]2OCC3=CC(=NO3)C4CNC4,0CF55423CD40D1B8_80481E57D17332DB_6039_DP,8.612245,00000000100100000000000000000000000000000000000000000000010000100100000110000000101100100010001011001010000011000000001011001111110010000110001111010111110111111111110,XFQJBKKECJFMNS-GHTZIAJQSA-N
N(C1=CC=C(C=C1)N2CC3CCC(C2)O3)C(C4=CSC(=N4)CC)=O,5785A82E579D5595_75EC5F835CD59AC3_6038_UN,8.576517,00000000000000000001000000000000000010000000000100000000010000100100000000010001010101101000100110101000010000110010011011100100110011010110001001011001111111111111110,ORXWCKNUZWKDTR-UHFFFAOYSA-N
FC2=C(C(=C1N(C=C(C(C1=C2)=O)C#N)C[C@@H]3CNCC[C@@H]3C4=CC=CC=C4)F)F,67647AD67D118ACF_8C561C1C6A0069DD_6034_UN,7.882435,00000000000000000000000000000000000000000110000000000000000000100100000000010000101001110011000001101100110100010100001011100101110000100110001111011011111110100111110,VCEMMDQGSNHBMK-JKSUJKDBSA-N
FC1=CC2=C(C=C1)C(=CN2CC3[C@@H]([C@H]3C)C)C4CCNCC4,38634B64AC0CFAB1_5F1C8B5908B2C003_6034_UN,9.090507,00000000000000000000001000000000000000000010000000000000000000100100000000010000001101110001000010101100110110010000101011100100110000100110001001011111010110101111010,GGVNNJQOGPHPLU-CHWSQXEVSA-N
CC2=C1N=C(SC1=CC=C2F)NCC3CCCN(C)C3C4=CC=CS4,6EC2457F9890FE56_7943DBA03A3B9D81_6041_UN,8.322401,00000000000000000000000000000000000010000010000100000000000000100100000000010100111101111011010010101100011110010001101011100100110001110110001011011111010110101111010,NXGIZKVBLDUNDA-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCCC4CCCN34,9F162C8F75AAECCF_15F740DC5D86225D_6041_UN,8.096301,00000000000000000000000000000000000000000010000000001000000000000100000000010001101101010011011010101100010100010000001011101100110001110110001001011001010110101111010,FBMDKYCTTPUUGS-UHFFFAOYSA-N
C(CCN1CCOCCC1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,92C42C67B7F73421_31F8CB240354EF11_7019_UN,8.0288105,00000000000000000001000000000000000000000010000000000000010000000000000000010000000001110000010111011000000111010000101011100000110011110110001010011010010111101111110,CDOJSNSKNKSUCE-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC3CCC2(COC2)CC3)F,301627659CD8DB5D_47742279C4A2FD6A_7022_UN,7.747314,00000000100100000000000000000000000000000010000000000000010000000010000000100000000001110011010000001000110101011001001000100000110001110110001011011111010111101111110,QSKVVLQZKZKWLV-UHFFFAOYSA-N
C2(=C1[NH]C3=C(C1=CC=C2)CCC3)NC4=CC=C(CO[Si](C)(C)C)C=C4,236CFE86D73672C5_E150B06BD488F15C_6041_UN,7.7919703,00000000000000000000100000000010000000000000000000000010000000000100000000100001000100100011010010000110110001011000101001001110010101010100011011011101010111101111110,ACYCNNWFKVJURZ-UHFFFAOYSA-N
N1CC(C1)(C#N)C2=NC=C(C=C2)N[C@H]3[C@@H](C3)C4=CC(=C(C(=C4)F)F)F,5D5B4872F26EBBC9_E89B17FCA43BDA4D_6041_DP,7.9190536,00000000100100000000001000000000000000000110000000000000000000100110000000000001101000110010000000101000100100011000000011000100000101110110001011000011010010100111010,SOALXCGETGSACM-SWLSCSKDSA-N
N(CC1=CC2=C(C=C1)COC2)[S](C3=CC4=C(C=C3)C=CN=C4)(=O)=O,25E5DD6E363EE505_F7A4A9057C09C66C_6029_UN,8.5935,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100101000001010101110011001001000010011001100111000001110001011101001010111110111110,AXHSGXVZVADINS-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC[C@@H]3CCNC[C@@H]3C=C)Cl,76C8B358081C76BB_8E2D44D81640CAA3_6034_DP,7.91455,00000000000000000000000000000000001010000000000100000000000000000100000000010110011101111011000010111001101110010000001111100100110101110110001011011011010110101111010,TYWVQTVNRDNIHB-HOTGVXAUSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC5CC(C4=CC=N[N]4C)OCC5,2108DFE9D0AECD7C_616E85ECEA2AB1B8_6041_UN,7.746381,00000000000000000000000000000000000000100010000000001000010000100100000000010101100101110010011111100100110111010000001011101100110011110110001011011011110011111111110,HZQYQUXZUXEQRE-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)C3CC(F)(C3)C4=CC=C(C=C4)F,88B53B165DB7021C_00CA9745E1BF944F_6038_UN,7.370406,00000000000100000000000000000000000000000010000000000000000000100010000000000000001000010011100010001000010100101000011000000000110000100000000001010001011110100111110,SYNFFGRJJHXVAJ-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(=O)C3CCCN3CC4=CC=C(C=C4)F,E5BCC75680F6F3AB_8066BB6DB319ED1C_6038_UN,7.7584543,00000000000000000001000000000000000000000010000000000000010000000000000000010001001101110011100110101000010100110000011011100000110010100110001001011011111111110111110,AAJHTNABEFPIOZ-UHFFFAOYSA-N
CC1=CC=C(O1)C2=NC(=CS2)C=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,A664E62797FE0E92_1CB0DDF8B89F94CC_7019_UN,8.28763,00000000000000000000000000000000000010000010000100000000010000100100000000000000010101011000010110010000000110010000101011100100010001110100001010011110100010101111110,VSVVWXOCUXCLBJ-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(=O)CC4=C(C=C(C=C4)F)F,6C7D315A680998B8_8D6DAA433DE315B1_6038_UN,7.6656632,00000000000000000001001000000000000000000010000000000000000000000000000000000000001000010011100010001000110100110000010000000000110010100000000011000011011110100111110,DTDGSQHDOLGKLQ-UHFFFAOYSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC2=C([N](N=C2C)C3=C(C=CC(=C3)C)C)Cl)C4,65F0BC8A34D0B907_8CCAE12C5E6C314D_7019_DP,8.491993,00000000000000000000000000000000000000000000000000001000000000100100000000010000100100010010001010010001110100010000001011101100110001110100011011011111000010101111010,ATCJTFGQNSOIEC-NUJGCVRESA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CCCCC3)C4=CC(=CC=C4)F,028A4C9ED3722AD5_CDA551B95FD8F32F_6041_UN,7.6461306,00000000000000000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,MYRBUFOMAGBKJT-NRFANRHFSA-N
C1(=C(C=CC=C1)C2(CC2)C#N)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F,A93D6A08F2CC27D2_14CD12878B08B2DA_6041_DP,7.692582,00000000000000000000001000000000000000000110000000000010000000100010000000000001001000110011000000101000100100011000001001000100110101110110001011010011010010100111010,IECCTPAJVOBXQB-FOIQADDNSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC3(CC3)C4=CC5=C(C=C4)OCCO5,4335C56F40BFE298_5A26575A62B5036E_6041_UN,8.601865,00000000000000000000001000000000000000100010000000001000010000100110000010010101100100010010011010100100110101011100001011101100000011110110001011011011110011111111110,NIMLIPIFFWOZMV-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C(F)F)Cl)NC[C@@H]2CCCN(C)[C@H]2C3=C[N](N=C3)C,B70B59452475F052_0EC84EBC640F6934_7022_UN,8.09335,00000000000000000000000000000000000000000010000000001000000000100100000000010000101101110011011010101001000110010001101011101100110001110110001011011111010110101111010,SUMLTTNSTUHHQE-SUMWQHHRSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=CC3=C(N=C2)C(=CC=C3)F)C4,A5126C3D8A96B6E5_66C40C6879679F78_6035_UN,8.032083,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010111101100010100000101001001100111110000100100001101011110110111101111110,QLXWDDYXTWOSCN-PQIIZBDJSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC3CCC34CNC4,90E95D510863A948_01DA3C66F020D58B_6041_DP,8.244247,00000000100100000000000000000000000000000010000000000100000000000110000000100000101000110011000000101100110100011000001011000100110101110110011011010111010010101111010,NUCJPFSDAOHOFP-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=CC3=C(N=C2)C(=CC=C3)Cl)C4,1CBDAEB511F86C3A_920C6ABF06E1C6BF_6035_UN,8.03207,00000000000000000000000000000000000000000000000000000000000000000100000000100000000001110000010111101101010100000101001001100111110000100100001101011110110111101111110,DFJZYZUSLNALAS-PQIIZBDJSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=CC3=C(N=C2)C(=CC=C3)Br)C4,CEEA5577D18E7376_651096CF4F2E3390_6035_UN,8.032071,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000010111101100010100000101001001100111110000100100001101011110110111101111110,KWIIFRPEXDNOMR-PQIIZBDJSA-N
C[N]1C(=CN=C1C2CCCCN2)N[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,02EB407125E9CDB8_38C44772F9B5AE98_6041_DP,8.38253,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101000100110010000001011100100110101110100001011011011010010101111010,RVGBNNSRLIKVTA-KTZGRWMLSA-N
NC1=CN(C2=C1C=C(C=C2)Br)CC3C(CNCC3)C4=CC=CC=C4,09E17DE2E3467D5E_75DE35B93E07388F_6034_UN,8.991127,00000000000000000000000000000000000000000000001000000000000000100100000000010001101111110001000010101100110100010000001011100100110101110110001001011011010110100111010,CBEWRIVDCFBENF-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CCCC(CC)CC)C3=CCNCC3,370A04A083A9BFEF_5FDC235669D42EEA_6034_UN,8.650073,00000000000000000000000000000000000000000010000000100000000000100100000000011000001101110001000010111100110110010010101011100100110000100110001001011101010110101111010,CGBVCUJKUNGCJM-UHFFFAOYSA-N
O[C@H](CBr)C1=C(C=CC=C1)NCC(C)(C)N2CCSCC2,20E0887CCF3FF28A_AF670CE7B8CE5A9F_6041_UN,8.616645,00000000000000000000000000000000000010000000001000000100000000000010000000110001001001101001000001101000100010011001101011100000110111110111001011011111110111101111110,OTDLYBADANHSBN-OAHLLOKOSA-N
C1(=NN=C(C=C1)C2=CC3=C(C=C2)OCCCO3)NC4=C[N](C[Si](C)(C)C)N=C4,FF4F0D349E04BC67_4FFCB2A48DF9EC25_6041_UN,7.7010717,00000000000000000001100000001010000000100000000000001000010000100100000010110101100100100101011010101100010001011101001011101100001011010110011011011101110111111111110,JHZSJTRPWDQKGF-UHFFFAOYSA-N
NCC3(COC1=C(C(=CC=C1)C2CNCCC2)F)COC3,6FB4F0A952EAC541_12478374EA732394_6035_UN,8.303483,00000000100100000000000000000000000000000010000000000000010000100010000000000000001010110111000001101000100101011100001011000011110100100110001111010011110101110111110,BTVJIBBOGPXCEA-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC4CC3CCOCC3CC4,96F66CD633E12D7B_3B68DC4E066EA049_6041_UN,8.153223,00000000000000000000000000000000000000000010000000001000010000000100000000010000101100110011011010101100010101000000001011101100110011110110001001011001010111101111110,QICQSPWBFSIXGW-UHFFFAOYSA-N
O[C@H](CBr)C1=C(C=CC=C1)NCC2(CCN(C)CC2)N3CCOCC3,0D9C9368C5593BEA_AEAFAE41D78637EE_6041_UN,8.367984,00000000000000000000000000000000000000000000001000000100010000100010000000010001101001100011010101101000100001011001101011100000110111110111001011011011110111111111110,UDBQOSLTFAYEBG-GOSISDBHSA-N
CN(C)CC1=C(C=CC(=C1)NCC2C3(CCC2)CCC3)F,8826836A5785BD12_A7DA80A894D97685_6041_UN,7.32203,00000000000100000000000000000000000000000010000000000000000000000010000000100000001001110011010010001000010100001001001000100000110001110010001010011111010110101111010,WUUWMPNCOIXLAI-UHFFFAOYSA-N
C2(=C1C=CC=CC1=C(C=C2)Cl)NC3CCN(C)C34CCCNC4,DD9AE53BFC384FC1_3B14D8E39F0DF8DE_7022_DP,8.241248,00000000000000000000000000000000000000000000000000000100000000000010000000010001101101110011010010101101110110011001101011100100110101110110001001011001010010101111010,LSKVIAYMXDUDGI-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC[C@H]3[C@H]2CCCCN2CCC3,9207C1F19C6ED2D3_DCB6C1636BC454BC_6041_UN,7.904153,00000000000000000000100000000010000000000000000000000000000000000000000000100000101001100011010000101100010000011000001001100000110001010110011001011101010110101111010,WEUQRQFNEMGROL-QFBILLFUSA-N
FC1=CC=C(C=C1)C3=CC2=C(C=CC=C2)N3C[C@@]45[C@@H](CNC4)CCO5,64846CF359043C1C_295817A666ECFDA1_6034_UN,9.042709,00000000000000000000000000000000000000000010000000000000010000100110000000010000101101110011000111001100010101001000001011100100110010100110001011011011110111100111110,BLGVADNVHHOCQU-DYESRHJHSA-N
NCC1(C(CCC1)OC3=C2CNCCC2=C(C=C3)F)CC4=CC=C(C=C4)F,6C1AF4CB81667483_F417DCBDCD9C9081_6035_UN,7.5525703,00000000000000000000000000000000000000000010000000000000000000000010000000000000001010110011000011101100110100011100001001000111110110100110001111010011110101100111110,GOIKHLOFSBASQK-UHFFFAOYSA-N
FC1=CC=C(C=C1)C3=CC2=C(C=CC=C2)[N]3C[C@@H]4C[C@H]4C5CCNC5,D6001B2B3CE8A308_D264A070C88FC9F1_6034_DP,8.843248,00000000000000000000001000000000000000000010000000000000000000100100000000010000001101110011000010001100110100010000001011100100110000100110001011011011010110100111010,IXGGBIQKLXKUEP-WSTRIDTPSA-N
FC2=C1CCCC1=C(C=C2)NCC3CC4CCC3N(C)C4,678DBB07CCDFE8B1_87E5AC75D70980DF_6041_UN,7.7008777,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001110011010010101100010110010001101001100000110001110110001011011001010110101111010,NXOUYPDDWQYAQA-UHFFFAOYSA-N
O(C(=O)CNC1=C(C=CC=C1)Cl)CC2C3CCC(N2)C3,67237010D835AEC8_F92BC786EFC956B7_6031_UN,7.489172,00000000000000000000000000000000000000000000000000000000000000000000000000000000001100010011000110101001110101010000001001010010110111110110001011010011011111110111110,OOUZLSFTQGENPO-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC3C4CC5CC3CC(C4)(F)C5,167F427427062D71_B0C56B70DEC3C1A5_6041_DP,6.85868,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101010011010010101100110110011000001011100000110101110100001011011011010010101111010,RGTNEJLVZZTKJU-UHFFFAOYSA-N
FC2=C(C=C1C=NC=CC1=C2)NC3CN(C)C4(C3)CCOCC4,1BF3154955082300_1CB3743D5691BF86_6041_UN,8.12769,00000000000000000000000000000000000000000010000000000000010000000110000000010001100101110001010011101100110111011001101011100100110011110110001011011011010011101111110,WGBKFNQDARAYFX-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(C4=CC=C([N]4C)C5=CC=C(C=C5)F)=O,F6D3306BA9EED173_CA63F40763D97877_6038_UN,7.6835775,00000000000100000000000000000000000000000010000000000000000000100110000000010001001101010010110110001000010100101000011001100100110000100100001011011011011110101111110,BKZKNRODNKEPQN-UHFFFAOYSA-N
CC1=C(C3=C([N]1CCC2(N)CCC(F)(F)CC2)C=CC=C3)C4CCNCC4,79E9E694F9077A61_EB079F8FEFD918A0_6034_DP,7.987131,00000000000000000000000000000000000000000010000000000000000000100110000000010000101111110011000010101100110110011000101011100100110101100110001011011011010110101111010,DHCUCAFRPNHOMQ-UHFFFAOYSA-N
NCCCC(OC1=CC=CC2=C1NCCC2)C3=CC=C(C=C3)F,79D8CE8054356C0C_3058C291724726FD_6035_DP,7.5950966,00000000000000000000000000000000000000000010000000000000000000000000000000000000001010010011000100101100110100010100001001000111100110110110001111010001110111100111110,JAEUVVXLLMWZDE-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(=O)C3=CC=C(S3)C4=CC(=C(C=C4)Cl)Cl,811AFDD5D9B74017_03A20B32810EBC22_6038_UN,7.5240755,00000000000000000001000000000000000010000000000000000000010000100000000000000000011100011010100010101001010100100000011010000100110010100100000011010011111111110111110,SFRXMPPFMNPSPB-UHFFFAOYSA-N
N(CC23CC(CC1=CC=CC=C1)(C2)CO3)[S](C5=CC4=C(N=C(C)C=C4Cl)C(=C5)F)(=O)=O,3B5A3C5939950A4D_09C3EBE14CDD9888_6029_UN,7.7364554,00000000000100000000000000000000110000000010000000010001011111001111010001000000011100011011001110101111011101001000010011001100111010101110001001101001110111111111110,YEYFBEDDRACLHE-UHFFFAOYSA-N
C(C1CCC2(CC1)OCCO2)=CC3=C(SC(C)C)C=CC=C3Cl,55F4985E58614184_867F95B1CDB74FD4_7019_UN,8.247095,00000000000000000000000000000000000000000000000000000000010100001000000010100000010100011000000010010001010101001000001010010000110010100110000011010110110001011011110,BOMAYTVRMZROFU-UHFFFAOYSA-N
C(C1C2CCOCC12)=CC3=C(C=CC(=C3)C)OC(F)F,520B6ED6DE0070FA_225A36A39DDCFF49_7019_UN,8.5802145,00000000000000000001001000000000000000000010000000000000010000000000000000000000000000100000000000110000011101000100001000000011110010100110000111010010110001011011110,FPEKDXBEZURHGA-UHFFFAOYSA-N
N5CC1=C(C=C(C=C1)NC2=C(C=C(C=C2)C3CCOCC3)F)C4(CC4)C5,1FD6AB9F217C948B_65BC8E26B7BC8B9B_6041_DP,8.169124,00000000000000000000001000000000000000000010000000000000010000100010000000000000001000110011000000101100010101001000001011000100110111110110001011010011010011100111110,JNHPNFAVWGZFRT-UHFFFAOYSA-N
FC2=C(C=C1C=C[NH]C1=C2)NC4=CC3=C(N(C)CCC3)C=C4,CED128A5D522C067_6982FF9482DDB603_6041_UN,8.487953,00000000000000000000000000000000000000000010000000000000000000000100000000010000000101110001010010101100010110010001101011100100100101110100001011011011010010101111010,QSSHEUWRGKDOPO-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3=C[N](N=C3[C@H]4CC[C@@H](C)O4)C)C5CCNCC5,20A9C752BCF179DB_7F9948D316C0BDE6_6034_UN,8.602183,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011111101100110110010001101011101100110010100110001011011111110111101111110,QBCRFJFZGDNRBC-IVZQSRNASA-N
ClC2=C1C(=C[N](C1=NC=C2)CCC3CNC(C3)(C)C)CC4=CC=CC=C4,635C649C9C1B9424_12A927A57A4F23E0_6034_DP,8.278378,00000000000000000000000000000000000000100000000000000000000000000110000000110100001101010011000010101101110110011001101011100100110000100110001001011101010110101111010,SJWRULCCXSEIRD-UHFFFAOYSA-N
CC(OCCN1CCOCCC1)CC2CCCCN2C,0EAF2C9A8D990913_41D066F331B975C5_6039_UN,7.3768244,00000000000000000001000000000000000000000000000000000000010000000000000000010000000001100000010101101000000011010001101011100010110010000110001000011110110111111101110,JNFVEOFXOVRFKH-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2=CC(=NO2)C3CCCCCC3)F,64CFE27A1A042C93_5560D6627101B9B7_7022_UN,7.9630985,00000000000000000001000000000000000000000010000000000000010000100100000100100001100101110001111011001010000100100001011011101100110001110100001010011111010110101111110,JGHOIQHLIJJINP-UHFFFAOYSA-N
C1(=CC(=CC(=C1)F)COC2CCCCC2)NCC3OC(C)(COC3)C,96DC34DAA0740FCB_803F1A500D9B7F92_7022_UN,8.198962,00000000000000000000000000000000000000000010000000000000010000000010000010100000001000110011000101101000000111001001001010000011110011110110000101110101110111111111110,GSJIGBFDCNILNU-UHFFFAOYSA-N
C2(=C1[NH]C3=C(C1=CC=C2)CSCC3)N[C@@H]4CCN(CC)[C@H]4C5=CC(=C(C(=C5)F)F)F,B83F815975BD72DA_554A49E98EF16F40_6041_UN,8.826921,00000000000000000000000000000000000010000010000000000010000000100100000000010001100101111011000010101100110110010010101011100100110101110110001011011011010110101111010,BCRSAQVDXRQWOJ-OFNKIYASSA-N
N([C@@H]1CCO[C@H]1C2=CC(=C(C=C2)F)F)C(C45CC3(CC(CC(C)(C3)C4)(C)C5)F)=O,30B5BCDA3779EAD3_4DCB2067E05AFAD8_6038_UN,8.28188,00000000000000000000000000000000000000000010000000000000010000100010000000000000000100010011100111000100110111111001011000000000100011100100000011010111111011111111110,GHKRLDAZFBIREF-UFOAXGRKSA-N
FC1=CC4=C(C(=C1)NC2CCN(C)C23CCCNC3)N=CC=C4,C4BC5C8C66978306_4F72A7F61FEF4F80_6041_DP,8.431841,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,QQQXRUKJMKZFEW-UHFFFAOYSA-N
C[Si](C)(C)C1=C(N=C(C=C1)NCC2C3(CCNC2)CCOCC3)F,CE89A242658EBA65_E155181AC912D65D_6041_DP,7.634964,00000000000000000000100000000010000000100010000000000100010000000110000000100100101000110011010000101000110101011000001011000000110111110110011011011111010111101111110,GSOGWRSJKGCFRC-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NC3CC(C2=CC=N[N]2C)OCC3)CC=C,FF3706A8596EB414_D6A755C3E2F30D0E_6041_UN,8.371483,00000000000000000000000000000000001000000000000000001000010000100100000000010000100100000011011111110000100011010000101011101100110011010100001011011111110111101111110,NJNQXQJSGNZCDT-UHFFFAOYSA-N
N3CCCC1=C(C=C(S1)NC(CC)CC2=CC=C(C=C2)F)C3,2F843FD2FE9418AC_C9A4AF99F9F090EC_6041_DP,7.221177,00000000000000000001000000000000000010000010000100000000000000000000000000000000011100111011000010001100110100010010101011000100110101110110001010010001010110101111010,GMWLDRCNSTZHCR-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(C4=C(C)[N](N=C4)C5=C(C=CC=C5)F)=O,3B8B43FC30583698_384699C60CB2F8A8_6038_UN,8.570509,00000000000000000001001000000000000000000010000000001000000000100100000000010000101100010011101011001000010100100000010011101100110001110100001011001011011110101111110,FJPFUQTXZMHHOG-UHFFFAOYSA-N
N(CCCC1=CC2=C(C=C1)OCO2)C(C4CC3CCC(N3C)C4)=O,4A0BCF85D99AA08D_5207240E8E345B79_6038_UN,7.91488,00000000000000000001000000001000000000000000000000000000010000000000000010010000001101000010110010101100110011110100111011110000110000000110001011111001111111111111110,LIWZUXUJGSMKKG-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2C[C@@H]3CCO[C@H]3C4=NC=C[N]4C)C5CCNCC5)F,9A151F11F831C1E4_625FEF766E148153_6034_UN,8.615863,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101110001010111101000100101010000001011100100110010100110001011011011110111101111110,QNGHLLVOEKTXER-LAUBAEHRSA-N
CC1=C(C=C(C(=C1)NCC(C2CCNCC2)C3=CC=CC=C3)Cl)C4CC4,F83BF85AC435B807_FC15DD68EA58EEE1_7022_DP,7.974065,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000110001000000101001100110010000001001000100110101110110001011010011010110101111010,DTRQXECUIKJBHB-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC(C3CCC3)C4CCC4,E6AE3D5A50C6C87C_855992C5A61D279F_6041_UN,8.140891,00000000000100000000000001000000000000000010000000000000000000000100000000010101001101010001010010001100011110000000001011100100110001110100001010011011010110101111010,GBPSFCNQFOAJIE-UHFFFAOYSA-N
C(C1CCCC12CCOCC2)=CC3=C(Cl)[N](C(=N3)N(C)C)C4=CC=C(C=C4)C,F77AF4399DD14934_88496BC5A217A988_7019_UN,7.262929,00000000000000000000000001000000000000000000000000000000010000100110000000110101000101110000010010110001011101001000001011100100110011110110011011011110010011101111110,GGZDGEAPFVMEHQ-UHFFFAOYSA-N
FC1=CC2=C(C(=C1)F)C=CC(=N2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,6CBE5B5684655F71_9BBA66B4CC4752B8_6041_UN,8.596104,00000000000000000000000000000000000000100010000000000000010000100100000000010100101001110001010100101100010111010001101011100100110011110110001001011011110111101111110,HMSZHPLJCPOZJF-FPOVZHCZSA-N
FC1=CC3=C(C(=C1)NCC2CCCCN(C)C2)C=CN=C3,BF40FCB99F236B93_8C8C3728543BA37D_6041_UN,8.514248,00000000000000000001000000000000000000000010000000000000000000000100000000010000101001110011010000101100010110010001101011100100110001110110001001011001010110101111010,BCCRHIQQLHBBJZ-UHFFFAOYSA-N
C2(=C1OC(OC1=CC=C2)(F)F)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,85E91A554B5F3D00_EEECB1AF510B1745_7022_UN,8.679118,00000000000000000000000000000000000000000010000000001000010000100100000010010000101101110001011111101100011111011101101011111100110011110110001011111111110111111111110,VOOSRTWRARAODG-GJZGRUSLSA-N
C[N]1C(=NC=C1C#N)NC3(CC2=C(C=CC=C2F)F)CCCCC3,614E901E3AE23153_EE4B600B84046B4E_6041_UN,7.2338157,00000000000000000000000001000000000000000110000000000000000000000110000000010101100101010011010010000000101100011000001011100100110001110100001011011011000110101111010,IFACGMYGPMIIMY-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2(CCNCC2)C3=C(C=NC=C3)F)F,481803C49BF0AD1E_6CF3DF1402E0AAF2_6041_DP,7.9291015,00000000000000000000000000000000000000000010000000000000000000100110000000100000001001110011010000101000100100011001001011100100110101110110001011011111010110101111010,OIXYPPAXTJKMDL-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N=CC(=C2)NCC3C(CC)CCCC3,5AEB4252771A6E4E_C3211B152EC1FFC1_6041_UN,8.387275,00000000000000000000000000000000000000000010000000000000000000000100000000000001001000010011000000101100010110000010101001000100110001110100001001010011010110101111010,DGQRNFMRBPUCKI-UHFFFAOYSA-N
ClC2=CC1=C(C=CC=C1)N(C2=O)CC3(CNCC3)C4CCOCC4,BAAD4050F41324F5_57892D0A9899576F_6034_UN,8.28804,00000000000000000000000000000000000000000000000000000000010000100110000000010000101101110011100010101101110101111100011011100101110010100110001111011011011111110111110,YPLQYHAIWNDYOC-UHFFFAOYSA-N
FC2=CC1=C(C=CC=C1)N(C2=O)CC3(CNCC3)C4CCOCC4,F652ACFE8F532392_EB02E86B0AC2058F_6034_UN,8.2880335,00000000000000000000000000000000000000000010000000000000010000100110000000010000101101110011100010101100110101111100011011100101110010100110001111011011011111110111110,OTDKRGRHGWMWBP-UHFFFAOYSA-N
C1(=CC(=CN=C1)F)NCC2CCCN(C)C2C3=CC(=CC=C3)Cl,5328650BE1E62172_774FDB167A9EBB73_7022_UN,8.652927,00000000000000000000000000000000000000000010000000000000000000100100000000010001101001110011010000101001000110010001101011100100110001110110001001011011010110101111010,MRLQODZZPHIGAM-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,7D338673343464E2_3011F4B898A15DDA_6041_UN,8.033356,00000000000000000000000000000000000000100011000000000000000000000100000000000100100101110010010010001100010110010001101001100100110101110100001011011011010110101111010,KMZJJRHBSXJQMJ-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CC2CNCCN(C)C2)C=CC(=C3)C)C4,A0FA3F29880472CB_79DC5343FBC5F2D3_6034_UN,8.296677,00000000000000000001000000000000000000000000000000000000000000000100000000010001101101100011010010001100110010010011101011100100110000000110011011011101010110101111010,LWYKBNPRORXLBN-UHFFFAOYSA-N
CCNC5CCC1=C(C4=C(N1C[C@@H](C)C2=CC3=C(C=C2)OCO3)C=CC(=C4)Cl)C5,01F5236B55CE85AA_DD1F6503C467DC32_6034_UN,7.91275,00000000000000000000000000001000000000000000000000000000010000000100000010010000001101010010000010001101110111010111001011110100110001100110001011011101110111111111110,MQDVUWPIHBQMQW-NNJIEVJOSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCC3)C4=CC(=CC=C4)F,EBCD216C9BB1C583_B4B1A89A8FEFBA32_6041_UN,7.769207,00000000000100000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100000001110100001010011011000010101111010,WPLNDAQIGKPBCM-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NCCC2OCCC2(C)C,5717126D8A681B7F_6AE80118A32BF8EA_7022_UN,7.930647,00000000000000000000000000000000000000000010010000000000010000000010000000100000001100010000000011011000100111011001101000000000110010100110000000010111110101101111110,BDPYUBNULHDXII-UHFFFAOYSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)NC[C@H]4[C@H](CCNC4)C5=CC=C(C=C5)F)F,6B1C6FBE730A7EBF_CABD0830FE0C6900_6041_DP,7.729456,00000000000000000000000000000000000000000010000000000100000000100100000000000000101000110011000000101100110100010000001011000100110101110110001011010011010110101111010,CALKTTXVAKNQHG-AZUAARDMSA-N
CC5(C)CCC1=C(C4=C(N1C[C@@H]2CNCC[C@H]2C3=CC=CC=C3)C(=CC(=C4)F)F)C5,5897A6EE4BF6E462_A2F338D08C53F4A8_6034_UN,8.163725,00000000000000000000000000000000000000000010000000000000000000100110000000110000101101110011000010101100110100011001101011100100110000100110001011011111010110101111010,LCWMWMKUUYGLBR-ICSRJNTNSA-N
C[N]1N=C(C=C1NCC2(CCNCC2)C3=C(C=NC=C3)F)C4CCCC4,45B2E009E543ED9D_37FCE6120E5A00A6_6041_DP,8.4742985,00000000000000000000000000000000000000100010000000001000000000100110000000010101101100110011011010101000100110011000001011101100110101110110001011011011010110101111010,IGWBHTWPTYMJKA-UHFFFAOYSA-N
BrC1=CC2=C(N=C1)N(C=C2CC3=CC=CC=C3)C[C@H]4NCC[C@@H](C(C)(C)C)C4,8EF4196B29820406_248A1EE971FE3F78_6034_UN,8.264275,00000000000000000000000000000000000000100000001000000000000000000110000000110101001101010001000010101100110110011000101011100100110000100110011001011101010110101111010,NCSSQEDFCBWAHS-CTNGQTDRSA-N
C1(=C(C=C(C=C1F)F)Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,FFBF9C4B5F78E26F_89B14DE1C92A487C_7022_UN,9.229323,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,OLEAMUWQOWNTEM-HOCLYGCPSA-N
C1(=C(C=C(C=C1Cl)F)Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,1BABE8871BA157EE_C6953ABA39240966_7022_UN,9.229309,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,NOLHERAAWQSWKR-HOCLYGCPSA-N
C1(=C(C=C(C=C1F)F)Br)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,86DFEC22721C0E2F_23D24AC3759A4ED3_7022_UN,9.229301,00000000000000000000000000000000000000000010001000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,VDYKWGUXADAIBI-HOCLYGCPSA-N
FC1=CC3=C(C(=C1)NCCC2C(C)(CCCO2)C)[NH]C=C3,AE4884D21163D31E_05D8F4D86AAEEB44_6041_UN,7.964061,00000000000000000000000000000000000000000010000000000010010000000110000000100001001100010001000011101100110111011001101011000100110111110110001001010111110111101111110,DMFFTHFSPVXJLI-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCCOC2C3=CC=CC=C3)Cl)C4CC4,5209BAB4EC5511FB_4576631AB571F070_7022_UN,7.8227224,00000000000000000000001000000000000000000000000000000000010000100000000000000000001000010011000001101001000111000000001000000100110011110110000011010011110111101111110,VQQRQFONJJHLHH-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(CCCCC2)C3=CC=CS3)Cl)C4CC4,D999D00AA12D1E58_58FACBA6F4C39AD0_7022_UN,7.399817,00000000000000000000001000000000000010000000000000000000000000100010000000000000011100011011000010001001000110001000001000000100110001110100000011010011010110101111010,URZFRFLRGQNULF-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)C3=CC=C(C=C3)CCF,4830F8A7136EF05F_0F0105291321A7C9_6038_UN,8.284008,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001100011110000101000010010110001111001100000110000100110001001011001011110101111110,SBDKDUAVCNBORR-UHFFFAOYSA-N
C(C12CCC(CC1)CC2)=CC3=C[N](N=C3C4=CC=CC(=C4)C)C5=CC=C(C=C5)F,51CCF614D0B7D2D0_B8F491AF613E0E32_7019_UN,7.945642,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011010000010101111010,WJCLIXGYCYCTAM-UHFFFAOYSA-N
FC2=C1C=CC=NC1=C(C=C2)NC4=C(C=C3OCCOC3=C4)[N](=O)=O,7BC46756507DC589_5613F7CE82FF984D_6041_UN,8.482236,00000000000000000000000010000000000000000010000001000000110000010100001110000001000000010000001001100110010101000100001111101100001011110110101011111011110011110111110,VUPWIPICVIJCEA-UHFFFAOYSA-N
CC2=C1[NH]N=CC1=CC(=C2)NCC3CCCN(C)C3C4=CC=CS4,374C78B585BBDEF1_74DADB19D67BFC97_6041_UN,8.615968,00000000000000000000000000000000000010000000000000001000000000100100010000010000111101101011011010101100010010010001101011101100110101010110001001011111010110101111010,JDJRCDYQAUJTNA-UHFFFAOYSA-N
FC2=C1C=CC(=NC1=C(C=C2)F)NCC3N(C)CC4(CC3)CCC4,99E4439832D74CEC_956ACAE645C27D07_6041_UN,8.412856,00000000000100000000000000000000000000100010000000000000000000000110000000010101001001110011010000101100010110011001101011100100110001110110001001011011010110101111010,CBFADKHJGBTSBP-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCNC4(C3)CCC4,E58F2F553F65AD39_8C92055E2AE39864_6041_DP,7.5511436,00000000000100000000000000000000000000100010000000000000000000000110000000000100001000010011000000101100110110011000001011000100110101110110001011010111010110101111010,WQERTFZTDWSKFX-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC3(C)C(OCC3)C4CC4)F,1D07D9C57EC62EA0_A26F9B88EA8F6BCD_6041_DP,7.7139072,00000000000000000000001000000000000000000010000000000000010000100010000000000000001100010011000011101100110111011001101011000000110111110110001011010011110111101111110,SJMKBFUQBKWAEC-UHFFFAOYSA-N
C[N]1N=NC2=C1C=CC(=C2)NCC34OC(C)(C)C(C3)C4,81238564E5A346C1_B16D6F2FC3E6EA89_6041_UN,7.198107,00000000000100000000000000000000000000000000000000001000010000000110001000110101101100000010011110001100010010001000100011101100101011010100011000001101110111101111110,CVWPPBYXYMHJBW-UHFFFAOYSA-N
C([C@]12C[C@H]1COC23CCC3)=CC4=C[N](C)N=C4C5=C(C=C(C=C5)F)F,84965E67DC95977C_E2597BBF6EA479F4_7019_UN,7.7265034,00000000000100000000001000000000000000000010000000001000010000100110000000010000100100010000011010110000010101001000001011101100110010100100001011011010110011101111110,WVEQZPIOKFHBQK-LIRRHRJNSA-N
CC2=C1SC(=CC1=CC=C2)NCC3CCN(C)C3C4=CC(=C(C=C4)Cl)F,E42D53FF38291C60_2ADCD0450A0A219B_7022_UN,8.091718,00000000000000000000000000000000000010000010000100000000000000100000000000010000111101111011010010001101010110010001101011100100110001110110001011011111010110101111010,JFNDOHCMEPLMLD-UHFFFAOYSA-N
NCC(COC1=CC(=C(C)C=C1C2CNCC2)Cl)CC3CC3,971A8E88E8A23C80_DE3C0C0F7B7785ED_6035_UN,8.565214,00000000000000000000001000000000000000000000000000000000000000100000000000000000001110110011000011001001100101010100001001000011110100100110001110010011110101101111110,WPZOUEJZNIKUAV-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=C[N]2CC3(CCCN3)CCl)C4CCNCC4,27BD2F4AC9E37A30_271689BE96225A5C_6034_DP,8.295929,00000000000000000000000000000000000000000000000000000000000000100110000000010001001101100011000010101101110000011000001011100100110100100110001001011001010110101111010,CPIOQEPCRRRSTE-UHFFFAOYSA-N
C(C1C2CCOCC12)=CC3=CC(=C(C)C=C3)OC(F)F,DAF02E132CDDC8CA_5D247815618CF9FD_7019_UN,8.582142,00000000000000000001001000000000000000000010000000000000010000000000000000000000000000100000000000110000011101000100001000000011110010100110000111010010110001011011110,MQUMGQSOARCUBK-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCNC23CCC3)F)CC4,C584C2BCC8D81C19_4640C1BE0FFD7891_6041_DP,7.479729,00000000000100000001000000000000000000000010000000000110000000000010000000010001101101110011010010001000110110011001101011100000110101110110001010011011010110101111010,CALDDPYZFPBMJQ-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3C4(C3)CCNCC4)Cl,26E2CA9421339611_EF0249A39581B9E9_6034_UN,7.3608117,00000000000000000000001000000000000010000000000100000000000000000110000000010110011101111011000010101001111110011000001111100100110101110110001011011011010110101111010,IPLORZSBVLZFRS-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NCC3C(CCN3)C4CC4)C,92F69D901E3F5F4D_60A480BAD439D2F3_6041_DP,8.198898,00000000000000000000001000000000000000000010000000000010000000100100000000000001101100010011000010101100110110010000001011000100110101110110001011010111010110101111010,NHGDJMUWHSUVDS-UHFFFAOYSA-N
CC1=C(C=CC(=C1)OCC2CC2)N[C@H]3[C@H]4CC[C@@H]([C@@H]3C(F)(F)F)O4,4578E873503D3549_DEC05D80A6BBE2D7_7022_UN,7.653932,00000000000000000000001000000000000000000010000000000000010000000000000000000000000100000011000111000000011101001100001000000011010011110100000111010011110111111111110,KMGPGDAEIXZSMF-YVSFHVDLSA-N
C1(=C(C=C(C=C1)F)Cl)NCC34CC2CC(CC(C)(C2)C3)(C4)C,217039830D53B4A8_988358FDDFA93C72_7022_UN,7.5056286,00000000000000000000000000000000000000000010000000000000000000000010000000000000001000010010000000001101010110001001000000000000100001110000000011000111010110101111010,NSCQKOYKNCQSAE-UHFFFAOYSA-N
C1(=C(C=C(C=C1)F)F)NCC34CC2CC(CC(C)(C2)C3)(C4)C,07256DB1A0876315_0D425F01B5187293_7022_UN,7.505621,00000000000000000000000000000000000000000010000000000000000000000010000000000000001000010010000000001100010110001001000000000000100001110000000011000111010110101111010,YPQCURKUTNRSCS-UHFFFAOYSA-N
C1(=C(C=C(C=C1)Cl)Cl)NCC34CC2CC(CC(C)(C2)C3)(C4)C,2EF9935D732A5632_82E6EDCF30177C5D_7022_UN,7.505626,00000000000000000000000000000000000000000000000000000000000000000010000000000000001000010010000000001101010110001001000000000000100001110000000011000111010110101111010,ZPGDWNLONJXRHA-UHFFFAOYSA-N
C1(=C(C=C(C=C1)Cl)F)NCC34CC2CC(CC(C)(C2)C3)(C4)C,2743D7A09E3A5E3F_6F1A597DE792D7C3_7022_UN,7.5055857,00000000000000000000000000000000000000000010000000000000000000000010000000000000001000010010000000001101010110001001000000000000100001110000000011000111010110101111010,KURXFMZVRCTMKG-UHFFFAOYSA-N
C(C1(CC1)C2CCCCO2)=CC3=C[N](C)N=C3C4=C(C=C(C=C4)F)F,063F834A3C6BEE82_5ED13C3C1FEBBC93_7019_UN,8.170519,00000000000000000000001000000000000000000010000000001000010000100110000000010000100100010000011010110000000101001000001011101100110010100100001011011010110011101111110,XOHPMIUEJTVKQX-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(CC3=C(C)[NH]C4=C3C=C(C=C4)F)=O,FA9AB766AF7348F5_0B071F40988D8A31_6038_UN,7.838685,00000000000000000001000000000000000000000010000000000000010000000100000000000000001100010011100010101100110100110000111011000100110110100100001011010011111111111111110,RICYBAPYKOONBS-UHFFFAOYSA-N
FC1=CC2=C(C=C1)SC=C2NC3CCN(C)C34CCCNC4,D8107AF87177B7A7_9FFA171FB3BB17E5_6041_DP,8.28885,00000000000000000000000000000000000010000010000000000100000000000010000000010001111101111011010010101100110110011001101011100100110101110110001001011001010010101111010,CPIVXCFOEUJFKE-UHFFFAOYSA-N
N4CCC1=C(C=C(C(N1C[C@H]2[C@@H](CCNC2)C3=CC=C(C=C3)F)=O)C#N)C4,2954108A15A6C499_1F3E05985629A67F_6034_DP,8.285901,00000000000000000000000000000000000000000110000000000000000000100100000000010000101001110011100001101100110100110100011011100101110100100110001111011011011110100111110,XFHQEGIAOGMDIK-HKUYNNGSSA-N
CC1=C(C=CC(=C1)CCNC(C2CC3CNC2C=C3)=O)F,CA180C242DFAB0DF_20E41424E5394608_6038_DP,7.8707333,00000000000000000000000000000000000000000010000000000100000000000000000000000000101000010010100001111000110110110000011001000000100100100110001011010011011110101111110,YHKTXCPMYPAFCF-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)C=CC3=C2CCCCC2=N[N]3C)OC(OC4)C5=CC=CC=C5,76DE37B984E3AAF7_B1259A749C645ADC_7019_UN,7.8470426,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010100011010110100010111010100001011111100110000100100001011011010110011111111110,IZTULIDMHBXWDK-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC3CCC2(CCCN2)C3)F,8A0F4DAF43FC5125_F1650E294E1E77BB_7022_DP,7.5826044,00000000000000000000000000000000000000000010000000000100000000000010000000100000101101110011010010001000110100011001001001100000110101110110001010011111010110101111010,LWOOGNNXVYAGOF-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2CC3(CCC2)CC3,BF222EEE39AAA6E6_07C05130F80A60C5_6041_UN,7.529419,00000000000000000100101000000010000000000000000000000000000000000110000000100001001000100011010000101000010000001000001001000000110001010100011011011111010110101111010,QDBYRQFHHJBRCC-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)N[C@H]4[C@@H](C4)C5=C(C=C(C=C5)F)F,395F1F49FAC4F4B8_9F6196D28B0E8E63_6041_DP,8.266307,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000110110010000000011100100110101110110001011001011010010101111010,JQFSCEMVYBNZHG-WHRORGPCSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC34CCCNC3C4,BB43267262FCB011_E9A4A2E11FBB5E52_6041_DP,8.459604,00000000000000000001001000000000000000000010000000001100000000000110000000010000101100010011011010101100110100011000001011101100110101110110001001011001010110101111010,ZCCXYSSLRODEAD-UHFFFAOYSA-N
C2(=C1CCCCC1=CC=C2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,6877D042A7A4A2F1_CE6C38CABBB98310_7022_UN,7.614321,00000000000000000000000000000000000000000010000000000000000000000000000000010001000001110011010000101100010100010001101011100100110001110110001011011011010110101111010,QIAFPZRBNMUUHB-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC3=CC=CC(=C3)CN4CCN(C)CC4)F,FD09CA8A0F6DA737_CA0BAB96FE8C7EAC_6041_DP,7.1910696,00000000000000000000000000000000000000000010000000000000000000000000000000010001001001110011010000101100110100010001101011100100110101110110001011011011010110101111010,YXZIBRKCKFLEJA-UHFFFAOYSA-N
FC1=CNC(=O)C2=C1C=CC(=C2)C3=CC=C(C=C3)C4(O)CCC4,9B0C4CE2C32D4165_DB170F23AB32AF64_6004_UN,9.01462,00000000000100000000000000000000000000000010000000000000000000100110000000000000000000010011100000100100110100101100011001000101000110100101000101010001101011010111110,ZJALVTORBFSHHI-UHFFFAOYSA-N
N(CCC1=C(C=CC(=C1)F)F)C(C23CCC(C)(C2)CO3)=O,8FC8C31C146FAC27_B7DEFCA1F1AF24E4_6038_UN,7.854409,00000000000000000000000000000000000000000010000000000000010000000010000010000000001100010011100110101000110111111001111000000000110010100110000011010011111111111111110,UMZZKBFKDUSTPK-UHFFFAOYSA-N
FC2=C(C=C1OC=CC1=C2)NC4=C(CN(C)CC3CCCCC3)C=CC=C4,275C005075631447_CEF6DBFB00E71212_6041_UN,8.345504,00000000000000000000000000000000000000000010000000000000010000000000000000000000100101110010010011001100010110000001001000100100110001110110001011011011110110101111110,XBUVIJQGRQGKHA-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NCC3C(CCN3)C4CC4)C,6ABE58A5F5017995_F5C06BEE7901B870_6041_DP,8.2644005,00000000000000000000001000000000000000000010000000000010000000100100000000000001101100010011000010101100110110010000001011000100110101110110001011010111010110101111010,RYJCRZOQFQZPFN-UHFFFAOYSA-N
FC1=C(C=C(C=C1)N3SC2=C(C=CC=C2)C3=O)NC5=C4C6CCC(C4=CC=C5)O6,B00623BED377AFF7_0AD2D4F0D5E70D76_6041_UN,7.900031,00000000000000000000000000000000110010000010000000000000010000100101000000010000110100011001101011000100010100100100011011101101000011110100001111011011101011110111110,AWXHPAGXQJNSLJ-UHFFFAOYSA-N
FC1=CC(=CC=C1)[S](=O)(=O)NC2=CC4=C(C=C2)OC3(CCC3)C=C4,D3DB70BECCF7441F_8060C3B8460B8479_6026_UN,8.259399,00000000000100000000000000000000110000000010000000010001011111001011010001000000010000011000001000110110011100001100011000001100001011111100000011111001100011110111110,LKWZTUKDHJIWJS-UHFFFAOYSA-N
CN4CCC1=C(C3=C(N1CC2CCNC2CC)C=CC(=C3)Cl)C4,49E9D2A53C9AC438_E48C80E2B22CE606_6034_UN,7.6914616,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101110011010010101101110110010011101011100100110000100110001011011111010110101111010,QUKUKYDLTMFIIT-UHFFFAOYSA-N
CC2=CN(C3=C1C=C(C=CC1=NC=C23)Cl)CC5(CC4=CC=C(C=C4)F)CCNC5,424C71F2F709BE20_5C5773CDB4D32F40_6034_UN,8.48216,00000000000000000000000000000000000000000010000000000000000000000110000000010000101101110011000010101101110110011000001011100100110000100110001001011001010110101111010,HQZVOVGUHWECDI-UHFFFAOYSA-N
C[N]1N=C(C=C1F)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,9AC678AA6ACD0EDA_7BDFA81BFDEDBBA1_6041_UN,7.6937046,00000000000000000000001000000000000000100010000000001000000000000110000000110101101100010011011010001100010100001001101011101100110001110100011011011111010110101111010,KGFORKDVLPMQDE-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CC3(NC2)CCC3)F,4F4FC5A28754A06B_425D2FF348814A58_6041_DP,7.2068076,00000000000100000000000000000000000000000010000000000100000000000010000000100000101101110011010010001000110100011001001001100000110101110110001010011111010110101111010,LEZLXFBABRNAAT-UHFFFAOYSA-N
FC2=C1N=CC=C(C1=CC=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,1D439B6F25F5EB86_1599600AAE5A0C4D_6041_UN,8.229293,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,KYSYVPYWRZECKX-QRQCRPRQSA-N
N(CCC12CC(C1)CO2)C(=O)C3(CCC3)C4=C(C=CC=C4F)F,B4F46ED0831570DA_CFEFFFD6B00FDF60_6038_UN,7.7646904,00000000000100000000000000000000000000000010000000000000010000100010000000000000001100010011100011001000110101111000011000000000110010100110000010010011111111110111110,JVSSKMORSKMGDG-UHFFFAOYSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(C4=CC(=C(C=C4)F)CC)=O,88C20991F9B201D4_7192CD08079C2DAD_6038_UN,7.7062063,00000000000000000000000000000000000000000010000000000000010000000000000000000000000100010001100011000100010100100010011000000100000011110100000011010011101111111111110,JMUXBAQDJSCFJY-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CCC34CNC4,CB810593FD930073_623795DA3B99C6C7_6041_DP,7.526987,00000000100100000000000000000000000000100000000000000000000000000110000000000100001000100011000000101100010010001000001011000100110101010110011011010111010110101111010,NFSBGVDHSWYQTR-UHFFFAOYSA-N
CC1=NC4=C(C(=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)C=CC=C4F,66F4BD918287D3BC_BF324BFEF3A183F1_6041_UN,8.21519,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101100010111010001101011101100110011110110011001011111110111101111110,TYCYOPHLHXHKCX-ICSRJNTNSA-N
FC3CCC(C=CC2=C([N](CC1CCCN1CC)C(=C2)C)C)C3,AD053F8CFC6326C7_BD8204C87E3C4CB1_7019_UN,8.537835,00000000000000000000000000000000000000000010000000000000000000000100000000010001000101110000000010011000000110010010101011100000110000100110011010011110010110101110010,VIDNSUBYVRSNJK-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC23CCNC2CCCCC3)F)CC4,454C0AC188CA56D8_E8F47E1B224C65D5_6041_DP,7.5945945,00000000000000000001000000000000000000000010000000000110000000000010000000010001101101110011010010001100110110011001101011100000110101110110001010011011010110101111010,GMNCGUUHMNOUIG-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCCC3CSCCN3,21579A6A4603B67C_476DC0BC1842617C_6041_DP,7.659001,00000000000000000000000000000000000010100010000000000100000000000100000000000100101000111011000000101100110110010000001011000100110101110110001011010111010110101111010,YCRDUQZJFCPCFO-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC34CCC(CC3)CO4,A345593DF112B597_69DD0A25840FCBDA_6041_UN,7.947459,00000000000000000000000001000000000000000010000000000000010000000110000000010101001101010011010110101100011111001000001011100100110011110110001011011011110111101111110,XSYOPOUVRFFABM-UHFFFAOYSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC3=C[N](C)N=C3C4=C(C=CC(=C4)F)F,2DD913EE1C718310_C223AC40E0E263A1_7019_UN,8.438842,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010000011010010000000100000000000011101100110000100100001010011010000110101111010,MTQQWVYFEDAEJM-CJNGLKHVSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3CC4(CCC3)CCCCC4,392E5882E1EAD01C_9467178F15974C66_6041_UN,7.6735916,00000000000000000000000001000000000000000010000000000000000000000110000000010101000101010011010010000100111100011000001011100100110001110100001011011011000010101111010,HIEWBEHAPKSFNS-UHFFFAOYSA-N
CN(CC1CNC1)C2=NC=C(N=C2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,2F2806324528E285_5668AFD4EBCE6069_6041_DP,7.990017,00000000100100000000001000000000000000100010000000000000000000100100000000000101101001110011010000101000000110000001000011100100110101110110001011001011010110101111010,CWTYEAUMKQAHQS-UONOGXRCSA-N
NOCC1=C(C=C(C=C1)F)NCC2(CCOCC2)C3=CC=C(C=C3)F,E4235A0DEE94F006_414670838A7C1A89_6041_UN,7.6536894,00000000000000000000000010000000000000000010000000000000010000100010010100000000001010110011001001101010100101011000001000001110110111110110001011010011010111110111110,YOPBMDDMULVUDT-UHFFFAOYSA-N
CN(C)CC1=NC=CC(=C1)N[C@@H]2C4=C(OC3(C2)CCCC3)C=CC(=C4)F,DA9372413096D4AF_FEB94EF334A2CFFD_6041_UN,7.7138205,00000000000000000000000000000000000000000010000000000000010000000110000000100001100001110001010011101100110100011101001011100100110011110100001011011101110111101111110,RSXRPPDHGYLPBL-IBGZPJMESA-N
[NH]1C=CC2=C1C(N(C=C2)CC3(N)CC4=C(C3)C=CC=C4)=O,530521451E29BDCC_04638815FFDBD127_6034_DP,8.815337,00000000000000000000000000000000000000000000000000000000000000000110000000010001000111000001100110101100110000111100010011100101010101000100001111001011011110100111110,LGGKUGSXYMTBPC-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NCC3CCN(C)C3C4=CC=CS4,28C105345AB75798_A0912BC035B79CD7_6041_UN,8.104947,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011111010110101111010,BEYYVRQBYGOBDO-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NCC2(CCCC(C)C2)N(C)C)F)F,501B03DA80571F34_9FF9DEF4A91881C5_7022_UN,7.8675632,00000000000000000000000000000000000000000010000000000000000000000010000000100001001001110011010000001000000110011001101000100000110001110000011011011111010110101111010,XQBDHUCXIXEWTJ-UHFFFAOYSA-N
ClC1=C(C=CC(=C1)NCC2=NC=CN2CC3C(C)(CNC3)C)Br,7067D4266F6DB2C9_939A055FF0F8EDD0_6034_UN,8.687173,00000000000000000000000000000000000000100000001000000000000000000110000000110101101101110011000010001001000110011001100011100100110101110110001010001111010110101111010,SRNDFWVBEJLASE-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3OCC4(C3)CCC4,448D5F9531D4B5BF_40F3CD43667DA770_6041_UN,7.0385675,00000000000100000000000000000000000000100000000000000000010000000110000000000100001100000011000110101100010011001000001011000100110011010110011011010111110111101111110,SYTKTKIKQXSCNY-UHFFFAOYSA-N
FC1=CC2=C(C(=C1)F)C(=C(C#N)C=N2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,FD630D76DD59C6D3_50E32106712C6BB9_6041_UN,7.599992,00000000000000000000001000000000000000000110000000000000000000000110000000100000101000010011000000101100010100001001101001000100110001110100001011010111010110101111010,IEHBWJKCWQRYQG-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CC[C@H]2CNCC2)C=CC(=C3)Br)C4,000854FED8B636E3_9A44D772CD80111A_6034_UN,7.953528,00000000000000000000000000000000000000000000001000000000000000000110000000110000001101110011000010001100110100011001101011100100110000100110001011011101010110101111010,VNCJFZSCGZWORO-AWEZNQCLSA-N
C1(=C(C(=CC=C1)C#N)Cl)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,B0161115FF93820F_5E57C4E61677A4BC_7022_DP,7.537825,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101001100100010000001001000100110101110110001011010011010110100111010,QEXJSAWLCVCRDK-DOTOQJQBSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3(CCNCC3)C4=C(C=NC=C4)F)C5,9F2300FB923DA67C_624D432F0B54F384_6041_DP,7.9539013,00000000000000000000000000000000000000000010000000000000000000100110000000010000101101110011010010101100110100011001101011100100110101110110001011011011010110101111010,NZNGTFMXHAJBDY-UHFFFAOYSA-N
C1(=C(C=CC=C1)C(C#N)N2CCOCC2)N[C@H]3[C@@H](C3)C4=CC(=C(C(=C4)F)F)F,BEAFCA904D85568A_3F300C9B47DBF8E0_6041_UN,7.8224,00000000000000000000001000000000000000000110000000000000010000100000000000010001100001110010000100101000100101010000001011100100110011110110001011011011010011100111110,DDMVWVFMWKIRPQ-SXBLTQOBSA-N
FC2=C(C=C1C(=CN(C1=C2)C[C@H]3[C@@H](CCNC3)C4=CC=C(C=C4)F)CC#N)F,E89F559D45DBDCE6_AE7D6CB34B365C50_6034_UN,7.832405,00000000000000000000000000000000000000000110000000000000000000100100000000010000101101110011000010101100110100010000001011100100110000100110001011011011010110100111010,QLNJEOQCKXVBGT-WMZOPIPTSA-N
CN4CCC1=C(C3=C(N1CC2C(C)(NCCO2)C)C=CC(=C3)Cl)C4,3C9A3088BD79B507_2A5D4CB14FD5B759_6034_UN,7.546075,00000000000000000000000000000000000000000000000000000000010000000110000000110000101101110011010110101101110111011001101011100100110010100110011011011111110111101111110,LCBDGPZEHLHEKT-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3OC(CC3)C4CC4,7609609180060C72_79D353143AF88107_6041_UN,7.8570814,00000000000000000000001000000000000000100010000000000000010000100100000000000100001100010011000110101100010110000000001011000100110011110100001011010111110111101111110,KDOIBADHOLGFRU-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC5COC4=C(C=C(C=C4F)F)C5,2CC5AEBE135A2733_3C33153B048ED859_6041_DP,8.714773,00000000000000000000001000000000000000100010000000000000010000000100000000000101101101110001010110101100110111010100000011100100110101110110001011001001110011101111110,PYJVWKIPRLESCU-MBIJGJCISA-N
N(CCN1CC2CCC(C1)O2)C(C4=CC3=C(C)C=C(C=C3[NH]4)F)=O,26DB611CBDFEB16B_034E072476CA2FEE_6038_UN,8.326124,00000000000000000001000000000000000000000010000000000010010000000100000000010001001101110001100110101100110100110000011011100100110110100110001001011001111111111111110,GDGKEXBGWRASJK-UHFFFAOYSA-N
C1(=CC(=CC=C1)COC2CCOC2)NC3=CN=C([Si](C)(C)C)C=N3,B43F313E2BDC4454_4443868066862386_7022_UN,7.7457857,00000000000000000000100000000010000000100000000000000000010000000100000010100101000100100101010010100000000001001000001011000111110011010110011101011101110111111111110,IGOAXJGTPJEBII-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CC2(C)CCCCC2)C=CC(=C3)C)C4,4110C7B2753A3F4D_ED4186B991AC8BCE_6034_UN,7.9581385,00000000000000000000000000000000000000000000000000000000000000000110000000010000000101000000000010001100010010011011101001100100110000000100010011011100010110101111010,QTOYPHXZGSFZLX-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=CC=N2)NC3CCN(C)C34CCCNC4,DFBDAAF8B5D34AE1_4FFCF947F50B5E43_6041_DP,8.372608,00000000000000000000000000000000000000000000000000000100000000000110000000010001101101100011010010101100110010011001101011100100110101010110001011011111010010101111010,NMABETYVISGUDF-UHFFFAOYSA-N
CCC4CCC1=C(C3=C([N]1CCC2CNC2)C=CC(=C3)C)C4,126E83866819D81C_A7067702F693EB22_6034_DP,8.36433,00000000100100000000000000000000000000000000000000000000000000000100000000010000001101100011000010001100010010010010101011100100110000000110001011011101010110101111010,SMZYIEFMAIXBTJ-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CCC2CNC2)C=CC(=C3)C)C4,126E83866819D81C_F845DDF976B6A964_6034_UN,8.364321,00000000100100000000000000000000000000000000000000000000000000000100000000010000001101100011000010001100010010010010101011100100110000000110001011011101010110101111010,SMZYIEFMAIXBTJ-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=C1)NC3=C2CCCCC2=CC=C3,F88E24903B7B1E33_B81127837782F74F_6041_UN,7.787463,00000000000000000000100000000010000000000000000000000000000000000000000000100000000000100011010000000100010000001000001000000100110001010000010011011111000010101111010,LTGKZHLYUMXKLD-UHFFFAOYSA-N
C(CC23CC1CC(CC(C1)C2)C3)=CC4=C[N](C)N=C4C5=C(C=C(C=C5)F)F,6AD50A18FA5A4085_2412483CDEF975E2_7019_UN,7.8553014,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010000011010010100010100001000000011101100100000100100001011001010000110101111010,JBGHATQSCXWXRX-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@H]3[C@@H]2CC[C@@H](N2)C3)F)[N]4C=CC=C4,9759BAD81927681F_7012093F335F05EF_6041_DP,8.444782,00000000000000000000000000000000000000000010000000000110000000100100000000010001100101010011000010000000110100010000001011100100110101110100001011011011000010101111010,BWCJYTHZJJXDON-IVMMDQJWSA-N
CC5(C)CCC1=C(C4=C(N1CC2=C(C=CC=C2)CC3CCNCC3)C=CC(=C4)Br)C5,24582F4F1D70A14B_230716A8C4E1AD92_6034_UN,7.9214387,00000000000000000000000000000000000000000000001000000000000000000110000000110000001101110001000010101100110100011001101011100100110000100110001011011111010110101111010,WMNVYLPVJCIMDC-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CN=C2)NCC(N3CCOCC3)C4=CC=C(C=C4)F,018763A77889A437_3C62FE00614A37BF_6041_UN,7.679699,00000000000000000000000000000000000000000010000000000000010000000100000000010001101101110001010110101100010101010000001011100100110011110110001001011001010111101111110,HMGHMEWOEBGALX-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC=C2NCC3CCN(C(CC)C)CC3,91D6C73FC287C336_4980545946F524A8_6041_UN,8.240035,00000000000000000000000000000000000000000010000000000100000000000100000000010000101101110011000010101100010110010011101011100100110101110110001011011111010110101111010,KEJYRGFZEZFYGO-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)Br)C)NCC2=NC=CN2C[C@H]3[C@@H](CNC3)C4CC4,234139222C11CE46_78632EAD2D76DB0B_6034_UN,8.502327,00000000000000000000001000000000000000100000001000000000000000100100000000010101101101110011000010001000000110010000000011100100110101110110001010011111010110101111010,OWOTXPBLZDWVMN-WMZOPIPTSA-N
FC1=C(C(=CC=C1)N[C@H]3[C@H](C2=NC=C[N]2C)OCCC3)C4CC4,5ED8501310EFA4C3_02C95F07946ED48A_6041_UN,8.2989645,00000000000000000000001000000000000000100010000000000000010000100100000000010101100101010011010110100000100101010000001011100100100011110100001011011011110011101111110,OEJJMOUXIBKRTL-NVXWUHKLSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC3C4(C(O)C3)CCOCC4,ACEE7C3956F60536_6BBF24A2A9054458_6041_DP,7.6195903,00000000000100000000000000000000000000100000000000000100010000000110000000000100000000100011000001100100110001011000001011000101110111010111011111010111110011111111110,BWDNKCLCLSITAY-UHFFFAOYSA-N
N5CCC1(CC1C=CC4=CC2=C([N](N=C2C)C3=CC=CC=C3)N=C4Cl)CC5,34E8C119821364D9_454B7C5385A5F3D3_7019_DP,8.005144,00000000000000000000001000000000000000100000000000001000000000100110000000010101101100110001001010111101110100011000001011101100110001110110001011011011010010101111010,ZBVDOXILTGIISX-UHFFFAOYSA-N
CC1=C(C=CC(=C1)NC2=CN=C([Si](C)(C)C)C=N2)OC3CCOC3,D50ADD02D65AB8F6_C020A09F55347910_7022_UN,7.7167783,00000000000000000000100000000010000000100000000000000000010000000100000010100101000100100100010010100000000001001100001011000111010011010110011111011111110011111111110,KYQOGAXOVVKYEG-UHFFFAOYSA-N
CN(CC1CCNCC1)C2=NC=C(N=C2)N[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,CE2B3185788FFF5B_E674948BCFE7BAA9_6041_DP,8.356783,00000000000000000000001000000000000000100010000000000000000000100100000000000101001001110011010000101000100110010001001011100100110101110110001011011011010110101111010,XYBHLCZPRTWLTN-RHSMWYFYSA-N
CN(C)C4CCN(CC1=CC=C(C=C1)NCC2(CCCC2)C3=C(C(=CC=C3)F)F)C4,433925BF0008EDCB_381763C4B9F4DC50_6041_UN,8.017581,00000000000000000000000000000000000000000010000000000000000000100010000000110001101101110011010010001000000110011000101001100100110001110110001011011111010110101111010,AQBDNMJGZUYKLN-UHFFFAOYSA-N
C(COC1CCCCO1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,B4A5AF40B0565E6B_B70F92B9E5FDCFF0_7019_UN,7.8205433,00000000000000000000000000000000000000000010000000000000010000000000000000000000000001010000010010110000000111010000101000110011110011110110000111011010010111111111110,RVEKLCXSJGEPIA-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2CCSC(C)(C2)C)F)CC3,8FFF5B4843C4ED76_3DA10CD46DAECA9D_6041_UN,7.889227,00000000000000000001000000000000000010000010000000000000000000000010000000110001110001111010010000101000100110011001101011100000110001110110011011011111010110101111010,CGDNJHNIAVGVKA-UHFFFAOYSA-N
CC(OC2=CC=C(CNCC1N(CC)CCC1)C=C2)CNC3=NC=NC(=C3)Cl,32E4ADEB6C81ECDB_7CA21B236322D8B9_6035_UN,8.565949,00000000000000000000000000000000000000100000000000000000000000000100000000010101101101110011000110101001000110010111101011100111110111110110001101011111110111101111110,VSAWYSOCIOKRRK-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(N)CCCC4=C3C=CC=C4)C5=CCNCC5,C61EE2FF88D5A82B_D0DAE99D0C28AE11_6034_UN,8.255987,00000000000000000000000000000000000000000010000000100000000000100110000000011001001111110011000010111100110100011000001011100100110101100110001011011001010110100111010,OTJLNZYMYJADSU-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3CC2(CC2)CO3)F)CC4,9636C0440C056C46_3393002482ED73E3_6041_UN,7.062193,00000000000000000001001000000000000000000010000000000000010000000010000000010001101101110011010110001000010111011001101011100000110011110110001010011011110111101111110,IYXZDEBAZOOFNV-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NC3(CCOCC3)CC4=CC=C(C=C4)F,3B93CA4C09A14422_C9BF72BAA0F834CC_6041_UN,7.769689,00000000000000000000000000000000000000100010000000000000010000100110000000010100100101110011010011101000100111011001101011100100110011110110001011011011010111101111110,FKBZNPWGFUGRTB-FQEVSTJZSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCCC2CCN(CC2)C3=CC=NC=C3,73407872D208171C_548B35A2FFF19B47_6041_UN,7.982586,00000000000000000000100000000010000010000000000000000000000000100100000000110000111101101001010010101000100000011000001011100100110001010110011011011111010110101111010,UQHJMRJEOKWQFI-UHFFFAOYSA-N
C1CNCC(C1)C3=CC2=C(C=CC=C2)N3C[C@@H](CC)NC4=NC=C(C=C4)Br,713387AC45D3ED77_B5B8D1815AD8C1D6_6034_UN,8.238991,00000000000000000000000000000000000000100000001000000000000000100100000000010101101101110011000010101100110100010010101011100100110101110110001011011011010110101111010,BHKQRHOQCILAEL-WHCXFUJUSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(C)CCOC3)C4=CCNCC4,663FEEEBAF83E5FC_21E23A636E2E0792_6034_UN,8.49518,00000000000000000000000000000000000000000010000000100000010000100110000000011000001101110001000011111100110111011001101011100100110010100110001001011001010111101111110,UXINRKGKHVWXTK-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)N[C@H]4[C@H](C3=C(C)[N](N=C3)C)OCC4,A60E0B7969DD73E2_A9478DF70F4376D3_6041_UN,8.797895,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011011111000000100101010000001011101100000011110100001010011111110011101111110,YESJVTKHBRLLEO-AEFFLSMTSA-N
C[Si](C)(C)C1=C(C=CC=C1)NC2C3(CCNC2)CCOCC3,B798A769D9180EED_8B7242503E9A4271_6041_DP,7.4613304,00000000000000000000100000000010000000000000000000000010010000000010000000100001001000100011010000101000110001011000001011000000110111010110011011011111010011101111110,ZDRBLYWECRQFBH-UHFFFAOYSA-N
N(CC12CCN(CC1)CC2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)Cl,589335DB2A2DEEA7_06152B91BE0DC71D_6038_UN,7.7747083,00000000000100000000000000000000000000000000000000000000000000100010000000000000001001110011100000101001010100111000011001100000110000100110001011011011011110100111110,NYEAXBQDZHQWEN-UHFFFAOYSA-N
N(CC12CCN(CC1)CC2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)F,A4C7DEB1AF430941_C9F07199653BBE3B_6038_UN,7.7747045,00000000000100000000000000000000000000000010000000000000000000100010000000000000001001110011100000101001010100111000011001100000110000100110001011011011011110100111110,ISLRMNUOMSSUHE-UHFFFAOYSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)C[C@]34CCC[C@H]3NCC4,4D16994C1A561A39_2570BCB2972A6EDD_6034_UN,8.512041,00000000000000000000000000000000000010000000000100000000000000100110000000010110111101011011000010001101111100011011001111100100110001110110001010011111010110101111010,JPSCSFSWSGHSKV-AIEAQGLASA-N
CC1=C(C=CC(=C1)F)NCC(CN2CCCC2)C3CC3,665BE7097F55BFC5_A0671888F7618627_6041_UN,8.389865,00000000000000000000001000000000000000000010000000000000000000000000000000010000101101110011000010001000000110010000001001100000110001110110001010011011010110101111010,OPOUSZXPLZYZJP-UHFFFAOYSA-N
N(CC1C3CC2CC(CC1C2)C3)C(C4=C(C)C5=C([NH]4)C=CC(=C5)F)=O,032849CB75D72C8B_74AAAB32842D26C5_6038_UN,7.5656834,00000000000000000000000000000000000000000010000000000010000000000100000000000001001100010001100110001100010100100000010001000100110100100100001011000011011110101111110,DDPOVKOBXZQUTA-UHFFFAOYSA-N
N3CC[C@@H]([C@H](CNC(C12CC(C)(C1)CO2)=O)C3)C4=CC=C(C=C4)F,D70BFF8AB4898835_A5B2C3D7714CA3D3_6038_DP,8.389453,00000000000100000000000000000000000000000010000000000100010000100010000010000000101100110011100110101000110101111001011011000000110110100110001001010011111111111111110,RHKJJTPACIVXJN-FIZCFOIVSA-N
CN4C[C@H]3C2=NC1=C(C=C(C=C1)Cl)C(=C2CC[C@H]3C4)C5=CC=C[NH]5,4249565421898AD8_87DE66BAD9F5A4A8_2201_UN,8.424387,00000000000000000000000000000000000000000000000000000000000000100100000000010000100101110001010010101101010110000001001011100100110000100110001011011001010010101111010,KVLNGMAGSCFTHL-BLLLJJGKSA-N
CC5(C)CN(CCC1CCC2=C(C3=C(N=C12)N=CC=C3)C4=CC(=CC=C4)Cl)CCS5,F78A546929959E94_9B4C3EBCA5916410_2201_UN,8.739074,00000000000000000000000000000000000010100000000000000000000000100110000000110100010001111000000010101101010110011001101011100100110000100110001011011100010110101111010,OBKYJPZETQAKCY-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC3C(C)(COCC3)C,822618FB6CE22C60_20B86529F2ACC28B_6041_UN,7.9393363,00000000000000000000000000000000000000000010000000000000010000000110000000100000101000110011000000101100010111001001101011000100110011110110011011010111010111101111110,LGANHXNRPVRNKP-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2C[C@@H]3C[C@H]3C#N)C4CCNCC4)F,83B3EA2D112785C4_54C4B3E179A42AF7_6034_UN,8.0646,00000000000000000000001000000000000000100110000000000000000000100100000000010101001101110001000010101000100100010000001011100100110000100110001011011011010110100111010,UBEOJBOAAJVUKT-GJZGRUSLSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3N(C)CC4(CC3)CCC4,8CBF727A76F74639_9ACE8B725B9E6F38_6041_UN,7.611495,00000000000100000000000000000000000000100000000000000000000000000110000000010101001001100011010000101100010010011001101011100100110001010110011011011111010110101111010,GNTSEMUGFUQAEA-UHFFFAOYSA-N
O[C@H](CBr)C1=C(C=CC=C1)NC24CC(OC23CCNCC3)(C)C4,4087C2D4CB9E9D1A_8FF87E96A4595C13_6041_DP,8.825969,00000000000100000000000000000000000000000000001000000100010000000010000000000000001100100011000111101000110010011001001011000000110111110111001011010011110111111111110,HRBNOCPGLSWBPN-KLAILNCOSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@@H]3CCO[C@H]3C=C,C4A36102BC0D6B4D_4AA7C88A8AB31A3B_6041_UN,7.816004,00000000000000000000000000000000001000100010000000000000010000000100000000000100001100010011000011111100010111000000001011000100110011110110001011010111110111101111110,BXPUTVRKKNKJKS-BBRMVZONSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC3CCNC34CCC4,44736A0AE8B66AB8_7F709490449C45E9_6041_DP,7.660804,00000000000100000000000000000000000000100000000000001100000000100110000000010101101100000011011010001000110010011000001011101100110101010110001010011111010110101111010,IRXNVUICAYGKCM-UHFFFAOYSA-N
N3CCCC(CC=CC1=C(Cl)[N](C(=N1)N(C)C)C2=CC=CC=C2)C3,8808C7AFAC324D69_D3E668255317D824_7019_DP,7.126256,00000000000000000000000001000000000000000000000000000000000000100100000000110101001101110011010010111001101100010000001011100100110001110110001011011111010110101111010,CQDOYEJEOGOVBZ-UHFFFAOYSA-N
FC1=CC(=CC(=C1)N[C@H]3[C@H](C2=C([N](N=C2C)C)C)OCC3)C[N]4C=CN=C4,2A7DDA7761B4CBCF_70178EA1F3665D54_6041_UN,8.4457035,00000000000000000000000000000000000000000010000000001000010000100100000000010101100101010011011111001000100101010000001011101100000011110110011010011111110111101111110,ANKZXQIZEQUBBK-UYAOXDASSA-N
CC1=CSC(=N1)CC2(CCNCC2)OC4=CC=C(CNCC3N(CC)CCC3)C=C4,DB2198D994797D80_3D673B565A7F23F1_6035_UN,8.799481,00000000000000000000000000000000000010000000000100000000000000000110000000010001011101101011000011101000100010011110101011100111110110000110001101011111110111101111110,LMVXBFKZZFNXHQ-UHFFFAOYSA-N
N(CC3CN1CC2CC1(C2)CO3)C(=O)C5=C4[NH]C=CC4=CC(=C5)F,49831D05979DAE38_3710851D648FAC2D_6038_UN,7.882358,00000000000100000000000000000000000000000010000000000100010000000110000000000000101101110011100111101100010101111000010011100100110110100110001001001001111111110111110,VSSPPAGILBKCKW-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2CCC3(CC2)CCCC3)F,A55BE19EED863AA0_2E39B39D5286C917_7022_UN,7.907058,00000000000000000000000000000000000000000010000000000000000000000010000000100000000001110010010010001000110100011001001000100000110001110000001011011111010110101111010,IMJQOTRGSUUNOZ-UHFFFAOYSA-N
CN1CC(CCC1)C=CC3=CC(=C2OCOC2=C3)C4=CN=CC(=C4)F,F4F024DCC5FBB397_2289086E11D114F6_7019_UN,8.219256,00000000000000000000000000001000000000000010000000000000010000100100000010010000000101110000010010111100010111010101101011110100110000100110001011011000110001111111110,DOCVYHWIKSCAFH-UHFFFAOYSA-N
CC1(CCO1)C2=CC=C(S2)NCCC3=NC4=C([N]3C)C=CC(=C4)F,CB07EB79886193D9_4BB23604D212B56F_6041_UN,7.6836348,00000000100100000000000000000000000010100010000100000000010000100110000000010101111101011000010010001100110111011001101011100100000011110110001010011111110111101111110,OTPBGQITERBXKW-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CCC(=O)C3=C(C=C(C=C3)F)F,DB29BB68936AD442_99A2723DBA1FC4FB_6038_UN,7.7480164,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001000110100110000011000000000110010101000000011010011111110110111110,UMRRCAKPSWUYGM-UHFFFAOYSA-N
O[C@H](CBr)C1=C(C=CC=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,1683310242BCD6A8_49B7762C4E99F073_6041_DP,8.749724,00000000000000000000000000000000000000000000001000000100000000100100000000010101101101100011010011001000100010000000000011100100110111110111001010001011110111101111110,KVYMCYIZOMZWLS-DXCKQFNASA-N
C1(=C(C=C(C(=C1)F)C#N)F)O[C@@H]2CNC[C@H]2CC3=CC=CC=C3,B5EA344F083EB6E5_79D18FDC16010564_7022_DP,7.889178,00000000000000000000000000000000000000000110000000000000000000000000000000000000001100110011000111001000000100000100000001000111110010100110001111000011110101100111110,YTRZQLDFDLAMDY-RDTXWAMCSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCCCC3)C4CCCCC4,009E093936F5CEF8_E807F0C00311B87D_6041_UN,7.494963,00000000000000000000000000000000000000000010000000001000000000100110000000010000101100010011011010001100010100001000001011101100110001110100001001011001010110101111010,VREBLIMMQWDEQA-UHFFFAOYSA-N
N(CCC12CC(C1)CO2)C(=O)C3CCC3C4=CC(=C(C=C4)Cl)Cl,EA92864E8F01370E_9F7827DA5C3A8715_6038_UN,7.9355717,00000000000100000000000000000000000000000000000000000000010000100010000000000000001100010011100011001001110101111000011000000000110010100110000010010011111111110111110,WEJBSMHLIXFFHO-UHFFFAOYSA-N
N5CC1=C(C=C(C=C1)NC2=CC(=CC(=C2)F)N3C[C@H](C)O[C@@H](C3)C)C4(CC4)C5,D9FDEACDD5937912_75CE2D29533510FE_6041_DP,8.042976,00000000000000000000001000000000000000000010000000000000010000100010000000010000101001110011000100101100010110001001000011100100110111110110001011011101110011101111110,LWCBNAJCLQSSGO-IYBDPMFKSA-N
FC1=C(C2=C(C=C1)CCC2)NC4CC3(CCN(C)CC3)OC5=C4C=CC=C5,460A2867929102BE_1A9785822594CC21_6041_UN,7.863945,00000000000000000000000000000000000000000010000000000000010000000010000000010000000001110011010011101100110100011101101011100100110011110110001011011011110011101111110,NSMRUWCBBQJTNJ-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3(NCCNC3)C)Cl,BC4F5910702A765F_41CCC749BC3DD039_6034_DP,7.970808,00000000000000000000000000000000000010000000000100000010000000000110000000010111111101111011000010101001101110011001101111100100110101110110001011011111010110101111010,GVBOOLACUOWPMK-UHFFFAOYSA-N
C[N]1N=C(N=C1NCC2(CCCC2)C3=C(C=CC=C3)F)C4CCOCC4,C70158103B47891F_A510C6581C309E69_6041_UN,7.93184,00000000000000000000000001000000000000100010000000001000010000100110000000010101101100110011011010101000001111001000001011101100110011110110001011011011010111101111110,CJZRHKNQFSPSJR-UHFFFAOYSA-N
N(CC23CC1CC(CC(C1)O2)C3)[S](C5=C4[NH]C=CC4=CC=C5)(=O)=O,BB0F13CE8BED4B43_F6BC00B36FEBAF71_6029_UN,7.7495832,00000000000000000000000000000000110000000000000000010101011111001111010001000000111100001010001111101110011000001000010011001100101110001100001001101001110111110111110,RIPKVRZHCFOBSR-UHFFFAOYSA-N
NCCCC(OC1=CC=CC2=C1CCNC2)C3=CC=C(C=C3)F,53B8F787071D58CC_90DCF74CD5BE34E6_6035_DP,8.113097,00000000000000000000000000000000000000000010000000000000000000000000000000000000001010110011000000101100110100010100001001000111110110100110001111010001110101100111110,UNUWKYYHPAZFJF-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCC3CCN(CC2=NC=CC=C2)C3,B2E5152E9183C5A7_4B869C9674CE6A8D_6041_UN,8.289499,00000000000000000000100000000010000010000000000000000000000000000100000000110001111101101011010010101000000000011000001011100100110001010110011010011111010110101111010,IRKCPRFAZBCAFU-UHFFFAOYSA-N
C1(=CC(=CN=C1)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,DC03E1D27732A044_0B09C064A9140624_7022_UN,7.7512283,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,XJOUFOMLEMTFSC-ACJLOTCBSA-N
C([C@@H]1C[C@@H]2O[C@H]1[C@H]3C[C@@H]23)=CC5=CC(=C(N4CCN(C)CC4)C=C5)F,6731EC058E771F27_B8D8FF4799A17BE7_7019_UN,8.039207,00000000000000000001001000000000000000000010000000000000010000100000000000010001000101110000010010111000010100010001101011100000110011110110001011011010110011101111110,NOBXTSLTXVQAMZ-BUSATUKNSA-N
FC2=C1N=CC(=C(C1=C(C=C2)F)NCC3CNCC(C3)(C)C)C#N,8616DA21A409778B_5F97D19EEBBB5262_6041_DP,7.819791,00000000000000000000000000000000000000000110000000000100000000000110000000100000101000110010000000101100010110001001000011000100100101110110001011000111010110101111010,NWPSCSQQBXJMJA-UHFFFAOYSA-N
NCCCC(OC1=C(C=CC=C1)CC2CCNCC2)C3=CC=C(C=C3)F,937DD5821AA14E07_1800F2783BC303F4_6035_UN,8.362941,00000000000000000000000000000000000000000010000000000000000000000000000000000000001010110011000000101000100100010100001001000111110110100110001111010011110101100111110,MHTJJNAIAHPTGM-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC3CCN(C)C34CCCNC4,0CEEEBD3A2656FDE_6075D0C263ECE23A_6041_DP,8.223884,00000000000000000000000000000000000000000010000000000100000000000110000000110001101101110011010010101100110110011001101011100100110101110110011011011111010010101111010,NNZRSJAVYXOUCG-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@]23CCC[C@H]2CNC3)Cl)C4CC4,6E80C0821A1AF16B_6104FBF6A7FE1062_7022_DP,8.278004,00000000000000000000001000000000000000000000000000000110000000100010000000000001101100110011000010001101110110011000001001000000110101110110001010010011010010101111010,SPHHKLGILQMYGY-GUYCJALGSA-N
ClC2=C1C(=CN(C1=NC=C2)CCC3CC(C)(C)OC3)CC4=CC=CC=C4,B60370D7ACA7CA2A_61300DDBB88A9D4C_6034_UN,8.362226,00000000000000000000000000000000000000100000000000000000010000000110000000110100000101010000000010101101010111011001101011100100110010100110001001011100110111101111110,LYGHFAGNHFKHPY-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC3=C(CN(C)C2CCCCC2)C=CC=C3)C4CC4,F12FC99CBE12E0C9_CE306C942E79C674_6041_UN,8.249606,00000000000000000000001000000000000000000010000000000000000000100000000000000000100001110011010000001000000110010001101000100100110001110000001011011011010110101111010,OYGYMKOSQPSJMG-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C3=C2CCCCCC3)C[C@]45[C@](C)(C4)CNC5,304B0E8C78307B11_905BBC3F11B08786_6034_UN,7.571301,00000000000000000000001000000000000000000000001000000000000000000110000000010000101101110011000010101100010110011001101011100100110000100110001011011011010110101111010,PXFBJLFFNOYAOQ-RTWAWAEBSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC4O[C@@H]3CCCC[C@H]3C4,33DD03EB842F6F74_9570BF2F4A1FC633_6041_UN,7.582199,00000000000000000000000000000000000000100000000000000000010000000100000000000100001100000010000110101100010010000000001011000100110011010100011011010111110111101111110,KYCSVKYIUAGHBJ-LVLJQFTKSA-N
CN(C)CC1=C(C=CC(=C1)NC2=CC(=NO2)C3CCCCC3)F,5E174B335A9206A5_7B5986988DDEF804_7022_UN,7.9442105,00000000000000000000000000000000000000000010000000000000010000100100000100100001100101110001111011001010000100100001011011101100110001110100001011011111010110101111110,ZGYNMCHYBWFBFU-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NCC3CCSCC3,19A124DE6B5C8075_4B3D48C36C99BC77_6041_UN,7.857664,00000000000000000000000000000000000010000010000000000000000000000100000000100000101000111011000000101100010100000000001011000100110001110110011011010111010110101111010,IZPQETPWLIPLSD-UHFFFAOYSA-N
C1(=CC2=C(C=C1)OCCC2=O)NC4=CC3=C(C=C[N]3C)C=C4,A8E526A37538F31F_15F78C682B650FFB_6041_UN,9.358206,00000000000000000000000000000000000000000000000000000000010000000100000000010000100101000100010010100100010001000100001011100101000011010100001111011001111011111111110,XSBCVJVVMLNPKX-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3C4CCOCC34,7C604132E88B59DC_FD1F80C1A02F6CB6_6041_UN,7.8546505,00000000000000000001001000000000000000100000000000000000010000000100000000000100001000100001000000101100010011000000001011000100110011010110011011010111010111101111110,WRAHUYMLXHZIGY-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C#N)[N]2C=C(C=N2)NCC3CNCC4(O3)CCC4,E26181CB804B285D_08BDE4F87ECFA2FF_6041_DP,8.174632,00000000000100000000000000000000000000000110000000001100010000100110000000010001101100110011001110101000010100001000001011101100110111110110001011011011110111100111110,QPBNHHADPWWGAJ-UHFFFAOYSA-N
FC1=CC5=C(C(=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)N=CC=C5,3D1DCCE12CE0831B_71A103B9A0891377_6041_UN,8.431667,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,LVPQYDDJRSSJEO-ZHRRBRCNSA-N
C(C1CC2CCC1CC2)=CC4=CC=C(C3=C(C)C=C(C=C3)F)O4,68E1177D8917C371_D7F4E90B19835203_7019_UN,8.512807,00000000000000000000000000000000000000000010000000000000010000100000000000000000000100010000000010010000010100000000001000000100110000100100000011010010100000001011110,RXIJDELLGISKSW-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)C3(CCC3)C4=C(C=CC=C4F)F,B0EC0F84F3A279B3_5504F05073AF8AE6_6038_UN,7.6486764,00000000000100000000000000000000000000000010000000000000000000100010000000010000101001110011110000101000010110111001111001100000110000100110001011011011011110101111110,CXGLUIOCZHAGNW-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CC2(C(C)CNC2)C)C=CC(=C3)Cl)C4,64E3538FD8EA8B32_6A269A59AA2D60FF_6034_UN,7.918178,00000000000000000000000000000000000000000000000000000000000000000110000000010000101101110011000010001101110110011011101011100100110101100110011011011111010110101111010,GATJKLVNNRPKSH-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2CCC=CCC2,BE13F714E0FDE633_2CFEE151A2772B12_6041_UN,8.02297,00000000000000000101100000000010000000000000000000000000000000000100000000100001001000100011010000111000000000001000001001000000110001010100011010011111010110101111010,GWTVVFIGWGGHNE-UHFFFAOYSA-N
C1(=CC2=C(N=C1)C=CC=N2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,93548EAD47C9FEF4_726C344F3BD3D31F_7022_UN,8.178024,00000000000000000000000000000000000000000000000000000000000000100100000000010001101001110011010000101101010110010001101011100100110001110110001001011011010110101111010,LLZOGMKQJYWVAH-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C#N)C2CC2)NC[C@H]3C4CCC([C@@H]3C(F)(F)F)CC4,1D8ED63DA9FDC4D3_BBEC59F9398BAD65_7022_UN,7.5149126,00000000000000000000001000000000000000000110000000000000000000100000000000000000001000000001000000001000011100001000001000000000110001110000001011010011010110100111010,NDGXMVAKMZANLN-IJWHBOBBSA-N
FC2=C(C=C1C(=CN(C1=C2)C[C@H]3[C@@H](CNC3)C4=CC=C(C=C4)Cl)CC#N)F,D003F7ECF2C9072A_F70B54E4D7973F4B_6034_UN,7.793157,00000000000000000000000000000000000000000110000000000000000000100100000000010000101101110011000010001101010100010000000011100100110000100110001011001011010110100111010,GLFDXFNWDKHVEU-YJBOKZPZSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(C)CCCCO2)F)CC3,24844121B7038242_FE076E0CA0787C6B_6041_UN,6.974084,00000000000000000001000000000000000000000010000000000000010000000010000000010001101001110011010100101000000111011001101011100000110011110110001011011111110111101111110,JWZKBCSGGISEKU-UHFFFAOYSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC4=CC=CC5=C4CCN(C)C5,55F89669E3A64F36_7DB318A707862C48_6041_UN,7.06272,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101110011010010101100010101010001101011100100110011110110001011011001010011101111110,MMRRVPSUYCFMOC-UHFFFAOYSA-N
FC1=CN=C(C=C1)C2=NC(=CC=N2)NC4C[C@H]3CCC[C@H](N3C)C4,29A4C3BFBEBD99A3_32105A157E60DF28_6041_UN,8.183928,00000000000000000000000000000000000000100010000000000000000000100100000000010101100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,OMRYJRZMVWJFAF-GOOCMWNKSA-N
FC1=CC(=C(C=C1)C2CC2)NCC3C(CC)CCCC3,C1B5BBAC734EF4E2_0DD6C25FB2C23A1D_6041_UN,7.51168,00000000000000000000001000000000000000000010000000000000000000100000000000000000001000010011000000001000000110000010101000000000110001110000000011010011010110101111010,ZXIFQMZFXZLVGX-UHFFFAOYSA-N
FC1=CNC(=O)C2=C1C=CC(=C2)C3=CC(=CC=C3)C4(O)CCC4,3C85D838400EA95C_99DC9EE7B0DD39EB_6004_UN,9.015112,00000000000100000000000000000000000000000010000000000000000000100110000000000000000000010011100000100100110100101100011001000101000110100101000101010001101011010111110,MMRNYUXSJFTCKJ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)OC=C2NCC4CC3(CCN3C)C4,4A18B70201FEFEF1_EDE9C6014AE93FB8_6041_UN,7.770041,00000000100100000000000000000000000000000010000000000000010000000010000000010000001101110010010111001100010100011001101011100100110001110110001000011001110110101111110,KIGTZTUEOLSGOC-UHFFFAOYSA-N
FC1=C(N=C(N=C1)NCC[C@@H]2CC[C@H]3C[C@@H]2C3(C)C)C4=CSC=C4,90B52DC21273A4F9_9C973BFECF83430D_6041_UN,8.621896,00000000000100000000000001000000000010000010000000000000000000100110000000100100101100011001000010101000111110011000101011000100110001110100001011010111010110101111010,KDFPMJNESJPCFL-QEJZJMRPSA-N
C2(=C1[NH]C3=C(C1=CC=C2)CCC3)NC4=CC=C(CC[Si](C)(C)C)C=C4,69292F67B21CD90C_7329049C203111E2_6041_UN,7.6690784,00000000000000000000100000000010000000000000000000000010000000000100000000100001000100100011010010000100110000011001101001000100010101010100011011011101010110101111010,HVJJXWKEKLOTNJ-UHFFFAOYSA-N
O[C@H](CF)C1=CC(=CC=C1)NCC23CCC(C)(CC2)OC3,0A9EC5FEE965C5DB_6D0D504B9EE3B9C3_6041_UN,7.865796,00000000000000000000000000000000000000000010000000000000010000000010000000000000001000000011000001101000110001001001101000000000110111110111000001010001110111111111110,GQHCCFFDHVSHLP-KLAILNCOSA-N
O[C@H](CCl)C1=CC(=CC=C1)NCC23CCC(C)(CC2)OC3,94438B3032470AC9_20A38CCAA9381294_6041_UN,7.865771,00000000000000000000000000000000000000000000000000000000010000000010000000000000001000000011000001101001110001001001101000000000110111110111000001010001110111111111110,FMLKLOLHCIZMPH-KLAILNCOSA-N
N(C2C1C3CC4C1CC5C2C3C45)C(C6=CC(=CC(=C6)CC)F)=O,2109FA088349885E_875CA7840B5FAA33_6038_UN,8.338209,00000000000100000001000000000000000000000010000000000000000000000000000000000000000000010001100010000100010100100010010000000000110001100000000001000001001110101111110,PNMXLYBVHILSLL-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)C2=C(C=CC(=C2)F)OC3CCCCC3,652210B401AEEB86_D4F247376018023C_6004_UN,7.473089,00000000000000000000100000000010000010000010000000000000000000100000000000100000010100111000010010000000000100001100001000000111110010100100010111011110100001001011110,ARUXUMMOYZAWHK-UHFFFAOYSA-N
C2(=C1COCCC1=CC=C2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,B3A3095C6251B4D1_44D29D9EA083A1A9_6041_UN,7.0478997,00000000000000000000000000000000000000000010000000000000010000000000000000010001000001110011010001101100010101010001101011100100110011110110001011011011010111101111110,IMXNMUWZQJXLSI-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CCCC3(C2)OCCO3)F,518E7BA02EE4A4AE_3B7B25B92013C154_7022_UN,7.3660216,00000000000000000000000000000000000000000010000000000000010000000000000010100000001101110011010010001000010101001001001010110000110011110110001011011111110111111111110,MIUVZZKLYIXHHV-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2CCOCC2)NC3=CC(=C(C=C3)N4CCCCCCC4)F,AA1469FD2B47C05E_EED1AF61126C17A1_6041_UN,8.238985,00000000000000000000000000000000000000000010000000000000010000100000000000010000000001110000000000101100000101010000001011100100110011110110001011011011010011100111110,AJGBBZYBYISOKT-UHFFFAOYSA-N
C1(=CC=C(C=C1)CN2CCN(CC2)C3CC3)NC[C]4(C[C]5(C4)C[CH2]C5)CF,9E54775F0BE8CC6C_D6E920E5CFBB2CED_7022_UN,8.087543,00000000000100000000001000000000000000000010000000000000000000100010000000010001001001100010000000101000010000011000001011100000110001110110001001011001010110100111010,RFLICOOIIUNKDX-UHFFFAOYSA-N
CN4CCC1=C(C3=C(N1CC2CCCC2(C)C)C=CC(=C3)Cl)C4,845BD165F9F46FAB_BBFCC471FA2257DB_6034_UN,7.685996,00000000000000000000000000000000000000000000000000000000000000000110000000110000100101110000010010101101010110011001101011100100110000100110011011011110010110101111010,VLHMFRVDLGFPBJ-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3CCCC(C(C)C)CC3,ABD1FCD3CFA743CC_234F740028922469_6041_UN,8.3801365,00000000000000000001000000000000000000000010000000001000000000000100000000110000100100010011011010000100110110010000101011101100110001110100011000011101000010101111010,NGFVHDFVGYCHIU-UHFFFAOYSA-N
CCC(COCC3CC1(CC2(C1)OCCO2)CO3)C4=CC5=C(C=C4)CCCC5,448F7325FC2136AE_870DE91FD85F8D47_6039_UN,7.416971,00000000000100000000000000000000000000000000000000000000010000000010000010000000000100100000000010000100010001001010101010010010110010000110100011110000110101011011110,XTKUHJWLTWMLMZ-UHFFFAOYSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC[C@@H]4CN(C)C[C@H]4C5=CC=CC=C5,BA6358C91DAACC28_3DE3AD3F2E9BF7BE_6041_UN,7.779953,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101110011010010101100010111000001001011100100110011110110001001011011010111101111110,STDPTWBKJZKFPO-CTNGQTDRSA-N
CCN4CCC1=C(C(=CC(=C1)NCC2(CCC2)C3=C(C=NC=C3)F)F)C4,DB01113B928083E8_85CF1516F20A597B_6041_UN,7.9718285,00000000000100000000000000000000000000000010000000000000000000100110000000010000001001110011000000101100010110011010101011100100110001110110001011011011010110101111010,WGJYRWPNUSXGKJ-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC3CC4(SCC3)CCC4,294A4108A9FFAC56_2079807CC744FE6D_6041_UN,7.7798233,00000000000100000000000000000000000010100000000000001000000000100110000000010101110101001011011010100000110000011000001011101100110001010100001011011111010010101111010,OQCNZHCVVUJJQZ-UHFFFAOYSA-N
FC1=CC=C(C=C1)CC2=NOC(=N2)NCC34COC(C)(C3)CCC4,C06EABFF82CD8BC5_9166900C17586957_6041_UN,7.7151594,00000000000000000001000000000000000001100010000000000000010000000110000100000101101100010011001111001010011111111001111011001100110011110110001001010001110111111111110,OQYGSQXCRBMQPR-UHFFFAOYSA-N
CN1CCCC1C2=CC=C(C=C2)NC[C@@H]3C[C@@H](CN3CC4=CSC(=N4)C)F,8A9F090B0482B374_8BBD7D04E092EF13_6041_UN,8.1700735,00000000000000000000000000000000000010000010000100000000000000100100000000010001011101111011010010001000000110010001101011100100110001110110001000011111010110101111010,ZDPIHGOHXHTGLV-LTGDSAQFSA-N
CN1CCCC1C2=CC=C(C=C2)NCCC4CCN(C3CCN(C)CC3)CC4,24D10DFDF3BC0355_C052E7AB00279A01_6041_UN,7.512336,00000000000000000000000000000000000000000000000000000000000000100000000000010000101101100001010010101000100010010001101011100000110001010110001001011111010110101111010,PSHNHNXVIAVMDS-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NCCC2=CCNCC2,694A38ADF6B8AB71_1C908F87A2E092D3_6041_DP,7.782615,00000000000000000100100000000010000000000000000000100000000000000100000000101001001000100001010000111000100000011000001011000000110101010110011001011101010110101111010,WVNWHEVDDRVRKB-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CC3(CCC2)CCCCC3)Cl)C4CC4,06EFFD40B7E242AE_76E6FF1AAEA65380_7022_UN,7.3825607,00000000000000000000001000000000000000000000000000000000000000100010000000000000000000010011000000000001110110011000001000000000110001110000000011010011000010101111010,PDKBJSBTJIWNCO-UHFFFAOYSA-N
FC2=C1C=CC=NC1=CC=C2NCC3N(C)CC4(CC3)CC4,0E79D2D0397C58D7_0AFEF13EB2541982_6041_UN,7.9063296,00000000000000000000001000000000000000000010000000000000000000000110000000010001001001110011010000101100010110011001101011100100110001110110001011011011010110101111010,JSKDEUZSBDBHAA-UHFFFAOYSA-N
FC2=C1N=CC=CC1=CC(=C2)NCC3N(C)CC4(CC3)CC4,A7FEC99782E0513C_652157BB00A368F2_6041_UN,7.966671,00000000000000000000001000000000000000000010000000000000000000000110000000010001001001110011010000101100010110011001101011100100110001110110001001011011010110101111010,PCFQOLWQXAGUKQ-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)NCC2C3(CCNC2)CCOC3)C#N,221CB90A8D8D593B_6C073F8515721051_6041_DP,7.940202,00000000000000000000000000000000000000000110000000000100010000000010000000000000101100110011000010101000110101011000001011000000110111110110001011010011010111101111110,VOAUGRFXLVYUBJ-UHFFFAOYSA-N
CN5CCC1=C(C4=C([N]1C[C@@H]2C[C@H]2C3CCNC3)C=CC(=C4)Cl)C5,EE5C5773CF2A039E_CD9A7BBEF647D140_6034_DP,7.475602,00000000000000000000001000000000000000000000000000000000000000100100000000010000101101110011010010101101110100010001101011100100110000100110001011011011010110101111010,DERHQNCQBIRGDR-DSUHRAPHSA-N
CCC1=NC(=C[N]1CC2CC2)NC4(CC3=C(C=CC=C3F)F)CCCCC4,CB24F875343CF8F3_AFF31C1FC626EEA3_6041_UN,8.023323,00000000000000000000001000000000000000100010000000000000000000000110000000010101100101010011000010001000100110011010001011100100110001110100001011011011010110101111010,IZWHCSNNGPNUKI-UHFFFAOYSA-N
CCN5CCC1=C(C(=CC(=C1)NC(C[N]2C=NC3=CC(=C(C=C23)C)C)C4CC4)F)C5,B5203BB7DDB4EF75_CF63137EA753E7C2_6041_UN,8.641584,00000000000000000000001000000000000000000010000000000000000000000100000000010101000101110011000010101100110110010010101011100100110001110110011011011111010110101111010,SRSJDGQQMOYPKQ-UHFFFAOYSA-N
CC(C)(C)[C@@H]3CCN[C@H](COC2=C(C=C1OCCOC1=C2)Br)C3,175AAAACC4A4A882_7073B613453B264F_6035_UN,8.274413,00000000000000000000000000000000000000000000001000000000010000000010000010100000001000010101000100101100110111011100101011000011110010100110010111110111110111111111110,RNOUNBQICUQLRM-OLZOCXBDSA-N
NCC(COC1=C2C(=CC=C1)OCCNC2)C3=CC=C(C=C3)Br,BB2560B8E85DB3B5_8FE9C22FF21FAC7D_6035_UN,8.136094,00000000000000000001000000000000000000000000001000000000010000000000000000000000001010110110000101001100110101010100001011000111110110100110001111010001110101110111110,YXCRQGYHCIVNOH-UHFFFAOYSA-N
NCC(COC1=C2C(=CC=C1)OCCNC2)C3=CC=C(C=C3)F,697277553DCD09CF_09A6CCD3DFCAD25A_6035_UN,8.136097,00000000000000000001000000000000000000000010000000000000010000000000000000000000001010110110000101001100110101010100001011000111110110100110001111010001110101110111110,QZKFMFVYBNRHTB-UHFFFAOYSA-N
NCC(COC1=C2C(=CC=C1)OCCNC2)C3=CC=C(C=C3)Cl,92CB8B544162ECC2_7FD4C9CBDE507294_6035_UN,8.136094,00000000000000000001000000000000000000000000000000000000010000000000000000000000001010110110000101001101110101010100001011000111110110100110001111010001110101110111110,LLGPZKRRMWWOBA-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2(CC2)C3CCOCC3)F,32916DA18C5728FE_F5E1BDCA98E30F61_6041_UN,7.5820546,00000000000000000000001000000000000000000010000000000000010000100010000000100000001001110011010000101000000101001001001000100000110011110110001011011111010111101111110,GWCCKTGICBJFHH-UHFFFAOYSA-N
CC2=C1N=C(SC1=CC=C2F)NCC3CC4(C3)C5CCC(C4)C5,29F85475F78664BF_63FC837A995C6605_6041_UN,7.788004,00000000000100000000000000000000000010000010000100000000000000000110000000000100011100011010000010001100011100001000001011000100110001110100001011010011010110101111010,GECYDTIWTPCXCK-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC(N3CCCC3)C4=CC=CS4,DD92A000F6C87B63_6DB848992437A6B9_6041_UN,7.9549503,00000000000000000000000000000000000010100010000000000000000000000100000000010101011101111001000010101100010110010000001011100100110001110110001011011111010110101111010,XDUJDTNIOOAICI-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CN(CCC2)C3CCOCC3)F)CC4,F699F921E7458F32_7B5A484BBDAB0991_6041_UN,7.4387426,00000000000000000001000000000000000000000010000000000000010000100000000000010001100001110011010001101000100111010001101011100000110011110110001011011011010111101111110,ZATHOZICPMURCR-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCC(C)C2)F)CC3,64AD3B783ABFC85E_DED24AE42D926BA6_6041_UN,7.7037816,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010010001000000110010001101011100000110001110110001010011111010110101111010,STCLDKVYIYYHCA-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NC(C)[CH]3C[C]4(C3)C[CH2]C4)C,12BA8094359EFC34_5EBA794C8A1B81E8_6041_UN,8.120481,00000000000100000000000000000000000000000010000000000000000000000110000000000000100000010010000000100100010100001000101001000100110001110100011011010111000010101111010,PBVMBNMDSVUXOB-UHFFFAOYSA-N
FC1=C(C=CC=C1)C2=NC(=NC=C2)NC3CCN(C)C34CCCNC4,A084536AE405A128_E91187AE7566EEA8_6041_DP,8.299046,00000000000000000000000001000000000000000010000000000100000000100110000000010101101101110011010010101000111110011001101011100100110101110110001011011011010010101111010,VNLJHMNQGMOESU-UHFFFAOYSA-N
CN(C)C1=C2C(=CC=N1)C(=CC=C2)NC4CCC3=NC(=C[N]3C4)C5=C(C=CC(=C5)F)F,C209090AA4752542_95A367E5FB1EFE93_6041_UN,7.889676,00000000000000000000000000000000000000100010000000000000000000100100000000100101000101110010010010101100110100010000001011100100110001110100001011011111010010101111010,BOIZFMQPFZZUDH-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC3CC4(CC3)CCOCC4,64DA794B09B341DF_21A993898C8B8561_6041_UN,7.3793445,00000000000000000000000000000000000000100010000000000000010000000110000000000100000000110011000010100100110101011000001011000100110011110110001011010111010011101111110,IRWSHZMNJOPKMI-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NC23CC(C)(C2)OC34CCC4,250A01438B1503A0_D3E5939BA9F40540_7022_UN,7.3943624,00000000000100000000000000000000000000000010010000000000010000000010000000000000000100010011000111010000110110011001001000000000110011100100000000010001100011101111110,NQFKYEUKNLXGTI-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C#N)[N]2C=C(C=N2)NC4CC3(CCNCC3)OCC4,2E8E7A0CCB3C41E9_D20207A5B5E3A534_6041_DP,8.277833,00000000000000000000000000000000000000000110000000001000010000100110000000010001101100110011001011101000110101011000001011101100110111110110001011011011110011100111110,KSAVIGQBRXCZBY-UHFFFAOYSA-N
C1(=C(C=C(S1)Br)I)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C,DD9D44822701AF66_587B11620B9DBD83_7022_UN,8.645197,00000000000000000000000000010000000010000000001100000000000000100100000000010101111101111011010010101000000110010001101011100100110001110110001010011111010110101111010,NIVKLRZPDWWYJK-IINYFYTJSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCOC23CCOCC3)F)CC4,9BA28EF0D54DB2DC_E153836ACEAD9045_6041_UN,6.802821,00000000000000000001000000000000000000000010000000000000010000000010000000010001100101110111010111101000110111011001101011100000110011110110001011011011110111111111110,JDXZUTQLASNENJ-UHFFFAOYSA-N
CC1=NC(=C[N]1C)NC3(CC2=C(C=CC=C2F)F)CCCCC3,8D33F0B8C9EDE530_924E01D40E1F9003_6041_UN,7.8922954,00000000000000000000000000000000000000100010000000000000000000000110000000010101100101010011010010000000100100011000001011100100110001110100001011011111000110101111010,QRAGMIAQTJLCBI-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC4CN(CC3=CC=CC=C3)C5(C4)CCOCC5,BDB66686116E015A_502CB67514201C24_6041_UN,7.9708595,00000000000000000000000000000000000000100010000000000000010000000110000000010101100101110001000011101100110101011000001011100100110011110110001011011111010111101111110,GCQMGZJZNSDKPJ-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)N[C@H]2[C@@H](OCC2)C3=CN=CC=C3,4B1D686A31204C86_7A9A69253BCEAF09_6041_UN,7.4942565,00000000000000000000000000000000000000000110000000000000010000100100000000000000000100010011000111100000100101010000001011000100000011110100001011010011110011101111110,OHOFEVXHMZOLJR-WBVHZDCISA-N
C2(=C1OCCCOC1=CC(=C2)C#N)NC4=C3C=CC=NC3=C(C=C4)[N](=O)=O,33D4F7F0A23A9399_A5D42A95AAB264BC_6041_UN,7.602992,00000000000000000001000010000000000000000100000001000000110000010100001110000001100000000101001101100110010001000100001111101100001011010110101011111001110011110111110,UWVHNTWPCOREOH-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)N[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)F)F,BF3016A82214C707_A76720E99FA0166B_6041_DP,8.665176,00000000000000000000001000000000000000100010000000000000010000100100000000000101101101110011010111101000110111010000001011100100110111110110001011011011110011101111110,UKQUZUOXEZJTHV-SNMOEOPISA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4=CC(=C(C(=C4)F)N5CCCC5)F,CEB56FF111175111_8C627DADC8DC1C94_6041_DP,7.879122,00000000000000000001000000000000000000100010000000000000000000100100000000010101100101110011010010101000110100010000101011100100110101110110001011011011010010101111010,HIBBYJDYZMLFKY-SCAQPMJSSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NCC4O[C@@H]3CCCC[C@H]3C4)C,38506D2B24A4DFF9_1591447B1303CA75_6041_UN,8.0786085,00000000000000000000000000000000000000000010000000000000010000000100000000000000101100010010000110101100010110000000001011000100110011110100001011010111110111101111110,LCRLPQSYNUHFSY-YWQITRNNSA-N
FC1=CC2=C(C=C1)C=NC(=C2)NC4C[C@H]3CCC[C@H](N3C)C4,15EE5A2BE554E03E_166D2E2FA5978A05_6041_UN,8.065401,00000000000000000000000000000000000000100010000000000000000000000100000000010100100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,CAGNIKWMTSYBEN-ALOPSCKCSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NCC4(C)CCOC3(CCC3)C4)C,2A0DA50FCEDA194A_77C19849FF8E37C9_6041_UN,7.4310102,00000000000100000000000000000000000000000000000000000100010000000110000000000000101100000011000010101100010011001001101011000100110111010110011011010111110111101111110,OCKPKJGZWMVDRY-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)C#N)F)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,0B820F2958BFDD3B_702A64693101C5E5_7022_DP,7.500807,00000000000000000000000000000000000000000110000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001011010110101111010,LFTDBUYXJPANRZ-NWDGAFQWSA-N
C1(=CC2=C(N=C1)C=CC=N2)NCC3CCN(C)C3C4=CC(=C(C=C4)Cl)F,D5316628F3D7B8BE_47D304E5C5A470C9_7022_UN,8.709978,00000000000000000000000000000000000000000010000000000000000000100100000000010001101101110011010010101101010110010001101011100100110001110110001011011011010110101111010,PMONQUFZKFPARJ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC3CC2CCNCC2CC3)Cl)C4CC4,B6BEF04DDDA56F82_6317A03ADB959AA5_7022_DP,8.158938,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000110011000000101101110110010000001001000000110101110110001011010011010110101111010,COEAFQLVRTXVMG-UHFFFAOYSA-N
FC2=C1SC=C(C1=CC=C2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,17A4E03BA8783A3C_8EF38AD9DBE4DA86_6041_UN,8.218218,00000000000000000000001000000000000010000010000000000000000000000010000000100000011100011011000010001100010100001001101000000100110001110100000011010101010110101111010,KTJMNOQCIBXBDG-UHFFFAOYSA-N
NCC(F)(COC1=CC=C(C=C1)C2CNC2)C3=CC=CC=C3,11A0C682194D24A0_EB2844F72E45B94E_6035_UN,8.110171,00000000100100000000000000000000000000000010000000000000000000100010000000000000001010100010000001001000000101001100000001000111000100100110001101000001110101100111110,JCBDDITUYNQJJQ-UHFFFAOYSA-N
FC2=C(C=C1C=CN=CC1=C2)NC3CN(C)C4(C3)CCOCC4,774B4C306274D7A4_F7BEFC230562D9A3_6041_UN,8.106712,00000000000000000000000000000000000000000010000000000000010000000110000000010001100101110001010011101100110111011001101011100100110011110110001011011011010011101111110,JWDPWRNIUMREPQ-UHFFFAOYSA-N
N1C2CCCC(C1)C2CNC(=O)C[N]3C=CC4=C3C=C(C=C4)F,4FA9997F57F8A4EF_42322F940364201B_6038_DP,7.8631525,00000000000000000001000000000000000000000010000000000100000000000100000000010001101101010011100110001100110100110000011011100100110110100110001001011001011110100111110,AGIWSLRMSODIBR-UHFFFAOYSA-N
CC4=CC1=C(C=C(C=C1C)NCC2N(C)CC3(CC2)CCC3)[NH]4,F1B0521682407D54_78CC609182ABB36D_6041_UN,7.6065564,00000000000100000000000000000000000000000000000000000100000000000110000000010001101101100011010010101100010010011001101011100100110101010110011001011111010110101111010,GFLOTAPAEWOCGR-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(CC3)C4CCOCC4,201D16E190AB336A_FC74E84C8725ED93_6041_UN,7.3499956,00000000000000000000001000000000000000100000000000000000010000100110000000000100001000100011000000101100010011001000001011000100110011010110011011010111010111101111110,WYSIIXODOLYMTQ-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2OCC(C)C2)F)CC3,D96AF09FB242D9C5_AFE10628934FAB05_6041_UN,7.36912,00000000000000000001000000000000000000000010000000000000010000000000000000010001101101110011010110001000000111010001101011100000110011110110001010011111110111101111110,ZIISVBAYTCFCLK-UHFFFAOYSA-N
CN(CC1CNC1)CC2=NC=C(N=C2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,D20BB9F3DB9718E4_0233953542095960_6041_DP,7.79578,00000000100100000000001000000000000000100010000000000000000000100100000000000101101001110011010000101000000110010001000011100100110101110110001011001011010110101111010,MNLFTEAEPGQGQY-GOEBONIOSA-N
CCCC(NC(=O)C1CC2CC1C3CC23)C4=C(C=CC(=C4)F)F,A341C38BF0EC85C7_CF1BF24EBCC023E4_6038_UN,8.302643,00000000000000000001001000000000000000000010000000000000000000000000000000000000000000010011100010000000110100110011011000000000110000100000000011010011001110101111110,SSQZFVXWEUJVHZ-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2C[C@@H]3C[C@H]3C4=CC=C(C=C4)F)C5=CCNCC5,E65A1F6A0E1183A0_A574A03384B71079_6034_UN,8.581066,00000000000000000000001000000000000000000010000000100000000000100100000000011000001101110001000010111100110100010000001011100100110000100110001001011011010110101111010,SDIMJPJITALSFI-UGKGYDQZSA-N
FC1=CC(=C(C=C1)C2CC2)NCC4=C(CN(C)C3CCCCC3)C=CC=C4,CFCFC59ADA0BC493_95CFBBAD4000CE46_6041_UN,8.409847,00000000000000000000001000000000000000000010000000000000000000100000000000000000001001110001010000001000000110010001101000100100110001110010001011011011010110101111010,URJHQISCBCEBQE-UHFFFAOYSA-N
FC2=C(C=C1N=CC=NC1=C2)NC3CCN(C)C34CCCNC4,9FDFB03A5C789351_B700C3C6749E688C_6041_DP,8.293039,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001011011011010010101111010,HWYWBDPMXLIEHS-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CC3(C2)CCOCC3)Cl)C4CC4,395834DA6A5576D0_A30592D4B25FEE48_7022_UN,7.311361,00000000000100000000001000000000000000000000000000000000010000100010000000000000001000110010000000101001010111001000001000000000110011110110000011010011010111101111110,UUGRUOKZAMOSMM-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4CCCC(C4)C5=CC(=C(C=C5)F)F,C0D04EFCB5AD92DD_9A7101E3B9A7A6AC_6041_DP,8.176443,00000000000000000001000001000000000000100010000000000000000000100100000000000100100101010011010010100000111100010000101011100100110101110100001011011011000010101111010,GWVPPEHPJOGYEZ-YBUMUKGHSA-N
CC1=C(C=CC=C1Cl)NC24CC(OC23CCNCC3)(C)C4,F73AC4CB621A51EC_B967146E92A57038_7022_DP,7.7926264,00000000000100000000000000000000000000000000000000000000010000000010000000000000001100110011000111101001110110011001001011000000110111110110001011010111110011101111110,YJCGDEKLFNFVGT-UHFFFAOYSA-N
CC1=C(C=CC=C1Br)NC24CC(OC23CCNCC3)(C)C4,27587065073124FB_656446723BEBE40A_7022_DP,7.7926216,00000000000100000000000000000000000000000000001000000000010000000010000000000000001100110011000111101000110110011001001011000000110111110110001011010111110011101111110,MMWTWECIYVPBPT-UHFFFAOYSA-N
FC2=C1C=CC=NC1=C(C=C2)NC4C[C@H]3CCC[C@H](N3C)C4,7B3CCE971D275513_DA1D741F6A13328E_6041_UN,7.996847,00000000000000000000000000000000000000000010000000000000000000000100000000010001100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,AGAXOACHBNHKBA-AGUYFDCRSA-N
CC1=C(C=CC=C1F)NC24CC(OC23CCNCC3)(C)C4,C2EF57A00957AACB_5746C35CCE741420_6041_DP,7.792608,00000000000100000000000000000000000000000010000000000000010000000010000000000000001100110011000111101000110110011001001011000000110111110110001011010111110011101111110,IQBDJNLDKVCZTC-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCCC3SCCC3,D4043872C019DF65_40DB5C0D775D6607_6041_UN,7.8221164,00000000000000000000000000000000000010100000000000001000000000100100000000010101111101001001011010001000100010010000001011101100110001010110001010011111010110101111010,WDHRYSNADDRSPV-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)N[C@@H]2C4=C(OC3(C2)CCCC3)C=CC(=C4)F)C5[C@@H]6CNC[C@H]56,13958566B2F84051_09A9FD5AC2EAE6CF_6041_DP,8.05814,00000000000000000000001000000000000000100010000000000000010000000110000000000101101101110001010011101100110110011101001011100100110111110110001011011001110111101111110,STQKNWKODZRFHX-LJADNKJMSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC3=CC=C(C=C3)C4NCCNC4,84D14D72A3D9F128_CC4CAF5D4637A7A3_6035_UN,8.242504,00000000000000000000001000000000000000000010000000000010000000100010000000000001001010110011000001101000100101011100001011000111110100100110001101010011110111100111110,ODLOQCDRHTYJBX-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2CC3(C2)CCOCC3)F,7D22E6686AAD6295_FAE9B90BDFA8E7F8_7022_UN,7.1488056,00000000000100000000000000000000000000000010000000000000010000000010000000100000000001110001010000101000110101011001001000100000110011110110001011011111010111101111110,NSEGGGNOJZICGR-UHFFFAOYSA-N
C(CC23CC1CC(CC(C1)C2)C3)=CC4=C[N](C)N=C4C5=C(C=CC=C5)Cl,18F93C813E9E96A8_3D80767001CDAD7C_7019_UN,7.8126235,00000000000000000000000000000000000000000000000000001000000000100110000000010000100100010000011010010101010100001000000011101100100000100100001011001010000110101111010,UMQZXMYIULEGDC-UHFFFAOYSA-N
NCC(COC1=C(C(=CC=C1)C2CNCCC2)F)C3CCCCC3,FFDDAA86E55E2DD2_DBE890FAFA12A076_6035_UN,8.349353,00000000000000000000000000000000000000000010000000000000000000100000000000000000001010110011000001101000100101010100001001000011110100100110001111010011110101100111110,WBFIHUVHVCSPDR-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(C5=C(C4=CC=CC(=C4[NH]5)CC)F)=O,B0BA7453CBC95908_8CCCFC47F0A8AA6A_6038_UN,8.46946,00000000000000000001001000000000000000000010000000000010000000000100000000000001001100010011100110001100010100100010010001000100110100100100001011000011011110101111110,ZKEZZJWZFVFARN-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CC3(CCC2)CC3)F)CC4,4FBD1AFDBFBCE5CB_1193E45B0C754062_6041_UN,7.343297,00000000000000000001001000000000000000000010000000000000000000000010000000010001101001110011010000001000010110011001101011100000110001110110001011011011010110101111010,WEIMEXMHFKECGQ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC2CCN(C)C23CCCNC3)C=C,441B5AF6F67068BA_D04F4DC2C08F0B94_6041_DP,7.563775,00000000000000000000000000000000001000000010000000000100000000000010000000010001101101110011010010111000110110011001101011100000110101110110001011011011010010101111010,LSBYGEKGKCBZNN-UHFFFAOYSA-N
C(C1CC12CCOC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,6392728C383F72B0_4F4F469FF8B2DAFA_7019_UN,7.8939686,00000000000000000000001000000000000000000010000000000000010000000010000000000000000101110000010010010000010111011000101000100000110011110110000010011010010011101111110,VCQRPGIXPUAMKD-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)N[C@H]2[C@@H](C2)C3CCCCC3,3BA209087CEEF664_8834558377E5400C_6041_UN,7.8275065,00000000000000000000101000000010000000000000000000000000000000100100000000100001000000100011010000100000100000011000001001000000110001010100011011011111000010101111010,NXGNRBCONDHXLU-GOEBONIOSA-N
CC1=C(C(=C(C=C1)F)NC[C@@H]2OCCN(CC)[C@H]2C3=C[N](N=C3)C)F,850E85007158AFDE_A11B2188F89A447D_7022_UN,8.479359,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010010101011101100110011110110011011011111110111101111110,ZVYVHOUTNBCTJX-YJBOKZPZSA-N
CN1C(=O)CCC2=C1C=CC(=C2)NC3=CC4=C(C=C3)N=C(C#N)C=C4,FD76604975A539CA_2449F239F9D6C92E_6041_UN,8.633998,00000000000000000000000000000000000000000100000000000000000000000100000000010001000001000001110000100100010010110000111011100101000011010100001111011011001010101111110,ZWTBDLSYESUDJY-UHFFFAOYSA-N
C(C1(CC=C)CC=CC1)=CC2=C[N](C)C3=C2C=C(C=C3)F,F76724BA03D045A8_70BABE5FF9F05F3B_7019_UN,8.541706,00000000000000000000000000000000001000000010000000000000000000000110000000010000000101010000010010010100010100001000000001100100010000100100000000001000000110101111010,LDMAZWLQAWOCFM-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)C[C@H]4C[C@@H]3CNC[C@@H]3N4C)Cl,E5B5F343CEEEA646_87BCAA6B77B150CD_6034_UN,8.010738,00000000000000000000000000000000000010000000000100000000000000000100000000010111111101111011010010001101011110010000100111100100110101110110001010001111010110101111010,XBZWGLIILKPNIC-INMHGKMJSA-N
CC1=C(C=C(C(=C1)N[C@H]2[C@H](CCNC2)C3=CC=CC=C3)Cl)C4CC4,2B074FE67F4DAC20_1ACEAAA3C4C53AE6_7022_DP,8.713376,00000000000000000000001000000000000000000000000000000010000000100000000000000001001000110011000000101001100110010000001001000100110101110110001011010011010010101111010,FRBVUHYHMQOKJA-DYESRHJHSA-N
CC1=C(SC=N1)C5=NC2=C(C=C(C=N2)NC3CC(OCC3)C4=CC=CS4)[NH]5,B46254860FB71380_6D3B88BBBA62D485_6041_UN,8.25949,00000000000000000000000000000000000010100000000100000100010000100100000000000101110100001010000011100100110001010000001011000100110111010100001011010011110011101111110,YRANZEXTSWGSNL-UHFFFAOYSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)NC4C(CN(C)C4)C5=CC=CC=C5)F,6749FE0BE3828795_AE8873975B6D68AD_6041_UN,7.2473793,00000000000000000000000000000000000000000010000000000000000000100100000000010001100101110011010010101100110100010001001011100100110001110110001011011111010010101111010,LXLRVZWWYUUYIB-UHFFFAOYSA-N
CC1=C(SC=N1)C5=NC2=C(C=C(C=N2)NCC3CCCN(C)C3C4=CC=CS4)[NH]5,F51C396D0A4DE584_3CBE8ADAF773877F_6041_UN,8.827709,00000000000000000000000000000000000010100000000100000100000000100100000000010101111101101011010010101100010010010001101011100100110101010110001011011111010110101111010,HSQLQCJIXDTOAH-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC4C(C)(C4)C5=C(C=C(C=C5)F)F,BD5D7D98A84CD676_042CC913FA06FD3A_6041_DP,8.234279,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011001100011100100110101110110001011001111010010101111010,XHWBVYOUFXKUQW-PXIGHNNKSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC3CC4(C3)C5CCC(C4)C5,7167022C479A10C0_B1156323D4EA4002_6041_UN,8.1509,00000000000100000000000000000000000000000010000000000000000000000110000000000000100000010001000010100100110100011000001001000100110001110100001011010011000010101111010,UZHYXGXOHGXFMT-UHFFFAOYSA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=N3)CCC4CCCN(C)C4,551B0D3F653C58EB_4D4074359624D3AB_6034_UN,8.189314,00000000000000000000000000000000000000100000000000000000000000100100000000010100001101100011010010101100110010010001101011100100110000000110001001011001010110101111010,WOMHVOOVGFPDTN-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCCSC2)F)CC3,651E02251070A00B_EE1E14938946AFC1_6041_UN,7.4218073,00000000000000000001000000000000000010000010000000000000000000000000000000010001101001111011010000101000000110010001101011100000110001110110001011011011010110101111010,KRTFZGWVHBCCMA-UHFFFAOYSA-N
N1CC[C@@H]2CN(CC[C@H]12)C3=NC(=CN=C3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,E33FB9A4AA8880E3_2E78EC64A703373D_6041_DP,9.260275,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101100110110010001101011100100110101110110001011011011010010101111010,WUDVYLNFSAGHBV-LRYKZCBQSA-N
O(C3CCN(CC1CCCC2=C1C=CC=C2)CC3)CC4=NC(=C(S4)C(C)(C)C)C,64748C41B1E23BCA_D16A41301D78D969_6039_UN,8.033826,00000000000000000000000000000000000010000000000100000000000000000110000000110000010101101000000111101100010011011000001011100111110010000110011111011110110111101111110,UUIAFCZUEMLUKC-UHFFFAOYSA-N
N3CCC2(CC(OCCC1CCN(C)CC1)CO2)CC3,788CC0C0D1FDE285_338BD9801B33A2D0_6039_DP,7.4322543,00000000000000000000000000000000000000000000000000000000010000000010000010010000001101100101010011101000110001011001101011100011110010000110001101011001110101111101110,GQJMPHQWLZGRRI-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=NC=C1)NCC2CC3(C2)CC3,284389B151336958_ECDA1A9788ABB465_6041_UN,7.7168136,00000000000100000100101000000010000000100000000000000000000000000110000000100100001000100010010000101000010000001000000001000000110001010100011000011101010110101111010,WTDCSOLQWJHVPR-UHFFFAOYSA-N
CC1=C(C=CC=C1F)NCC2C(CCCC2)N3CCCC3,4891E9B99A04B019_74A56B643F721523_6041_UN,8.176039,00000000000000000000000000000000000000000010000000000000000000100000000000010000101101110011000010001000000110010000001001100000110001110110001011011011010110101111010,INGSSZSLGZUZFV-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC2C(CCCC2)N3CCCC3,08617C3BE7EEC0EC_A50E60CF29AEEB01_7022_UN,8.176033,00000000000000000000000000000000000000000000000000000000000000100000000000010000101101110011000010001001000110010000001001100000110001110110001011011011010110101111010,IGANMXHJXXZUFF-UHFFFAOYSA-N
CC1=C(C=CC=C1Br)NCC2C(CCCC2)N3CCCC3,8CDEE9E36C638755_790D32D380E07F33_7022_UN,8.17603,00000000000000000000000000000000000000000000001000000000000000100000000000010000101101110011000010001000000110010000001001100000110001110110001011011011010110101111010,WDFWGFGTAOLSTP-UHFFFAOYSA-N
CCC1=C(C=CC(=C1)F)NCC2CC3(C2)C4CCC(C3)C4,C2EEC8CF2A71EDAF_FBD5D41608B97216_6041_UN,7.713052,00000000000100000000000000000000000000000010000000000000000000000010000000000000001000010010000010001000010100001010001000000000110001110000000011010011010110101111010,LNODYVNWVXNSJM-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CCCC2CCCC2)C=CC(=C3)Br)C4,2651CA9FCF2FA698_1A355209D45C4235_6034_UN,7.4905863,00000000000000000000000000000000000000000000001000000000000000000110000000110000000101010000000010001100010100011001101001100100110000100100000011011100010110101111010,SKGCGSYZOMUHJG-UHFFFAOYSA-N
C1(=CC3=C2C(=C1)CCC(N2CCC3)=O)NC4=CC=CC5=C4C=C[N]5C,8B65B7A7B1A7396E_C1431E880A7C65B2_6041_UN,8.991442,00000000000000000000000000000000000000000000000000000000000000000100000000010000100101000001110010101100010000110000011011100101110011010100001111011001011010101111110,YSMMCRBASYEFMD-UHFFFAOYSA-N
N(C1=CC=C(C=C1)C24CC3CC(CC(C2)C3)C4)C(C5=C(C)C6=C([NH]5)C=C(C=C6F)F)=O,339B47069558A4DD_61DA5964ABD7D03B_6038_UN,7.6553707,00000000000000000000000000000000000000000010000000000010000000100110000000000001000100010000100110000100010100101000010001000100100101110100001011000011001010101111110,WQTVNNZWELJQHC-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NCC3(CCCO3)C4CC4)C,66CE9542F05AC12C_AF23140F2F0B2D58_6041_UN,7.781139,00000000000000000000001000000000000000000010000000000000010000100110000000000000101100010011000110101100010111001000001011000100110011110110001011010111110111101111110,VCFLGBBXUGHSLX-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=C2C3CC3)CC(CC)C4=CC5=C(C=C4)CCCC5,278EDDD7FC9777D5_FB038726A25AC23F_6034_UN,8.068919,00000000000000000000001000000000000000000000001000000000000000100100000000010000000101010000000010001100010100000010101001100100110000100100000011011000010110101111010,UWMUHJAZTNDWNL-UHFFFAOYSA-N
N(CC23CC1CC(CC(C1)O2)C3)[S](C5=CC4=C(N=C(Cl)C=C4)C(=C5)Cl)(=O)=O,900D72DC16380EEF_8E17CEA0B2AAB395_6029_UN,7.8996534,00000000000000000000000000000000110000000000000000010001011111001111010001000000011000011010001100101111011100001000010011001100101010101100001001101001110111110111110,ZYVWUBQOFFUQHN-UHFFFAOYSA-N
CCC2=C1N(C=C(C1=CC=C2)C3=CCNCC3)CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,DB57C74A41E9BF88_53CE558C4539F9D2_6034_UN,8.139735,00000000000000000000000000000000000000000000000000100000000000100100000000011001001101110001000010111101110110010010101011100100110100100110001011011111010110101111010,SMXLVOKIVWDAON-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4CCOC(C4)C5=CC(=CC=C5)F,3AACEC5B9668CB68_1A6AEABF7E1D5E2B_6041_DP,8.214683,00000000000000000000001000000000000000100010000000000000010000100100000000000101101101110011010011101000110111010000001011100100110111110110001001011001110011101111110,PGZLGJCCAMDDHK-WHWMZARZSA-N
CC1=C(C=C(C(=C1)NCC2(CC)CCCCC2)Cl)C3CC3,67CBF43AD11BD8AB_0627FE079C092993_7022_UN,7.310709,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010011000000001001000110001010101000000000110001110000000011010111010110101111010,LCYACPIRJMWFKP-UHFFFAOYSA-N
N3C[C@@H](OC1=C(C=C(C=C1Cl)C#N)Cl)[C@H](CC2=CC=CC=C2)C3,D63E7631CBCE2FF7_65E705C5C033A846_6003_DP,8.019851,00000000000000000000000000000000000000000100000000000000000000000000000000000000001100110011000111001001000100000100000001000111110010100110001111000011110101100111110,IIIIXNWXLFWSLO-RHSMWYFYSA-N
N3C[C@@H](OC1=C(C=C(C=C1F)C#N)Br)[C@H](CC2=CC=CC=C2)C3,AF2A8C3F68779D6F_9F5D5AF1013CA694_6035_DP,8.01985,00000000000000000000000000000000000000000110001000000000000000000000000000000000001100110011000111001000000100000100000001000111110010100110001111000011110101100111110,BSILAMRDUPEJED-RHSMWYFYSA-N
N3C[C@@H](OC1=C(C=C(C=C1Br)C#N)Br)[C@H](CC2=CC=CC=C2)C3,4AFB97BB7051AFF4_658EA5812A513E2C_6035_DP,8.019846,00000000000000000000000000000000000000000100001000000000000000000000000000000000001100110011000111001000000100000100000001000111110010100110001111000011110101100111110,WRHPORXYGOULIV-RHSMWYFYSA-N
C1(=CC=C(C=C1)C2(CC2)C#N)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F,9330DA16248EECAE_E7E6F82A6A0F4621_6041_DP,7.6808414,00000000000000000000001000000000000000000110000000000010000000100010000000000001001000110011000000101000100100011000001001000100110101110110001011010011010010100111010,VTBZYMGBLBWXJQ-YLJYHZDGSA-N
CN(C)CC1=C(C=CC(=C1)NC2C3(C2)CCCCC3)F,CAAC194FC5F9380C_E08126D4FD91089F_7022_UN,7.511844,00000000000000000000001000000000000000000010000000000000000000000010000000100000000001110011010000001000110100011001001000100000110001110000001011011111010110101111010,OTSLGSXJEBEQDI-UHFFFAOYSA-N
N3C[C@@H](OC1=C(C=C(C=C1Cl)C#N)Br)[C@H](CC2=CC=CC=C2)C3,7DAEA471B1AEC62B_DD064837B7631C35_6035_DP,8.019836,00000000000000000000000000000000000000000100001000000000000000000000000000000000001100110011000111001001000100000100000001000111110010100110001111000011110101100111110,UZBKQZHNJTWQTE-RHSMWYFYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3C4(CCNC3)CCC4,3C8B17DE5F051C0A_4CBE5863B3A358B7_6041_DP,7.4703965,00000000000100000000000000000000000000100010000000000100000000000110000000000100101000110011000000101100110110011000001011000100110101110110001011010111010110101111010,RNFMRRCXIHVILW-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NC[CH]4C[C]3(C[C](C)(C3)C)C4,4B4F2B133C2CE796_07FE74ABC3D7326E_6041_UN,7.8857307,00000000000100000000000000000000000000000010000000000000000000000110000000100000101000010010000000101100010110001001000001000100100001110100011011000111010110101111010,SNWZXZRJMMZQCG-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC4C[C@H]3CCC[C@H](N3C)C4)F,3A28C22A72890CAE_4D9550C1E6472735_6041_DP,6.9892364,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001010011010000101100110110010000101011100000110101110100001011011011010010101111010,CJXPJPALQSPBTG-GOOCMWNKSA-N
CCNC4CCC1=C(C3=C(N1CC(C)C2CCCCN2)C=CC(=C3)Cl)C4,C0C4EDF39A3BD17E_09C0E97089954F5B_6034_UN,7.8982835,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101010011000010101101110110010011101011100100110101100110001011011101010110101111010,GCKTTXDTVILZKN-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(=O)CC3=C(C(=CC=C3)Cl)Cl,EAAF4BCFD8582F48_063A6DF7673901D7_6038_UN,7.323464,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010001100010001001110100110000011000000000110010100000000011010011011110100111110,QQPKXISRMCNNMO-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(=O)CC3=C(C(=CC=C3)Br)F,B35EBFBC550F2D04_FA48908D55B3E3DB_6038_UN,7.323458,00000000000000000000000000000000000000000010001000000000000000000000000000000000001000010001100010001000110100110000011000000000110010100000000011010011011110100111110,PDHZNXFTJIEMCB-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(=O)CC3=C(C(=CC=C3)Cl)F,E9DCACBF808E05BF_C8AE1EE41C14A63A_6038_UN,7.3234577,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010001100010001001110100110000011000000000110010100000000011010011011110100111110,UDGJAAJWZSMLNL-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC(C)CC2CCOC2)F)CC3,18828F39723F4ADD_F3DA4D3E23026569_6041_UN,7.415312,00000000000000000001000000000000000000000010000000000000010000000000000000010001100101110001010010001000100111010001101011100000110011110110001010011111010111101111110,QSPYGCBBXBCDLW-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4C(C)(C4)C5=CC(=C(C=C5)F)F,73C2E16FCD564F3D_57B37AC9FA9D3640_6041_DP,8.349085,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011001100011100100110101110110001011001111010010101111010,JMZDOJLNSXHRJZ-PXIGHNNKSA-N
N(CCC1CC2CCC1C2)C(=O)CC3=C(C(=CC=C3)F)F,77AADD5390D3B6A8_118B0531579DAC2B_6038_UN,7.3234515,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010001100010001000110100110000011000000000110010100000000011010011011110100111110,MJSBKXFTHCDMBN-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[NH]C3=C2CCCCCC3)NCC4(CN(C)C)CCC4,EAF2E33AFEE304BB_44EACFFE362CADBD_6041_UN,6.988223,00000000000100000000000000000000000000000000000000000000000000000110000000100000101101100011010010001100110010011001001001100100110101010110001010011101010110101111010,ITTUEPXMIXGDKG-UHFFFAOYSA-N
FC2=C(C(=C1N(C=C(C(C1=C2)=O)C#N)C[C@@H]3CNCC[C@H]3C4=CC=CC=C4)F)F,03473E4A323A5E83_ED3B6FF6EFBEC231_6034_UN,8.015962,00000000000000000000000000000000000000000110000000000000000000100100000000010000101001110011000001101100110100010100001011100101110000100110001111011011111110100111110,VCEMMDQGSNHBMK-HOTGVXAUSA-N
CC1=CC(=C(C=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)F,DD3F31EE8C9207B6_D5A7E405408AE401_6041_UN,8.027334,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011111010110101111010,BJJPNEFJKAGYOX-QRWLVFNGSA-N
FC1=CC2=C(C=C1)C3=C([NH]2)N=CN=C3NC5C[C@H]4CCC[C@H](N4C)C5,4278241D222A2D23_1212F1D831988930_6041_UN,8.400877,00000000000000000000000000000000000000100010000000000100000000000100000000010100100101010001010010100100110110010000101011100100110101110100001001011001000010101111010,UTRAZTFHILHTBO-AGUYFDCRSA-N
CC1=CC(=C(C=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)Cl,2F6F3F0163FF3279_35EC1623C2DE4E32_7022_UN,8.027325,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011111010110101111010,OXTCCEQJNYZELI-QRWLVFNGSA-N
O(C1CCOC2=C1C=CC=C2Cl)C3=C(C4=C(C=C3)[NH]C=C4)[N](=O)=O,FE7BEFE3C0406BA9_A17F0358A4B0F8A6_6035_UN,8.671494,00000000000000000000000010000000000000000000000001000000110000010100001100000000100100010100001110100111010101000100001111101111001011110100101111111011110011110111110,WYIHAHPBSOVZQB-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NC2CCN(C)C23CCCNC3)C=NC=C4,D670270A3F1311EC_B35C54E4C96201E9_6041_DP,8.475938,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,IQUXWQAEVQWSJF-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)NCC2C3(CCNC2)CCOC3)C#N,A1241BB077166069_BBA7F70F678E3EBA_6041_DP,8.130903,00000000000000000000000000000000000000000110000000000100010000000010000000000000101100110011000010101000110101011000001011000000110111110110001011010011010111101111110,QAJBKNXZFYZWRF-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C3(CC2)CCOCC3)Cl)C4CC4,6C929BA1B3752B65_570482998913D2D6_7022_UN,7.296638,00000000000100000000001000000000000000000000000000000000010000100010000000000000001000110011000000101001010111001000001000000000110011110110000011010011010111101111110,SXRZHQPTDODKAI-UHFFFAOYSA-N
CCC(OC1=CC=C(C=C1)C[C@@H]2COCCN2)C4=C3OCCC3=CC(=C4)Cl,A8B960B1A0305D35_76E6A150DA8C741A_6035_UN,7.5257225,00000000000000000000000000000000000000000000000000000000010000000000000000000000001100110101000110101101110101010110001011000111110010100110000111110001110111111111110,LDPZUOKECHANMA-ITUIMRKVSA-N
COC1(COC1)C2=CC=C(C=C2)N[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,9D3F80E124FC21EE_A45A09E63BD6C365_6041_UN,7.600625,00000000100100000000000000000000000000000010000000000000010000100010000010000000000100110011010111000000100101011000101010000111000011110110000111110011110011111111110,CAIXJPUZZNPTSP-MOPGFXCFSA-N
CCN5CCC1=C(C(=CC(=C1)NCC3(CC2(CNC2)C3)C4=CC=CC=C4)F)C5,F957D5C6AC9436EE_07308B8B83E7D0E4_6041_DP,7.811898,00000000100100000000000000000000000000000010000000000000000000100010000000010000001001110011000000101100010110011010101011100100110101110110001011011001010110101111010,YKVDKDHSPWROMV-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2=N[NH]C=C2NC3CCN(C)C34CCCNC4,CDC47806500314F9_E3F2A4889DB7A498_6041_DP,7.9297285,00000000000000000000000000000000000000000010000000001110000000100110010000010001101101110011011010101000110110011001101011101100110101110110001011011011010010101111010,DBUFGEONJXQXHR-UHFFFAOYSA-N
COC1(COC1)C2=CC=C(C=C2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,51BF68759E44B6BC_7E82B6D0039FDC01_6041_UN,7.987852,00000000100100000000000000000000000000000000000000001000010000100110000010010000101101100001011110101000000011011001101011101111110011010110011101111111110111111111110,KXFIWXZFDCUSBQ-OALUTQOASA-N
FC1=C(C=C(C=C1)NCC3(C)CC2CC2C3)C4OCCO4,E97364A2D5176648_06382C0FC98971EC_6041_UN,7.9714975,00000000000000000000001000000000000000000010000000000000010000100010000010000000001100010010000010001000010111001001001010010000110011110110000011010011010111111111110,WPDOFMCSEQTNAC-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC3CC4(CC3)CCCCC4,C2FC3E2CF5014048_94BEC240B1FBDBFB_6041_UN,7.7229757,00000000000000000000000000000000000000000010000000000000000000000110000000100000100000010011000010100100110100011000001001000100110001110100011011010111000010101111010,HPJUBKJMIRHWKA-UHFFFAOYSA-N
NCCC(OC1=CC=C(C=C1)C2CNCC2)C3=CC=C(C=C3)Br,83DDD3B2E98F53E1_02258AE2F4A5EA29_6035_UN,8.231888,00000000000000000000000000000000000000000000001000000000000000100000000000000000001110110011000011001000100100010100001001000111010110100110001101010001110101100111110,NJUUKZAUPUSZRO-UHFFFAOYSA-N
N(CC1C2CC(CC1)OC2)C(C3=C(CC)[N](N=C3)C4=CC=C(C=C4)F)=O,98A71AAE4DCA2778_7211FB5896E0BDAE_6038_UN,8.032991,00000000000000000001000000000000000000000010000000001000010000100100000000010000101100010011101011001000010101110010011011101100110011110110001011011011111111111111110,AOPPZDDDWPMHNH-UHFFFAOYSA-N
FC1=C(C=CC=N1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,8FE4D5D750AB75A7_C77AF3A8ECE3716A_6041_UN,8.036427,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,KZWKDCRYWWWMJE-DYVFJYSZSA-N
CCN4CCC1=C(C(=CC(=C1)NC(C)[CH]2C[C]3(C2)C[CH2]C3)F)C4,8E3BBAD31EE5DEFE_70547B260E1F5683_6041_UN,7.11261,00000000000100000000000000000000000000000010000000000000000000000010000000010000000001110011000000101100010110011010101001100000110001110110001011011101010110101111010,ALKLNNCYDZXRQL-UHFFFAOYSA-N
CC4=CC1=C(C=C(C=N1)NC2CCN(C)C23CCCNC3)[NH]4,8BB635657B9EFB58_492F64933E1B492D_6041_DP,7.8051176,00000000000000000000000000000000000000000000000000000100000000000110000000010001101101100011010010101100110010011001101011100100110101010110001001011101010010101111010,JLUGIXAMMFRHRV-UHFFFAOYSA-N
C[N]1N=C(N=C1NCC2(CCCCC2)C3=CC(=CC=C3)F)C4CCOCC4,ED9B2921C24CA955_E9F4FB7A72AFA308_6041_UN,7.9160967,00000000000000000000000001000000000000100010000000001000010000100110000000010101101100110011011010101000001111001000001011101100110011110110001011011011010111101111110,CEHXJXALBSWWLI-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(C3=C(C)N=C4C(=C3)C=CC=C4F)=O,1DF292026775AA4B_F5722F71E5500CC1_6038_UN,8.035258,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010011100011101100010100100000011001000100110000100100001011010011011110101111110,ZRMWCMSIZYFYPS-UHFFFAOYSA-N
N3C[C@@H](OC1=NC(=C(C=C1C#N)Br)C)[C@H](CC2=CC=CC=C2)C3,E4A42B7AAA3CFD1B_7A27EE3420C37968_6035_DP,7.340099,00000000000000000000000000000000000000000100001000000000000000000100000000000000101100110011100111101000000100100100010011000111110010100110001111000011110111101111110,FMAYHSQLWZLKIV-NVXWUHKLSA-N
FC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCCC3)C[C@H]5N[C@H]4CCO[C@H]4C5,2BCE14C3F556FB57_840E1C8E52273C90_6034_UN,8.404081,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101010011000111101100110101010000001011100100110110100110001011011011110111100111110,JZAGNVJZGVPYIW-SPYBRQBASA-N
FC1=C(C(=CC=C1)NCCC3CCN(C2CCN(C)CC2)CC3)C=C,755D61759AFCCFA4_7E6CB65454A90129_6041_UN,7.9805956,00000000000000000000000000000000001000000010000000000000000000100000000000010000101001110001010000111000100100010001101011100000110001110110001011011011010110101111010,JDVZBJZICQTPMD-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C(=N2)C3=NC=CC=C3)C[C@]45[C@](C)(C4)CNC5,A784F1028332B623_BC10F755E6D49AB2_6034_UN,8.319821,00000000000000000000001000000000000000100000001000000000000000100110000000010101101101110011000010101100010110001001100011100100110000100110001011001011010110101111010,FWAOHNRNHKDWPV-MOPGFXCFSA-N
CCN4CCC1=C(C(=CC(=C1)NCC(C2=CC=C(C)C=C2)N3CCCC3)F)C4,717740DA448B09F0_3D5237D83187A101_6041_UN,8.232044,00000000000000000000000000000000000000000010000000000000000000000000000000010001001101110001000010101100010110010010101011100100110001110110001011011101010110101111010,XBSJCURBSPUMBM-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CC2CCOCC2CC3)F)CC4,8531BBA58FAF6904_8BCEE425B0315319_6041_UN,7.501563,00000000000000000001000000000000000000000010000000000000010000000000000000010001100001110011010000101100110111010001101011100000110011110110001011011011010111101111110,RNOOLLBJOOLKNN-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2CC3=C[N](N=C3[C@H]4CC[C@@H](C)O4)C)C5CCNCC5)F,97F9FAF8D939A1C8_550B20D1DCE89540_6034_UN,8.589093,00000000000000000000000000000000000000100010000000001000010000100100000000010101101101110001011111101000100110010001101011101100110010100110001011011111110111101111110,SOQXOTQQZDHDAP-IVZQSRNASA-N
N1CC2CCCC1C2C=CC3=C(CC)OC4=C3C=CC=C4,AF1C9B251E6FC675_827C3AFC267ACD07_7019_DP,9.014423,00000000000000000001000000000000000000000000000000000000010000000000000000000000001100000011000010011100110000010010001011000100110010000100000011010011110110101111110,UXXJDDBWIDOANM-UHFFFAOYSA-N
NCCC1=C[N](C2=C1C=C(C=C2F)Cl)CC3(CCNCC3)NCC4CC4,21DE19D2ABE33A3B_179BB61C381A14A7_6034_DP,8.161252,00000000000000000000001000000000000000000010000000000100000000000110000000010001101111110011000010101101110100011000001011100100110101100110001001011001010110100111010,CPFWTVXMMMHRHC-UHFFFAOYSA-N
NCCC1=CN(C2=C1C=C(C=C2F)Cl)CC3(CCNCC3)NCC4CC4,21DE19D2ABE33A3B_E1A49B47E797A37C_6034_UN,8.161238,00000000000000000000001000000000000000000010000000000100000000000110000000010001101111110011000010101101110100011000001011100100110101100110001001011001010110100111010,CPFWTVXMMMHRHC-UHFFFAOYSA-N
NCCC(OC1=C2C(=CC=C1)OCCNC2)C3=CC=C(C=C3)Br,C7E00C04E744F424_B0CAAA8B8AFE6861_6035_UN,7.9398603,00000000000000000001000000000000000000000000001000000000010000000000000000000000001010110100000101001100110101010100001011000111110110100110001111010001110101110111110,VULVHSSEBAWTTO-UHFFFAOYSA-N
NCCC1=CN(C2=C1C=C(C=C2Cl)Cl)CC3(CCNCC3)NCC4CC4,30D9E8E060CF6CA2_6A082DF8554FA50E_6034_UN,8.161242,00000000000000000000001000000000000000000000000000000100000000000110000000010001101111110011000010101101110100011000001011100100110101100110001001011001010110100111010,YSDILNHYMIBZSF-UHFFFAOYSA-N
NCCC1=C[N](C2=C1C=C(C=C2Cl)F)CC3(CCNCC3)NCC4CC4,0779CB7DCA80E35D_EF9B2B1E5B86F19E_6034_DP,8.161234,00000000000000000000001000000000000000000010000000000100000000000110000000010001101111110011000010101101110100011000001011100100110101100110001001011001010110100111010,PMYBVZJSWRPXOY-UHFFFAOYSA-N
NCCC1=C[N](C2=C1C=C(C=C2Cl)Cl)CC3(CCNCC3)NCC4CC4,30D9E8E060CF6CA2_9C3700A38AC212D5_6034_DP,8.161231,00000000000000000000001000000000000000000000000000000100000000000110000000010001101111110011000010101101110100011000001011100100110101100110001001011001010110100111010,YSDILNHYMIBZSF-UHFFFAOYSA-N
NCCC1=CN(C2=C1C=C(C=C2Cl)F)CC3(CCNCC3)NCC4CC4,0779CB7DCA80E35D_19A40645840B4645_6034_UN,8.161231,00000000000000000000001000000000000000000010000000000100000000000110000000010001101111110011000010101101110100011000001011100100110101100110001001011001010110100111010,PMYBVZJSWRPXOY-UHFFFAOYSA-N
CC2=C(C=C1N=C(C(=CC1=C2)C)NCCC3SCCC3)C,229E7482E630D689_B09D1938EA30C195_6041_UN,7.8865204,00000000000000000000000000000000000010100000000000000000000000000100000000000100011100001001000010101100110010010000001011000100110001010110011011010111010110101111010,XWEDCWFKEXBRDZ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)C4OCCO4,6DD7B826F01DFE6D_3C539F9230E8CE46_6041_DP,8.63062,00000000000000000000000000000000000000000010000000000100010000100100000010010101101101110011010010001000000111000000001011110100110111110110001010011011010111111111110,QOELYTRZVSKKDH-SWLSCSKDSA-N
C(=CC1=CC(=CC(=C1)F)F)NCCN(C)C2CCOCC2,58839010ACD2277E_D576D7F1A8783164_7022_UN,7.547219,00000000000000000000000000000000000000000010010000000000010000000000000000000001001001110000010001111000100111010001101000100000110011100110001001011001010111101111110,FUPGFBFSOZYHKK-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NC[C@H]3CCS[C@H](C)C3)C,839C79D09D7AC150_790AE66EEF143A1A_6041_UN,8.124096,00000000000000000000000000000000000010000010000000000000000000000100000000000000111000011011000000101100010110000001101011000100110001110110011011010111010110101111010,GUSSCJOCARNXCY-RISCZKNCSA-N
FC1=CC(=CN=C1)C2=C4C(=CC(=C2)C=CC3CCCCC3CC)OCO4,7F89350143998A5F_39A9CB5285874B71_7019_UN,7.8958926,00000000000000000000000000001000000000000010000000000000010000100100000010000000000100010000000010110100010111000110101011010100110000100100000011010010110101011111110,UZQSLSYUKJDNEN-UHFFFAOYSA-N
CN1C(CCC1)C=CC3=CC=C(C2=C(F)C=CC=N2)O3,89CE0F586BCCC65D_3B9D3009BC05465A_7019_UN,8.678307,00000000000000000000000000000000000000000010000000000000010000100100000000010000000101110000010110111000000110010001101011100100010000100100001010011010110010101111110,FVUUUYXMOMQSMJ-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NCC3(CCNC3)C4CC4)C,367755CD54C78E84_325CC747C6E6DEB7_6041_DP,8.339478,00000000000000000000001000000000000000000010000000000100000000100110000000000000101100110011000010101100110110011000001011000100110101110110001011010111010110101111010,NJNRSYOJVBCDCK-UHFFFAOYSA-N
C1CC(CCN1)C2=CN(C3=C2C=CC=N3)CC(C)(N)CC4=CC=C(C=C4)Br,0FEC7D167A526A47_E5A2ABAE561B2C92_6034_UN,7.3013206,00000000000000000000000000000000000000100000001000000000000000100110000000010101001111110001000010101100110100011001001011100100110100100110001001011001010110101111010,GRYPCUIQCHFEHU-UHFFFAOYSA-N
C1CC(CCN1)C2=CN(C3=C2C=CC=N3)CC(C)(N)CC4=CC=C(C=C4)Cl,D1D5391931FED9A7_1539155B8DDA87C6_6034_UN,7.301298,00000000000000000000000000000000000000100000000000000000000000100110000000010101001111110001000010101101110100011001001011100100110100100110001001011001010110101111010,BKKKDYCTUSWGKD-UHFFFAOYSA-N
CN1CCC(CC1)(C)C=CC2=CC(=C(C=C2)N3CCOCC3)F,E110F48FB64E79D5_D7EA53DDA42424AB_7019_UN,8.2223,00000000000000000000000000000000000000000010000000000000010000100010000000010000000001110000010100111000000101011001101011100000110011110110001011011110010011101111110,CKPKIGWIJCTGBL-UHFFFAOYSA-N
C1CC(CCN1)C2=CN(C3=C2C=CC=N3)CC(C)(N)CC4=CC=C(C=C4)F,EFFA59877B0FB31F_04149BA6413DC1E6_6034_UN,7.30129,00000000000000000000000000000000000000100010000000000000000000100110000000010101001111110001000010101100110100011001001011100100110100100110001001011001010110101111010,YZKYWVHRWKKSAC-UHFFFAOYSA-N
CC1C4CCC(CC1NC(=O)CC2=C[NH]C3=C2C=CC(=C3)F)N4,584EADE386444DF0_0FA6505257234E6E_6038_DP,7.903848,00000000000000000001000000000000000000000010000000000100000000000100000000000000100100010011100010100100110110110000111011000100110111100100001001010011001110101111110,GVFHTTFUXNMFGN-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C3(COCC2)CCCC3)Cl)C4CC4,A33D492B521B880E_5DF55870AFE22311_7022_UN,7.1628757,00000000000000000000001000000000000000000000000000000000010000100010000000000000001000110011000010101001010111001000001000000000110011110110000011010011010111101111110,GWBURQZRYFNYBN-UHFFFAOYSA-N
C[N]1C=CN=C1C2=NC=CC(=C2)NC3C4CC5CC3CC(C4)(F)C5,EE697D2ED0A0A0DB_CE7A2E2F552EFE0B_6041_UN,7.667001,00000000000000000000000000000000000000100010000000000000000000100110000000010101100101010010010010100100010100001000000011100100100001110100001011001011000010101111010,GWVCGAOQMKXZKG-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC3CCC2(COC2)CC3)F,651FA76A81769374_5F3A43025DC06EFC_7022_UN,7.936984,00000000100100000000000000000000000000000010000000000000010000000010000000100000000001110010010000001000110101011001001000100000110001110110001011011111010111101111110,XUODUFDNVZYKHH-UHFFFAOYSA-N
CC1=N[N](C)C2=C1C=CC(=N2)NCC3(CC3)CC4CC4,7C586E4820BC197E_4275B3E61F5E960B_6041_UN,7.5200133,00000000000000000000001000000000000000100000000000001000000000000110000000010101101100000011011010101100010000001000001011101100110001010100001000011101010110101111010,OZLTUPAYQFFBDD-UHFFFAOYSA-N
C1CCC2=C(C1)N(C3=C2C=CC=N3)CC4(C)CC=CC4,ECBB95A9F72960E3_C031F06D239C20ED_6034_UN,8.537103,00000000000000000000000000000000000000100000000000000000000000000110000000010100000101000000000010111100010000011001001011100100110000000100001011011000010110101111010,AVRDOEQZFANVME-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CCCCNC2)F,70BDA5371DF047D3_41383FAB684F0621_7022_DP,7.8484106,00000000000000000001000000000000000000000010000000000100000000000000000000100000101001110011010000001000100100010001001001100000110101110110001010011111010110101111010,AVXCMTIRBXMJSQ-UHFFFAOYSA-N
ClC2=C1C=CC=NC1=C(C=C2)C=CC3=C(C=N[N]3C)C4CCC4,595EF8BE831AAB88_B7844A237ADBAC52_7019_UN,8.364503,00000000000100000000000000000000000000000000000000001000000000100100000000010000100100010000011010110101010100000000001011101100000000100100001011011010000010101111010,AXARYYMQVCSCJJ-UHFFFAOYSA-N
FC2=C1C=CC=NC1=C(C=C2)C=CC3=C(C=N[N]3C)C4CCC4,FB43F3CAE845F31A_51375069C6CBAD76_7019_UN,8.364501,00000000000100000000000000000000000000000010000000001000000000100100000000010000100100010000011010110100010100000000001011101100000000100100001011011010000010101111010,NKZOACINPVFTOP-UHFFFAOYSA-N
CC3(COC1=CC=C(C2=C1CN(C)CC2)F)COCCN3,8B3D24F0E3415957_302E5FA60D00A88B_6035_UN,7.2115684,00000000000000000000000000000000000000000010000000000000010000000010000000010000001001110101010101101100110111011101101011100011110010100110001111011101110111111111110,SMZDHOZXPXTDIS-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NCC2CCN(C(CC)C)C2)C3CC3,AA226198676F1CEA_CC3A8ABBFC6E58C8_6041_UN,8.10948,00000000000000000000001000000000000000000010000000000000000000100000000000010000101101110011000010001000000110010011101001100000110001110110001010011111010110101111010,RJTMBJBSXVXWDV-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N(C3=C2CNCC3)CC5COC4=C(C=C(C=C4)[N](=O)=O)O5,E9DBEA5865C0D997_201F4BCA4FDD34E0_6034_UN,8.641785,00000000000000000000000010000000000000000010000001000000110000010100001110010000101101110001001111101110110101010100001111101100111011110110101011111001110111110111110,ZLZXLWKSTKKVMV-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(C4=N[N](C=C4C)C5=CC=C(C=C5)F)=O,CE278E0FEDBE2387_53304FB864FF844C_6038_UN,8.540667,00000000000000000001001000000000000000000010000000001000000000100100000000010001101100010011101111001000010100100000010011101100110001110100001011001011011110101111110,QZUQQZFXDNQEJJ-UHFFFAOYSA-N
CC(C)CC1=CC(=C(C=C1)NC3CC(C2=CC=N[N]2C)OCC3)F,FE36908FBA7AEBA3_E871A2676C8FDC7C_7022_UN,8.184268,00000000000000000000000000000000000000000010000000001000010000100100000000110000100100010010011111100000100111010001001011101100110011110100011011011111110111101111110,AKWWBSIJXXAASY-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2C=CC(=CC2=CC=N3)Br)C4,D32E3A4918E85029_8827C81D112EC291_6035_UN,8.311504,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000110011101100010100100101011001100111110000100100001101011110110111101111110,MXESRDSBHWGDPQ-BAGBSZHRSA-N
C[N]1N=C(N=C1NCC3=CC(=C(N2CCNCC2)C=C3)F)C4CCOCC4,A3181636BB8EF703_22C48C6EC8B779C9_6041_DP,7.761311,00000000000000000000000001000000000000100010000000001000010000100100000000010101101101110001011010101000101111010000001011101100110111110110001011011011010111101111110,TYXOJGVIDQONGS-UHFFFAOYSA-N
CC(C)(C)C2=CC1=C(C=CC(=C1)F)N2CC3CCCN3CC4CCCN4,71F52C4A969DF58F_A8139EA708019855_6034_UN,7.8673644,00000000000000000000000000000000000000000010000000000000000000000110000000110001001101110011000010001100110110011000001011100100110000100110011010011111010110101111010,OXMLNEHQFUGOHO-UHFFFAOYSA-N
C[C@@H]4CC1=C(C=C(C(=N1)N[C@H]2[C@H](CC2)C3=C(C=C(C=C3)F)F)C#N)[C@H](C)O4,7056EC8B528AB09D_49CC7502AAAB2416_6041_UN,7.3725204,00000000000100000000000000000000000000100110000000000000010000100100000000000100100000010011000001100100110110010001001011000100000011110100001011010111100011101111110,NDTJLYNBKIRLGH-FIXGWNCBSA-N
N(CC1C2CCC(C1)CC2)C(=O)CC3=COC4=C3C=CC(=C4F)F,AE107506BC4C5739_2E9F6721CFDDC05B_6038_UN,7.814937,00000000000000000000000000000000000000000010000000000000010000000000000000000000001100010011100010001100110100110000011000000100110010100100000011010011111110110111110,CFRLLBWUIAAVAY-UHFFFAOYSA-N
N(CC1C2CCC(C1)CC2)C(=O)CC3=COC4=C3C=CC(=C4Cl)Cl,AE3313D26E4C0E16_68B8D5503DB58313_6038_UN,7.814928,00000000000000000000000000000000000000000000000000000000010000000000000000000000001100010011100010001101110100110000011000000100110010100100000011010011111110110111110,OXNNFWXHWWVOIS-UHFFFAOYSA-N
N(CC1C2CCC(C1)CC2)C(C3=C(CC)[N](N=C3)C4=CC=C(C=C4)F)=O,6A3BD169D8D45F6B_C36B957BC0756666_6038_UN,8.228261,00000000000000000000000000000000000000000010000000001000000000100100000000010000101100010011101011001000010100110010011011101100110001110100001011011011011110101111110,GLOLFIIRGVQQAO-UHFFFAOYSA-N
C1(=C2C(=NC=C1)[NH]C=C2C3CC3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,D9CD7B53BDBFC4EE_4BA43854B4BEB464_6041_UN,8.299092,00000000000000000000001000000000000000100010000000000100000000100100000000010101100101110011010010101100110110010001101011100100000101110100001001011011010010101111010,CNJNHFDKPDEXLR-QUCCMNQESA-N
C1(=NC(=CC=C1)C2OCCO2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,F234BFB79AEA0ED2_15E09DC903A7AAEE_6041_UN,7.652498,00000000000000000000000000000000000000100010000000000000010000100100000010010101000101110000010110101000000101010001101011110100110011110110001011011011010111111111110,VIENXWHYRSGESI-UHFFFAOYSA-N
C[C]4(C)C[C]3(C[CH](C=CC1=C[N](C)N=C1C2=C(C=C(C=C2)F)F)C3)C4,3E40E9FD706EC07B_98705BE45D409C4C_7019_UN,8.140117,00000000000100000000000000000000000000000010000000001000000000100110000000110000100100010000011010010000010110001001000011101100100000100100011010001110000010101111010,HZOXPWUZLLIOOW-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2(C)CCC3(CC2)CC3,D96C04454B55733A_A979C7CDDD9E63E3_6041_UN,7.3692055,00000000000000000000101000000010000000000000000000000000000000000110000000100001001000100011010000101000010000001001101001000000110001010100011011011111010110101111010,ZEVVBEDWQOWQFB-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC34CC(CC)(C3)CO4,F009518664E6FAF9_5F6C642FA0A731BB_6041_UN,7.8041835,00000000000100000000000000000000000000100000000000001000010000100110000000010101101101000011011110001000010011001010100011101100110011010110011010001111110111101111110,KNLUMWPDRICJAV-UHFFFAOYSA-N
N(CCC1=C[NH]C2=C1C(=CC(=C2)F)F)C(C34CCC(C)(C3)CO4)=O,D3390E4B3DE818F2_E6D52B1A049160A7_6038_UN,8.306943,00000000000000000000000000000000000000000010000000000000010000000110000010000000001100010011100110101100110111111001111011000100110110100110001001010001111111111111110,LVCXRFTWPKDKJJ-UHFFFAOYSA-N
N(CC2=NC1=C(C=CC=C1F)O2)C(C34CC(CNC3)C4)=O,4BB571957440D1CA_A5BBD983E52AE2A3_6038_DP,8.012451,00000000000100000000000000000000000000000010000000000100010000000110000000000001101100110010100111101100010100111000010011000100100110100110001001000001111110110111110,NARUWEURXBJLRP-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NCC2(CCCOC2)N3CCOCC3,48D886B005BD5E18_32F67565D25EF2AE_7022_UN,8.73222,00000000000000000000000000000000000000000010010000000000010000100010000000010001001001110011000101111000000101011000001011100000110011100110001001011001010111110111110,GRNMCWHOWLQCQL-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NCC3N(C)CC4(CC3)CC4)C,1AD240E2F4A6F4E5_BDE41AD0F9AD6A0F_6041_UN,7.6242766,00000000000000000000001000000000000000000010000000000000000000000110000000010001101001110011010000101100010110011001101011100100110001110110011011011111010110101111010,ZKVKKGDPKBQXPJ-UHFFFAOYSA-N
C1(=C[N](N=C1)C2CCCCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,95B7A215899AFE9B_2D821F7D14C2E8CE_6041_UN,8.456636,00000000000000000000000000000000000000000010000000001000000000100100000000010001100101110011011010001000100110010001101011101100110001110100001011011011010010101111010,MJZMJEBWIBRLRJ-UXHICEINSA-N
CN(C)CC1=CC(=CC=C1)NCC2(CCNCC2)C3=C(C=NC=C3)F,7CB931E816F7256D_82013187791F0E59_7022_DP,7.838993,00000000000000000000000000000000000000000010000000000000000000100110000000100000001001110011010000101000100100011001001011100100110101110110001011011111010110101111010,HUGVVBPWYBMRLJ-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(C(C)(C3)C)C4=C(C=C(C=C4)F)F,BAAD3BD558314DA3_914FD849E758BF7E_6041_UN,8.654136,00000000000000000000001000000000000000000010000000001000000000100110000000110001101100010011011010001000000110001001100011101100010001110100011010011111010110101111010,SQIBMTPVLWPKAU-UHFFFAOYSA-N
FC1=CC5=C(C(=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)[NH]C=C5,F895CF7897D7D053_137EC1F4CA1500C5_6041_UN,8.224928,00000000000000000000001000000000000000000010000000001010000000100100000000010001101101010011011010101100010100010000001011101100110101110110001011011011010110101111010,IAOIJUUQEKFUTD-VFNWGFHPSA-N
FC1=CC2=C(C(=C1)F)C(=C(C#N)C=N2)NCC34CC(C)(CC3)CO4,761F7A73DB3B424D_39F6CE126EEB8668_6041_UN,7.6361356,00000000000000000000000000000000000000000110000000000000010000000110000000000000101100010011000110101100010111001001101011000100110011110110001011010011110111101111110,JJNCFVKKBWKQEK-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(COC3)C4=C(C=CC=C4)F,EFDFBE7E979074A1_530E43665CF92CD0_6041_UN,7.788011,00000000100100000000001000000000000000000010000000001000010000100110000000010001100100110001011110000000100101011000000011101100000001110110001010011011010011101111110,WKAARHLJOBHFGX-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2(CC)CCOCC2)F)CC3,A101690FB3C6246F_2EB590AE6C3A118D_6041_UN,7.2074413,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110010010001101000100111011011101011100000110011110110001011011111010111101111110,NCKMIWOQILEZTF-UHFFFAOYSA-N
CC1=C(C=CC=C1Br)NCC3(C)CCOC2(CCC2)C3,2D07BE891A63521A_A713B81B70F7D231_7022_UN,7.7165756,00000000000100000000000000000000000000000000001000000000010000000010000000000000001000010011000000101000010111001001101000000000110011110110000011010111110111101111110,JJDUGWMFAKNVFJ-UHFFFAOYSA-N
CC1=C(C=CC=C1F)NCC3(C)CCOC2(CCC2)C3,651D65E8AB4FFBE5_95313D358568221B_6041_UN,7.716571,00000000000100000000000000000000000000000010000000000000010000000010000000000000001000010011000000101000010111001001101000000000110011110110000011010111110111101111110,QKSKVCUZOCCNLI-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC3(C)CCOC2(CCC2)C3,F1DC737F637DB7EE_7B10EA07D9B94603_7022_UN,7.7165737,00000000000100000000000000000000000000000000000000000000010000000010000000000000001000010011000000101001010111001001101000000000110011110110000011010111110111101111110,BFQQELVHNZAJMW-UHFFFAOYSA-N
CN4CCC1=C(C=CC=C1NC2=C(C)[N](N=C2)C3CCOC3)C4,36261BEB4D694733_3B8A505D107FD528_6041_UN,7.6354475,00000000000000000000000000000000000000000000000000001000010000100100000000010001100101100011011111101100010011010001101011101100110011010110001011011111010011101111110,OOHRLUMOTJQGQD-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@@]23[C@@H](CCC2)OCC3)F)CC4,F726C256F31F8A92_25779EAE9BE2153F_6041_UN,7.2774053,00000000000000000001000000000000000000000010000000000000010000000010000000010001100101110011010111001100110111011001101011100000110011110110001010011011110111101111110,LTHONWDSCSZFKI-UXHICEINSA-N
CC2=C1N=C(C=C(C1=CC=C2)C)NCC34OC(C)(C)C(C3)C4,DA9BCEC8B736F385_F8E5D446D58CEE0E_6041_UN,7.146482,00000000000100000000000000000000000000100000000000000000010000000110000000100100001100000010000110101100010010001000100011000100100011010100011001000101110111101111110,NCHMJVHFLARZCB-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CC(C)CC2=CC=N[N]2C)C=CC(=C3)Cl)C4,1BEA1E6DCB5230EE_A9ECAE3CF7D9D3D6_6034_UN,8.169368,00000000000000000000000000000000000000000000000000001000000000000100000000010000101101010010011010001101110110010011101011101100110001100110011011011111010110101111010,WQYHEYXURNVQPE-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC34CC(CNC3)(F)C4,639871AC406EE672_2657CB7C7E503DE8_6041_DP,7.6386976,00000000000100000000000000000000000000100010000000000100000000100110000000010100101101110010010010101000010110011001101011100000110101110110001001011011010110101111010,ASHIUXYHOQKJOL-OOHWJJMZSA-N
N1C2CCCC(C1)C2CNC(=O)C[N]3C=CC4=C3C=CC(=C4)F,689535B610E29786_907E5046131F9B84_6038_DP,7.8714123,00000000000000000001000000000000000000000010000000000100000000000100000000010001101101010011100110001100110100110000011011100100110110100110001001011001011110100111110,HJFALVAKGAKROU-UHFFFAOYSA-N
N4C[C@@H]1COC[C@]1(C=CC3=CC(=C(N2CCN(C)CC2)C=C3)F)C4,7B54C6544CA86436_115133033E582F6D_7019_DP,7.3514624,00000000000000000000000000000000000000000010000000000000010000100010000000010001001101110011010011111100010101011001101011100000110001110110001011011011010011101111110,OAOZGTFNCXKKSL-APWZRJJASA-N
C1(=CC=C(C=C1)CN2CCCCC2)NC3=C[N](C[Si](C)(C)C)N=C3,1A67630F73043D51_459EA880474A190D_6041_UN,7.35491,00000000000000000000100000001010000000000000000000001000000000000100000000110001100101100001011010101000000000011001001011101100110001010110011001011101010110101111010,AWJUEMPFQBCYPO-UHFFFAOYSA-N
O(C3CCN(CC1CCCC2=C1C=CC=C2)CC3)CC4=CC(=NS4)C,AF3221A33F314ED4_7A5E40BDAF6709D4_6039_UN,8.215138,00000000000000000000000000000000110010000000000000000000000000000101000000010000010101101000001011101100010011010000001011101111110010000110001111011000110111101111110,CMFNYPYKLSJSBA-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)C3(CCC3)C4=C(C(=CC=C4)Cl)F,1C3F5C387F3C1F0D_B455ABF8ADECEFAB_6038_UN,7.5667567,00000000000100000000000000000000000000000010000000000000000000100010000000010000101001110011110000101001010110111001111001100000110000100110001011011011011110101111110,HROMDLNPCWZBAP-UHFFFAOYSA-N
N4CC1=C(C=C(C=C1)NCC2=CC(=C(C=C2)F)CN(C)C)C3(CC3)C4,182EAA15D740D8F2_E0E4B997C797BDC9_6041_DP,7.3370624,00000000000000000000001000000000000000000010000000000000000000000010000000100000001001110011010000101100010100001001000001100100110101110110001011011111010110101111010,QGYDMJHRAQDBOW-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CC=N2)NC3CCCC(CC)C3,8F602B08065048A4_B93703DDF9F7F389_6041_UN,8.354901,00000000000000000000000000000000000000000010000000000000000000000100000000000000100000010011000000100100110110010010101001000100110001110100001001010001000110101111010,WHIKKMLNIYWGCS-UHFFFAOYSA-N
CC1=C(N=C(N=C1)NCC23OC(C)(C)C(C2)C3)C4=C(C=CC=C4)F,6622574C8AA70C74_6A71C5B9A2465966_6041_UN,7.439004,00000000000100000000000001000000000000000010000000000000010000100110000000100100101100010010000110101000011110001000100011000100100011110100011011000111110111101111110,YHTXJWPWZGBMLO-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC(C)CC3CCOCC3,7C4EDEA06FC283A0_32A5ABE6297A096B_6041_UN,7.9313326,00000000000000000000000000000000000000100010000000000000010000000100000000000100000000110001000000100100110111010001001011000100110011110110011011010111010111101111110,PHXASCZNUYMLIN-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C=C)NC2CCN(C)C23CCCNC3,A3309A817848E830_3E2E3E95D8130B09_6041_DP,8.03549,00000000000000000000000000000000001000000010000000000100000000000010000000010001101101110011010010111000110110011001101011100000110101110110001011011011010010101111010,WXZTXPWRQCRZAW-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC4=C(CN(C)C3CCCCC3)C=CC=C4)F,F155FE61339C8F01_42E842AC3568588E_6041_DP,7.6443777,00000000000000000000000000000000000000000010000000000000000000000000000000000000001001110011010000101100110110010001101001100100110101110110001011011011010110101111010,XZSSDHSIAFGBJP-UHFFFAOYSA-N
C1(=C[N](N=C1)CC2CCC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,B9994680A6254E78_B840BE236FA2660D_6041_UN,7.936821,00000000000100000000000000000000000000000010000000001000000000100100000000010001100101110011011010001000100110010001101011101100110001110110001000011011010110101111010,JCNLJNVADYUWGF-MOPGFXCFSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NCC45CC(CC)(C4)CO5,8EDA4F6B5DE928AC_45E23771ED0036B3_6041_DP,7.988282,00000000000100000000001000000000000000100000000000000000010000000110000000000101101101100011010110101000010011001010100011100000110111010110001001001101110111101111110,TUHBZVZOHNXIOO-WPFWNBIPSA-N
ClC2=C1C(=CN(C1=NC=C2)CC3CNCCC34CCN(C)CC4)CC5=CC=CC=C5,800D03930CFD9B0C_C5CC5A5FE29D6934_6034_UN,8.007376,00000000000000000000000000000000000000100000000000000000000000000110000000010100101101110011010010101101110100011001101011100100110000100110001001011001010110101111010,RFVZFMGUVODOAV-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC34CC(CC)(C3)CO4,12C0D0B355FB160A_583D3B90FE190765_6041_UN,7.4709525,00000000000100000000000000000000000000100010000000000000010000000110000000000100001100010011000110101100010111001010100011000100110011110110011011000111110111101111110,CFRNJPFAAXYIOV-UHFFFAOYSA-N
FC2=C1C=CC=NC1=CC=C2NC3CCN(C)C4CCCC34,DB2C9BE372B46E71_E2A18E5F7516FA28_6041_UN,8.622649,00000000000000000000000000000000000000000010000000000000000000000100000000010000100001110011010010101100110110010001101011100100110001110100001011011011010010101111010,RZFCBCAREWUWOL-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)N[C@H]4C6=C(OC5(C4)CCC5)C=CC(=C6)F,5DA8CF7D8951DBD6_A05E5F61A1AA38A8_6041_DP,8.214999,00000000000100000001000000000000000000100010000000000000010000000110000000000101100101010011010011100100110100011100101011100100110111110100001011011001100011101111110,SFSLLBANWAVCMK-AJYBTWMASA-N
CCC4CCC1=C(C3=C(N1CC2(C)CCCC2)C=CC(=C3)C)C4,D274E530A31AC22B_6694DA76D4F4A3E1_6034_UN,8.02892,00000000000000000000000000000000000000000000000000000000000000000110000000010000000101000000000010001100010010011011101001100100110000000100010011011100010110101111010,BDIUARYRVKXCIZ-UHFFFAOYSA-N
CC(OC[C@@H]2C[C@H]1COC[C@H]1O2)C3=C(C=CC(=C3)C)F,61AAE4CA8A54F427_320CE0618D4ED98A_6039_UN,7.816366,00000000000000000000000000000000000000000010000000000000010000000000000010000000000100110100000010000100010101000000100010000010110010100110000010100110110101011011110,QSZUPJQGXCXZPY-CMNLQMMWSA-N
CC1=C(C3=C(N1CC2(F)CCOC2)C=CC=C3)C4=CCNCC4,08D1A175903B6875_37FD1F4D9791F7F5_6034_UN,8.621638,00000000000000000000000000000000000000000010000000100000010000100110000000011000001101110001000011111100110111011000101011100100110010100110001011011011010111101111110,RNYIQOFXSINBTQ-UHFFFAOYSA-N
N(CC1=C[NH]C2=C1C=C(C(=C2)F)F)C(C3CC4CNCC3O4)=O,B9E4DD7CB95584CD_B613B88FB6C310E1_6038_DP,8.107803,00000000000000000001000000000000000000000010000000000100010000000100000000000000101100110111100111101100010100100000010011000100110110100110001011000011111111110111110,CKLJUNWBDZDKAA-UHFFFAOYSA-N
C[N]2C=C1C=C(C=CC1=N2)NC(C3CCOCC3)C4=CC=C(C=C4)F,B2B1F3B753CD2D89_22BBCF0B4E63F4AB_6041_UN,7.6243324,00000000000000000000000000000000000000000010000000001000010000000100000000010000100100110011011010100100010101000000001011101100110011110110001001011001010011101111110,NXBGVAKEDSZRMQ-UHFFFAOYSA-N
C(C[C@]12C[C@H]1CCC2)=CC3=C[N](N=C3C)C4=CC=C(C=C4)F,C24607973B4E9A85_000E9E7CFFFDC115_7019_UN,8.21819,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011010000110101111010,UAFLSGSSAQWDOV-APWZRJJASA-N
C(C[C@]12C[C@H]1CCC2)=CC3=C[N](N=C3C)C4=CC=C(C=C4)Cl,C0BB754BD9F41307_22F127E232FB2515_7019_UN,8.218185,00000000000000000000001000000000000000000000000000001000000000100110000000010000100100010000001010010001010100001000001011101100110001110100001011011010000110101111010,DBXWEWFBXQRHLZ-APWZRJJASA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCN(CC2)C3CC3)F)CC4,7C6B46D39FA1246A_3EE092FE1F349769_6041_UN,8.066887,00000000000000000001001000000000000000000010000000000000000000100000000000010001101001110011010000101000000110010001101011100000110001110110001011011011010110101111010,OVSLUHVXJUWFEZ-UHFFFAOYSA-N
O[C@H](CBr)C1=CC=C(C=C1)C2=CC=C(C=C2)NC3CC4(C3)C5CCC(C4)C5,83204654BCEA503F_861B27540612D639_6041_UN,8.204026,00000000000100000000000000000000000000000000001000000000000000100010000000000000000000000001000010000000110000011000001000000100110111110001000001010001110111100111110,VHIJLLFFANKPSM-VUMVCEMISA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4=CC(=CC(=C4C)F)F,2E1EEAE622AABEB5_C7FCFADD690DAAAE_6041_DP,8.397765,00000000000000000001000000000000000000100010000000000000000000000100000000000101100101010011010010100000110100010000101011100100110101110100001011011111000010101111010,QUUWOCOJGIYKPG-QDMKHBRRSA-N
CC1=CC(=CC=C1)C2=C[N](C(=N2)C3NCCC3)C[C@@]45CCN(C)C[C@H]4CNC5,53261450CB030815_33F8D76F7540FFDC_6034_DP,8.127002,00000000000000000000000000000000000000100000000000000000000000100110000000010101101101100011010010101100110010011001101011100100110100000110001011011111010110101111010,OEWKDQRJUDMXQL-HUJVSABWSA-N
C1(=CC2=C(C=C1)[NH]C=C2C3CC3)NCCN4CC[Si](C)(C)CC4,A76564221BA30AB0_A7EAFB8E35C474B5_6041_UN,7.891054,00000000000000000000101000000010000000000000000000000000000000100100000000110001001101100001010010101100110000011001101011100100110101010110001001011101010110101111010,GDOZUQRFELTXED-UHFFFAOYSA-N
C[N]1N=C(N=C1N[C@H]2C3=C(OC(C)(C2)C)C=CC(=C3)F)C4CCOCC4,22BDA1D013B347CC_B92489FB668F5511_6041_UN,8.234629,00000000000000000000000001000000000000100010000000001000010000100110000000110101100100110000011011100100111101011101001011101100110011110110011011011111110011111111110,OQBXZTLFRPKYGP-OAHLLOKOSA-N
N1CCCC2=C1C=C(C(=C2)NCC34CC(OC3)CCO4)F,917EC3C7AD8F0C18_EF59C26A7B991A3E_6041_DP,8.175907,00000000000000000001000000000000000000000010000000000000010000000010000010000000001100010111000111101100110101011000001011000000110111110110001011010011110111110111110,IMBABDVIWQKHHR-UHFFFAOYSA-N
O(C1CCC2=C1C=CC=C2)CC3=CC4=C(C=C3)NC(=O)O4,05C2E6BCE714A312_AA96F2AFFDA71DFC_6039_UN,8.892508,00000000000000000000000100000000000000000000000000000000010000000100000000000000000100000000000110000100011001100100011011010111110010000100000111110001111111010111110,CMDNNSPCUVHSNP-UHFFFAOYSA-N
C1(=N[N](C=N1)CC2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,5CC1B339822F1BCA_ACD9A031DC432A2E_6041_UN,8.8101845,00000000000000000000001001000000000000000010000000001000000000100100000000010101100101110011011010001000101110010001101011101100010001110110001010011011010110101111010,MPHHNGDECAMNOQ-CVEARBPZSA-N
FC3CCCC(C=CC1=N[N](C)C(=C1)C2=CC=CO2)C3,6F092B0C4C9DE411_7D9C019D8BB83D66_7019_UN,7.7475805,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010000011111010000000100000000001011101100110000100100001010011010100010101111110,OLXMPWDGEHOWQF-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3N(C)CC4(CC3)CCC4,DF0E885F6F4D9CBD_5E48147D247590BB_6041_UN,7.4601336,00000000000100000000000000000000000000000010000000001000000000000110000000010001101101110011011010101100010110011001101011101100110001110110001001011111010110101111010,TYWDBBJTIUIVAV-UHFFFAOYSA-N
N(CC1C=CCCCC1)C(=O)[C@@H]2CCO[C@H]2C3=CC(=C(C=C3)Cl)F,EBBC6E492D05DA97_B22E8B12165BE210_6038_UN,7.8278184,00000000000000000001000000000000000000000010000000000000010000100000000000000000001100010111100011011001000101100000011000000000110010100110000010010011111111110111110,SEDDWSKHJQOHLI-CCFGZORBSA-N
C(CC2C1CC3CC(C1)CC2C3)=CC4=C[N](C)N=C4C5=C(C=CC=C5)Cl,8E0B0186233967E9_5CC23DC51ABD6ED4_7019_UN,8.050617,00000000000000000000000000000000000000000000000000001000000000100100000000010000100100010000011010010101010100000000000011101100110000100100001011001010000110101111010,XCEDIXKYTZJSIG-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC2=NC=C(C=C2)C3CCC3,7BBAA23EC7AAD3CF_282BE760FD6DA38A_7022_UN,7.7638993,00000000000100000000100000000010000000100000000000000000000000100100000000100100000000100000010000100000000000001000001001000100000001010100011001011101000010101111010,GYOVVYJVWKWCDG-UHFFFAOYSA-N
N(C1=C2C(=CC=C1)COCC2)[S](C4=CC(=C3[NH]C=CC3=C4)C)(=O)=O,5E88537248BF9A4F_37BC940796853450_6029_UN,8.717732,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100101011001010100110011001001000011011001100111111011110001011111001010011111111110,WIYDKUDIRASFKC-UHFFFAOYSA-N
O=C1N(C4=C(N1C[C@H]2[C@@H](CNC2)C3=CC(=CC=C3)F)C=CC=N4)C5CCNCC5,6FB20284D0EB4499_BCFCB8520E5AFC06_6034_UN,8.682235,00000000000000000000000000000000000001100010000000000000000000100100000000010101101101110011000011101100111100110100011011100101110101100110001111011011011110100111110,LESHYRKKOPKSCD-LPHOPBHVSA-N
CC(C)OC1CCC2=C1C=CC(=C2)NC3=CN=C([Si](C)(C)C)C=C3,9FFEF947B0B6B62F_5BE153C9D816917B_6041_UN,7.590388,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100001010010100100010010001000001001000111000011010100011111011101100011101111110,BXARZKPFJVDQAE-UHFFFAOYSA-N
FC1=C(C(=CC=C1)F)C3(C=CC2(COC)CCCCO2)CCC3,4189520F9966E8B0_1C85AF0FEF211015_7019_UN,7.161306,00000000000100000000000000000000000000000010000000000000010000100010000010000000000000110000010000110000000111001001001000000010110010100110000011010010110101011011110,JSQIGFXQNWRQJJ-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC3CCC2(CCNCC2)CC3)F,3DA2B3B974C4F15E_144B15A72813AAB4_7022_DP,7.4411182,00000000000000000000000000000000000000000010000000000000000000000010000000100000001001110011010000101000110100011001001001100000110101110110001011011111010110101111010,JTSZIMQFULRNHZ-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NCC2CCNC3(C2)CCC3)F)C#N,E759F04FC66FA30B_A7EC5083A9BC3571_6041_DP,8.043645,00000000000100000000000000000000000000000110000000000000000000000010000000000000001000010011000000101000110100011000001001000000110101110110001011010011010110101111010,DEHJFZAABZOPKH-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NC[C@@H]3CCCO[C@H]3C4=CC=N[N]4C,11C745D9CD6AE64E_6BA974F1A5AB22E8_6041_UN,7.698312,00000000000000000000001000000000000000000010000000001000010000100100000000010000101100010011011111101000000101000000001011101100110011110110001011011011110111101111110,WRQDCKGWUIAYNX-IFXJQAMLSA-N
C1(=CC2=C(N=C1)[NH]C=C2C3CCC3)NC4=CC=C(CC[Si](C)(C)C)C=C4,C7CCA77F23B46291_DC36A0ADBAFD9F4B_6041_UN,8.389064,00000000000100000000100000000010000000100000000000000000000000100100000000100101000100100001010010100100010000001001101011000100000101010100011001011101010110101111010,BTROLIIXLQWCBS-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NCC23COC(C)(C2)CCC3)C4CC4,082786C25E9CF321_45B3F94E9E4117FE_6041_UN,7.5314646,00000000000000000001001000000000000000000010000000000000010000100010000000000000001100010011000011001000010111001001101000000000110011110110000011010011110111101111110,KFPYKNICDHIWHV-UHFFFAOYSA-N
C2(=CC1=C(C=CC=C1F)S2)NCC34COC(C)(C3)CCC4,C14FCEB3FC2D3F73_DA66C74405EB4146_7022_UN,7.101434,00000000000000000001000000000000000010000010000100000000010000000010000000000000011100011011000011001100010111001001101010000100110011110110000001010001110111101111110,YHSQZEHYJGHDAX-UHFFFAOYSA-N
NC[C@H](OCC1OCCC12CCNCC2)C3=C(C=CC=C3)F,EBA07A15EA262E8A_CD45AA3A72B095BE_6039_DP,8.1462555,00000000000000000000000000000000000000000010000000000000010000000010000010000000001110110001000110101000110101011000001011000010110110100110001011010011110101110111110,BOEJWPAGLMSCDK-VYRBHSGPSA-N
C1(=NC(=CC=C1)C2CC2)NC3=CN=C([Si](C)(C)C)C=C3,1D6D4579F1429A82_5DAF430CA9F9FD6A_6041_UN,7.364229,00000000000000000000101000000010000000100000000000000000000000100100000000100101000000100000010000100000000000001000000011000100000001010100011001011101000010101111010,UYDZLPMNBFLKDF-UHFFFAOYSA-N
C1(=CC(=C(C(=C1)F)F)F)NC[C@@H]2CCCN(C)[C@H]2C3=C[N](N=C3)C,AF404C2B5F51B825_91EE9E4E2874148C_7022_UN,8.488912,00000000000000000000000000000000000000000010000000001000000000100100000000010000101101110011011010101000000110010001101011101100110001110110001011011111010110101111010,PCSZXTANSOEREP-APPDUMDISA-N
CC1=C(C2=C(C=C1)C=C[NH]2)NC4CCOC(C3=CN=C[N]3C)C4,567C67C592840DEA_39841E83BF846539_6041_UN,7.5934963,00000000000000000000000000000000000000000000000000000010010000100100000000010101000101000010010111100100110011010000001011100100110111010100001011011111110011101111110,KFKUVSUGTVLLCO-UHFFFAOYSA-N
O(C2(CC1CC(=NO1)CCl)COC2)C4=CC=C([C@@H]3[C@H](C)CCNC3)C=C4,E32F8AA197C5446A_E27A0AE6685527D6_6035_UN,8.281635,00000000100100000000000010000000000000000000000000000000010000100010000110000010001100100101001011101011100001011101101111001011110010100110001101110011110111111111110,STIVBYRBTAPHDF-ONZWQQIVSA-N
NCCC1=C[N](C2=C1C=C(C(=C2)Cl)F)CC3(CCNCC3)NCC4CC4,9A8EEEC640C3D797_639F5E1AC0205F87_6034_DP,8.083969,00000000000000000000001000000000000000000010000000000100000000000110000000010001101111110011000010101101110100011000001011100100110101100110001011011011010110100111010,DJHIEVDTTUFSPS-UHFFFAOYSA-N
NCCC1=CN(C2=C1C=C(C(=C2)F)Cl)CC3(CCNCC3)NCC4CC4,1CDA44118B16A63D_F792E35BDC44C742_6034_UN,8.083963,00000000000000000000001000000000000000000010000000000100000000000110000000010001101111110011000010101101110100011000001011100100110101100110001011011011010110100111010,GMZTZNKEMWWXOJ-UHFFFAOYSA-N
NCCC1=C[N](C2=C1C=C(C(=C2)F)Cl)CC3(CCNCC3)NCC4CC4,1CDA44118B16A63D_01ADCE0003C97099_6034_DP,8.083964,00000000000000000000001000000000000000000010000000000100000000000110000000010001101111110011000010101101110100011000001011100100110101100110001011011011010110100111010,GMZTZNKEMWWXOJ-UHFFFAOYSA-N
NCCC1=C[N](C2=C1C=C(C(=C2)F)F)CC3(CCNCC3)NCC4CC4,FF2ED1FE687AADB7_E7D98883452C0300_6034_DP,8.083963,00000000000000000000001000000000000000000010000000000100000000000110000000010001101111110011000010101100110100011000001011100100110101100110001011011011010110100111010,GANOSOJIWMMCBG-UHFFFAOYSA-N
NCCC1=CN(C2=C1C=C(C(=C2)Cl)F)CC3(CCNCC3)NCC4CC4,9A8EEEC640C3D797_95A073411FADE85C_6034_UN,8.083965,00000000000000000000001000000000000000000010000000000100000000000110000000010001101111110011000010101101110100011000001011100100110101100110001011011011010110100111010,DJHIEVDTTUFSPS-UHFFFAOYSA-N
NCCC1=CN(C2=C1C=C(C(=C2)F)F)CC3(CCNCC3)NCC4CC4,FF2ED1FE687AADB7_11E6A5D89AA1B4DB_6034_UN,8.083958,00000000000000000000001000000000000000000010000000000100000000000110000000010001101111110011000010101100110100011000001011100100110101100110001011011011010110100111010,GANOSOJIWMMCBG-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[NH]C3=C2CCCCCC3)NC5=C(C=C(CN4CCN(C)CC4)C=C5)F,7900FECA6BFFD52D_5A153BEE4711A466_6041_UN,7.406007,00000000000000000000000000000000000000000010000000000000000000000100000000010001000101110011010010101100110100010001101011100100110101110110001011011011010110101111010,DEYIFPLOJCWQNR-UHFFFAOYSA-N
CC[C@@H](OCC3CC1(CC2(C1)OCCO2)CO3)C4=CC(=C(C=C4)C)F,9651F6102FAAD905_BE02313B96804A11_6039_UN,7.643051,00000000000100000000000000000000000000000010000000000000010000000010000010000000000100010000000010000000010111001010001010010010110010100110100010110110110101011011110,HGPYMCLMWFMROR-UHUGOGIASA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC(N3CCOCC3)C4=C(C=CC=C4)F,F0DA658BF3920808_F5DCAB2E0C960DCA_6041_UN,7.7679415,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101110001010110101000000111010001101011100100110011110110001011011011010111101111110,RGXAOPCXQGDUBR-BGERDNNASA-N
O(C3CCN(CC1CCCC2=C1C=CC=C2)CC3)CC4=C(ON=C4C)C5CC5,A23B0B45A6D00938_A5FE3DAE9AD3D249_6039_UN,8.38398,00000000000000000000001000000000000000000000000000000000010000100100000100010000000101100100001011101110010001010000101011101111110010000110001111011010110111111111110,NTEFWRCWWVKEGT-UHFFFAOYSA-N
N1C4CCC1C(C=C[C@@H]2CCCO[C@H]2C3=C[N](CC)N=C3)C4,B86F5F21F93A8349_C52795B8A3EDE9E5_7019_DP,8.762964,00000000000000000000000000000000000000000000000000001000010000100100000000010000100100000010001011111000110001010010001011101000110010000110001001011011110111101111110,JBIGWQLHFWLXCI-BMEDJJSJSA-N
C2(=C(C=C1C=CC=CC1=C2)Br)NC3=CC(=N[N]3C)C4CCCO4,E673CCFDD20D434A_20E3EF8A1E2DDD6A_7022_UN,8.073829,00000000000000000000000000000000000000100000001000001000010000100100000000010101100100010000011111000100010101000000001011101100010011110100001011011011110011101111110,VWWMNEASYGKVHH-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NC3=CC(=N[N]3C)C4CCCO4,015EB57A02912EA7_7003A7BCF5A6B91C_7022_UN,8.073817,00000000000000000000000000000000000000100000000000001000010000100100000000010101100100010000011111000101010101000000001011101100010011110100001011011011110011101111110,KUAKNBPLRDLANO-UHFFFAOYSA-N
CC3CCCC(C=CC1=C([N](N=C1C)CC2=C(C=CC=C2Cl)Cl)C)C3,E5772BC9DEC273F3_0E83AF1272BB862E_7019_UN,8.469722,00000000000000000000000000000000000000000000000000001000000000000100000000010000100100010000001010011001000110010001101011101100110000100100011011011110010110101111010,CASWKPRORSMRNR-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N(C=C2C3=CCNCC3)CC5[C@@H]4C[C@@H](C4(C)C)CC5,2EDB800223C7A542_8A9C2427F9445188_6034_UN,7.920601,00000000000100000000000000000000000000000010000000100000000000100110000000111000001101110001000010111100110110011000101011100100110000100110001001011101010110101111010,HWJHQVPNXZRGDA-WURXZWLQSA-N
FC2=C(C=C1C(=CN(C1=C2)CC3CCNC3(C)C)CC#N)F,924649C553B97D19_2592C38D732A63EE_6034_UN,8.520323,00000000000000000000000000000000000000000110000000000000000000000110000000110000101101010011000010001100110110011000101011100100110000100110001010011111010110101111010,BGRZRYLPBCDZNT-UHFFFAOYSA-N
CN1CCC2=C1C=CC(=C2)NC4=CC3=C(C=C[N]3CC)C=C4,03770CD38CCDD4E3_8DD2180EFDB82284_7022_UN,8.739349,00000000000000000000000000000000000000000000000000000000000000000100000000010000100101100001010010001100010010010011101011100100000001010110001011011101010110101111010,NMRZCVSSTWCLRF-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CN=C2NC4C[C@H]3CCC[C@H](N3C)C4,A0F6D36C7AF5DC88_CE2BC761B0BAE90C_6041_UN,8.114338,00000000000000000000000000000000000000100010000000000000000000000100000000010100100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,CVQPOOLHBAVUDK-MQVJKMGUSA-N
N(CC1C2CC(C1)C3CC23)C(C4=N[N](C=C4C)C5=C(C=CC=C5)F)=O,7574243591E09116_77F964AF1C6E3297_6038_UN,8.512426,00000000000000000001001000000000000000000010000000001000000000100100000000010001101100010011101111001000010100100000010011101100110001110100001011001011011110101111110,CNXWHFDAHOPXHB-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)NC[C@H]2CNCC(O2)(C)C)F)C#N,A434F7E0D8D0509C_1883EDEA49593DB6_6041_DP,7.7761254,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110011011000111110111101111110,LXPQOIUABPGECW-GFCCVEGCSA-N
CN(C)CC1=CN(C2=C1C=CC(=C2)F)CC3C4(CNC3)CCC4,85AB32232FF67270_A76946AA9123B445_6034_UN,7.187318,00000000000100000000000000000000000000000010000000000000000000000110000000110000101101110011010010001100010100001001001011100100110000100110001000011101010110101111010,QTFJHUXONKDFNW-UHFFFAOYSA-N
FC1=C(C=C(C=C1)CC=C)NCCC2CCCN(C)C2,FD956DCCF4F01E99_3FA87BE997409328_6041_UN,8.07071,00000000000000000000000000000000001000000010000000000000000000000000000000010000001001110001010000111000100110010001101001100000110001110110001011011011010110101111010,OBYJZHHEMKSMNR-UHFFFAOYSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)CC4(C)CN(C4)C5=CC=C(C=C5)F,5C5FB5779D5D1475_92E6517F92ACA1A9_6034_UN,8.31727,00000000100100000000000000000000000000000010000000000000010000100110000000010000101101110001000110101100110101011001001011100100110011110110001001011001010111101111110,GMWIXZIYFYITFZ-UHFFFAOYSA-N
CC1=C(C(=NO1)C2=CC=C(C=C2)F)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,8216F314CE3C21CD_0C5FCB243F12F1AB_6041_UN,8.309812,00000000000000000000000000000000000000000010000000001000010000100100000100010001101101110001011111101010000111010001101011101100111011110110011011011111110111111111110,ZKGQOLJPVQJLDS-PXNSSMCTSA-N
CC1=C(C=C(C(=C1)NCC2OCCCNC2)Cl)C3CC3,637F127AD3D4BD16_89B39E200E514076_7022_DP,8.128275,00000000000000000001001000000000000000000000000000000100010000100000000000000000101000110011000101001001100111010000001011000000110111110110001010010011110111101111110,HIHBBMNGGIRQGO-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC3CCN(C(CC)C)C3)F,C274000941E30E17_FE67D9E6A57BD4FF_6041_DP,7.3379135,00000000000000000000000000000000000000000010000000000000000000000000000000010000101101110011000010101100110110010011101011100000110101110110001011011111010110101111010,JXMVZVRNRWZOEO-UHFFFAOYSA-N
N1CCC3(CC1)OC4(COC2=CC(=CC=C2)OC(F)F)CC3(N)C4,6894C289EB5D92C0_4ACEC3A2D27D4751_6035_DP,7.8892164,00000000000100000000000000000000000000000010000000000000010000000010000010000000001110100111000111101000111101011100001011000011110111100110001101110001110111110111110,ASSPRFONXOYJDK-UHFFFAOYSA-N
CC1=NC4=C(C(=C1)NCC[C@@H]2CC[C@H]3C[C@@H]2C3(C)C)C=C(F)C=C4,0903675C1AB031A5_6E56BA846C3C8BD4_6041_UN,8.37242,00000000000100000000000000000000000000000010000000000000000000000110000000100000101000010001000000101100110110011000101001000100110001110100011001010101010110101111010,LHCGQBXYXZHLQW-MPGHIAIKSA-N
O(CC1(CCOCC1)C2CC2)C[C@@H]3CNCC(O3)(C)C,A2C0EADC688ABBA4_AD2F2A2FE6D06EC3_6039_DP,7.309569,00000000000000000000001000000000000000000000000000000000010000100010000010100000001000100010000101101000000011001001001011000010110010000110000001110101110101111101110,WYDGKQMOQWWWJH-AWEZNQCLSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC4=CC3=C(C=C(C)C=C3C)[NH]4,BAD863A2897E48FD_833AF2C71DACD7C6_7019_UN,8.824776,00000000000000000000001000000000000000000000000000000000000000100100000000000000000100000001000010010100010000000000000001000100110000000100000000010111000110001111010,PODGNOGUOAZPKJ-QAPCUYQASA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3(CC3)C#C,EE190007659D619C_946D327BC33525D9_6041_UN,7.8798265,00000000000000000100001000000000000000100010000000000000000000000110000000000100001000010011000000101100010110001000000001000100010001110100001011010111010110101111010,IMDACTJRKQXNPP-UHFFFAOYSA-N
N(C1C2CCC1CCC2)C(=O)CC3=C[NH]C4=C3C=CC(=C4)F,51C1316931555CA3_62301FBD2AB10383_6038_UN,7.5835447,00000000000000000001000000000000000000000010000000000000000000000100000000000000000100010011100010000100110100110000011001000100110111100100001001010001001110100111110,OHWHMPYDXYQRRJ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CC(=N2)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,2C9B5D4392D8392C_7159215F3F257EAA_6041_UN,8.697753,00000000000000000000000000000000000000100010000000000000000000100100000000010100101101110011010010101100010110010001101011100100110001110110001001011011010110101111010,SFDLAGRPWUECQM-JXFKEZNVSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OCC2OC(CC23CNC3)=O)C4,88F2EC897F22FCC2_0B1A5D34E7509492_6039_DP,7.7552857,00000000100100000000000000000000000000000000000000000000010000000010000010100000001101100011010011001000010001001001001011110011110010000110001100111111111101111101110,NISDKVMEXFXFAO-AMMIGWFGSA-N
C[Si](C)(C)C1=C(C=CC=C1)NC[C@H]3[C@H]2CCCCN2CCC3,95A211D4E989ED6E_A949C89F55E073D7_6041_UN,7.956473,00000000000000000000100000000010000000000000000000000000000000000000000000100000101001100011010000101100010000011000001001100000110001010110011011011111010110101111010,FPNZOTGQKRBPIS-FUHWJXTLSA-N
CC1=C(C=CC=C1Cl)NCC2=NC=C[N]2CC3CCC4(CN3)CCSCC4,1A04BD2FFCADA9C2_2E7B01E6152B1B0F_6034_DP,8.126629,00000000000000000000000000000000000010100000000000000000000000000110000000010101001101111011000010101001110110011000001011100100110101110110001011011011010110101111010,NRLXEGQKENWXAR-UHFFFAOYSA-N
CN(C1CNC1)C2=NC(=CN=C2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,6E8EAE3D99B6D75E_23B81F96B2206893_6041_DP,8.809763,00000000100100000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100000101110110001011011111010010101111010,UEFHULUJZXJFIS-APWZRJJASA-N
FC1=CC2=C(C=C1)N(C=C2C3=CCNCC3)CC4[C@@H]5COC[C@H]45,7F637B087D1E3C41_B92F46BE1F55CAF0_6034_UN,8.9127655,00000000000000000000001000000000000000000010000000100000010000100100000000011000001101110001000010111100110101010000001011100100110000100110001001011001010111100111110,RBGRCDIJHGKSNJ-AYHJJNSGSA-N
C1CC(CCN1)C3=CC2=C(C=CC=C2)N3C[C@@H](CC)NC4=NC=C(C=C4)Br,D1818D63230AA0B1_E1D7C7AF9645A1FD_6034_UN,7.9653444,00000000000000000000000000000000000000100000001000000000000000100100000000010101001101110001000010101100110100010010101011100100110101110110001011011011010110101111010,NORCSDQUEWYJSM-LJQANCHMSA-N
CN5CCCN(CC1=C(C=C(C=C1)NC2C4=C(OC3(C2)CCOCC3)C=CC=C4)F)CC5,A4860A2AAAC68FE2_C4158F666B7FFF8A_6041_UN,7.5064516,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110101010001101100110111011101101011100100110011110110001011011011110111111111110,GTUMCXBZOZTCSL-UHFFFAOYSA-N
NCCC(OC1=CC(=CC=C1)CC2CCNCC2)C3=CC=C(C=C3)Br,FA04952EDE759DE5_F891381213380E39_6035_UN,8.188482,00000000000000000000000000000000000000000000001000000000000000000000000000000000001010110001000001101000100100010100001001000111110110100110001101010001110101100111110,VAGWJXLHQNXXFM-UHFFFAOYSA-N
C1NCC2=C(C1)C4=C(N2CC3(CN(C)C)CCCCC3)C=CC=C4,676D37959E6EF72F_04DEC6D76CDB13DF_6034_UN,7.425763,00000000000000000000000000000000000000000000000000000000000000000110000000110001101101100001010010101100110010011001001011100100110000000110001011011101010110101111010,VAYXZIVRKXXHLF-UHFFFAOYSA-N
C(C2CCCC1(CC1)C2)=CC3=C([N](N=C3C)C4=C(C=C(C=C4)C)C)Cl,1DAA92917C93D7E3_24928DB0FF2E8066_7019_UN,8.181297,00000000000000000000001000000000000000000000000000001000000000100110000000010000100100010000001010010001010100001000001011101100110001110100011011011110000010101111010,XCEULIDSKFOPPX-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC3=NC=C(CC2COCCC2)S3,A873ECEB12410E82_3791ED9264B198E2_7022_UN,7.965246,00000000000000000000100000000010000010000000000100000000010000000100000000100100010100101001010010100000001001001000001011000100110011010110011001011101010111101111110,ZDRHVHKFLHJSGL-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)N[C@@H]2CNC[C@H]2C3=CC=CC=C3,9D0B9699DD6F903F_F44B69562497A215_7022_DP,8.047539,00000000000000000000000000000000000000000110000000000110000000100000000000000001101100110011000010001001100100010000000001000100010101110110001011000011010010100111010,YNUVYKSEVOSVCK-XJKSGUPXSA-N
N(CC1CC2CCC(C1)O2)C(C4=CC3=C(C(=CC(=C3)C)F)N=C4)=O,1691FE3A18554816_E5D7EFCA4E0AB980_6038_UN,7.611114,00000000000000000001000000000000000000000010000000000000010000000100000000000000101100010010100011101100010100100000011011000100110010100100001001010001111111111111110,JOBDITWCAMKMGT-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@H]4C[C@@H]3CNC[C@@H]3N4C)Cl,1019102C5D422403_629D0BC5E51EC266_6034_UN,7.917938,00000000000000000000000000000000000010000000000100000000000000000100000000010111111101111011010010001101011110010000100111100100110101110110001010001111010110101111010,IWQJMOFJGUUKCV-RKVPGOIHSA-N
BrC1=CC2=C(C=C1)N(C=CC2=O)CC3CNCC34CCNCC4,B32373ED9ADEB4F3_276FC3235CD1DC85_6034_DP,8.888182,00000000000000000000000000000000000000000000001000000000000000000110000000010000101101110011000011101100110100011100001011100101110100100110001101011001111110100111110,BPJGYQGSPAMPJQ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2C[C@@H]3CCCO[C@H]3C4=CC=N[N]4CC)C5CCNCC5,01815CC569A6E2C5_57BC66F9195FF716_6034_UN,8.066566,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001001111101100110101010010001011101100110010100110001011011011110111101111110,AOIMOUMAYZCDOR-MHECFPHRSA-N
C2(=C1OC=CC1=CC=C2F)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,5D5331C45AF9693C_2400A66691AD9D66_7022_UN,7.934806,00000000000000000000001000000000000000000010000000000000010000000010000000100000001100010011000110001100010100001001101000000100110001110100000011010111110110101111110,LKCCTYXPOUBTLH-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@H]3[C@H](C2=CC=N[N]2C)C3)Cl)C4CC4,94963B3E50D89E1C_67FA476BE1B39DC2_7022_UN,8.043372,00000000000000000000001000000000000000000000000000001000000000100100000000010000101100010011011010001001000110000000000011101100010001110100001010011111010110101111010,ZHEFUNYRONFANZ-DZGCQCFKSA-N
O=[N](=O)C1=CC2=C(C=C1)C(=CC=N2)NCC3C4=C(CC3)C=C(C=C4)F,1FBADF7DDFBEC512_6DA8C7A5EA1E851A_6041_UN,8.373223,00000000000000000000000010000000000000000010000001000000100000010100001100000000101000010011001010101110010100000000001101101100111001110100001011011001010110110111110,OZFGDUBHJBSNJN-UHFFFAOYSA-N
CC1=C(C3=C(N1CCC2CCCN2C)C=CC=C3)C4=CCNCC4,EB9731CE97B7DDD7_6861B6CE5E22C0E0_6034_UN,8.12244,00000000000000000000000000000000000000000000000000100000000000100100000000011000101101100001010010111100110010010001101011100100110000000110001011011111010110101111010,CCZGVYHANJTJSJ-UHFFFAOYSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)CC4CC4(C)Br,8D833027763EAA50_EDE51BC69B9D2C42_6034_UN,7.521569,00000000000000000000001000000000000000000000001000000000010000000110000000010000001101110001000110101100110111011001101011100100110010100110001001011011010111101111110,WHANZAAIVKGNTA-UHFFFAOYSA-N
C2(=C1OC=CC1=CC(=C2)F)NCC4=C(CN(C)C3CCCCC3)C=CC=C4,B52B62A1F74E72BC_B220562C4195CA2A_7022_UN,8.128006,00000000000000000000000000000000000000000010000000000000010000000000000000000000001101110001010110001100010110010001101000100100110001110110001011011011110110101111110,MIJPKLFNSJEQIF-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(C[N]3C4=C(N=C3C)C=C(C(=C4)F)F)=O,EB63CF3898CF016D_AA731172076A16DA_6038_UN,8.585903,00000000000000000000000000000000000000100010000000000000000000000100000000010101001101010011100110011100110100110000111011100100110010100110001011011011011110101111110,IVWLCCUJURNYPP-UHFFFAOYSA-N
CC[N]1C=CC2=C1C=CC=C2NCC3(C(C)(C3)C)C4=C(C=C(C=C4)F)F,BD63D052CB1213F5_EE96304787C53779_6041_UN,8.214597,00000000000000000000001000000000000000000010000000000000000000100110000000110000101101010011000010001100010110001011100001100100010001110110011011001111010110101111010,VWVUZFNFLAWWJC-UHFFFAOYSA-N
N4CC[C@@H]3CN(CC1=NC=C(N=C1)NC2=CN=CC(=C2)[Si](C)(C)C)C[C@@H]3C4,64BEEA836A496384_C7E5F0DA1071ED89_6041_DP,7.9626384,00000000000000000000100000000010000000100000000000000000000000000100000000110101101101100011010010101100110000011000001011100100110101010110011001011101010110101111010,PKRAYAWMVYSRSZ-CVEARBPZSA-N
N1CCC4(CC1)CCC2=C(C=CC(=C2)NC3=CN=C([Si](C)(C)C)C=C3)O4,1EDE46C93B96B582_A30D581A8D4702C6_6041_DP,6.887886,00000000000000000000100000000010000000000000000000000000010000000110000000100001001000100001010001101100110000011100001011000100110111010110011011011101110011101111110,SGFVHJSOODKSQS-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3CCCCN3CC)C4=CCNCC4,5945A1A8C5F9AC64_A0C69AF896D2F893_6034_UN,8.107658,00000000000000000000000000000000000000000010000000100000000000100100000000011001001101110001000010111100110110010010101011100100110000100110001001011011010110101111010,XFVLCCRPBOUJHT-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=CC2=O)C[C@@H]3C[C@H]3C4CCNC4,09363875DB840911_3811CD9ABCC1DFF0_6034_DP,9.118512,00000000000000000000001000000000000000000000001000000000000000100100000000010000001101110011000011101100110100010100001011100101110000100110001101011011111110100111110,OQHVRQPANSNMOO-WGIUUAEBSA-N
NCC1(C(CCC1)OC2=C3C(=CC=C2)CNCC3)CC4=CC=C(C=C4)F,794A8ADA88D8E223_521C2E3DCCCB516F_6035_UN,7.5703535,00000000000000000000000000000000000000000010000000000000000000000010000000000000001010110011000011101100110100011100001001000111110110100110001111010011110101100111110,PNHWHMSXQCOGGR-UHFFFAOYSA-N
CN5CC(C1=NN=C(C)N1CCCC2CC3CCC2C3)C4(CNC4)C5,14A0659A20E24A9A_6BF324C9B9599344_6034_UN,7.571395,00000000100100000000000000000000000000100000000000001000000000100110000000010101101101100011011010001000010010011001101011101000110000000110001010011111010110101111010,QQPLNLVIPKIYFB-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2N(C)CC3(CC2)CCC3)F,B6A62F570D501D5F_06DFFFFB1920EFE3_7022_UN,7.7728033,00000000000100000000000000000000000000000010000000000000000000000010000000110001001001110011010000101000010110011001101001100000110001110110011011011111010110101111010,IVFOXQVJSNKYFZ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C(N=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,6777967625AA648A_CCA3D0C173FCB76D_6041_UN,8.148984,00000000000000000000000000000000000000100010000000000000000000000100000000000100100001110010010000101100010110010001101001100100110001110100001011011011010110101111010,XGEZJCQOPOUSNW-UHFFFAOYSA-N
CC1=C(C3=C(N1CC2(N)CCC(F)(F)CC2)C=CC=C3)C4CCNCC4,884B3BBF866C88FC_9A78AF8F1B359FF9_6034_UN,7.9249897,00000000000000000000000000000000000000000010000000000000000000100110000000010001001111110011000010101100110110011000101011100100110101100110001011011011010110101111010,HRHSNCJIODBPGH-UHFFFAOYSA-N
N(C2=C1C=C[NH]C1=CC=C2)C(C4=CC3=C(OCCN3C)C=C4)=O,58A642E67705E162_86FC59379C734144_6038_UN,9.083227,00000000000000000000000000000000000000000000000000000100010000000100000000010000100101100000110110101100010001110101111011100100000111010110001011011001111011111111110,SVBONRXOBPNQJB-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCNCC3C,4FE4C8C01D2BE629_E21C020938D45806_6041_DP,8.5469055,00000000000000000000000000000000000000100010000000000000000000000100000000000100001000110011000000101100110110010001101011000100110101110110011011010111010110101111010,HQAGDERZIMGIDD-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2(CCOCC2)C#N)N[C@H]3[C@H](CC3)C4=C(C=C(C=C4)F)F,193DA2D48ED754ED_E710D06C79C8DC0B_6041_UN,7.4217277,00000000000100000000000000000000000000000110000000000000010000100010000000000000000000110011000000100000100101011000001000000100110011110110001011010011010011100111110,VISMBECFRGIRJC-TZIWHRDSSA-N
N(CC12CCC(CC1)CO2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)F,6E4DFEB4CCD69F6C_5BFCA0DFF50BCBC9_6038_UN,7.683053,00000000000100000000000000000000000000000010000000000000010000100010000000000000001000010011100100101001010101101000011000000000110010100110000011010011111111110111110,GDKRJHRWNHOGCV-UHFFFAOYSA-N
N(CC12CCC(CC1)CO2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)Cl,CA0FE7F233DCE0FC_9419FAD72E3DB2EF_6038_UN,7.683052,00000000000100000000000000000000000000000000000000000000010000100010000000000000001000010011100100101001010101101000011000000000110010100110000011010011111111110111110,KJEGYQOGBDTWLY-UHFFFAOYSA-N
CC(C)C1=C(C=C(C=C1)NC[C@@]23CCN[C@@H]2CCC3)F,2F1A3BAFE40AD9DD_CE499AFA6323F301_6041_DP,8.400786,00000000000000000000000000000000000000000010000000000100000000000010000000100000101100010011000010001100110100011000001001000000110101110110001010010111010110101111010,SFAPVSUWQAPGPC-IAGOWNOFSA-N
C(C2CCCC1(CC1)C2)=CC3=C[N](C)C4=C3C=C(C=C4)F,6DAB105C8FDFD09F_083B4581C6B232FA_7019_UN,8.2495365,00000000000000000000001000000000000000000010000000000000000000000110000000010000000101010000010010010100010100001000001001100100110000100100000001011000000010101111010,HDCIQMYTJSORQN-UHFFFAOYSA-N
C2(=C1CCOC1=CC=C2)NCC3CCN(C)C3C4=CC(=C(C=C4)Cl)F,1CA659EC338BF96D_E2A917BD1247E4C8_7022_UN,8.769633,00000000000000000000000000000000000000000010000000000000010000100000000000010000101101110011010011001101010111010101101011100100110011110110001011011011110111101111110,AHHTWGMNCKRYFY-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C4=C(C)N=C3C=C(C=CC3=C4)F)=O,6D61E2FC9034FF6C_615DAB87D6C1EADB_6038_UN,7.755806,00000000000000000000000000000000000000000010000000000000010000000100000000000000101100010001100011101100110100110000011011000100110010100100001011010011111111111111110,OVYNVUFOELEVBG-UHFFFAOYSA-N
N(CC12CCC(CC1)CO2)C(=O)C4=C3C=C(C=CC3=NC(=C4)C5CC5)F,4ED8C74CB639011A_7C73AF0BD3E70FB8_6038_UN,7.906476,00000000000000000000001000000000000000000010000000000000010000100110000000000000001000010011100100101100010101101000011011000100110010100110001001010001111111110111110,XIOFZJFBJNAOEW-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(C)CCCCCCC3,21D3426A08A9B04D_F462FA52DC83C817_6041_UN,7.1269946,00000000000000000000000000000000000000100000000000000000000000100110000000010100101101100011010010101100000010011001101011100000110001010110001000011111010110101111010,JMOLHHNDDVUEAX-SFHVURJKSA-N
C[N]1N=NC2=C1C=CC(=C2)NC35CC(OC34CNC4)(C)C5,961A9D136505B5C8_7664FD6CFB499BC1_6041_DP,7.3421197,00000000100100000000000000000000000000000000000000001100010000000110001000010101101100100011011111001100110010011001000011101100111111010110001000001101110011101111110,QXARVECSDGKWNK-UHFFFAOYSA-N
N5C[C@@H]4CC[C@H](OC1=CC=CC(=C1)C2=NC3=C([N]2C)C=CC(=C3)F)[C@@H]4C5,315A9FFDB31174BF_AE1021A62CAA73C2_6035_DP,8.242642,00000000000000000000000000000000000000100010000000000000000000100100000000010101001101110011010011001100010100000100001011100111110010100110001111011011110011101111110,JNWDEDBQKLEUCF-NQYLQCIDSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CCC[C@H]3NCCC3)Cl,F7146CCE5E2D9784_E658288BE093393C_6034_UN,7.7079945,00000000000000000000000000000000000010000000000100000000000000000100000000010110011101011011000010001001101100010000001111100100110101110110001010011011010110101111010,CWXGARDMLBOBTE-HNNXBMFYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCCC3CCCOC3,3EC1BC8FB1D0CAC2_1EACDF481F3987E7_6041_UN,7.3661423,00000000000000000000000000000000000000100010000000000000010000000100000000000100001000110001000000101100110111010000001011000100110011110110001011010111010111101111110,XVTDCAVWTQMYJO-UHFFFAOYSA-N
C1(=C(C=C(C=C1F)F)Cl)NC(COC)C2CCCOC2,3EC3550FB8D5C720_CCD07ACD3D82EFEA_7022_UN,7.861712,00000000000000000000000000000000000000000010000000000000010000000000000000000000000000110011010101100001100101010001001000000010110011110110000011010011010111111111110,SLRSREBWLVYJCB-UHFFFAOYSA-N
COC1=C(C=C(C=C1)C4=NOC(CNC(C2CC3CNC2C=C3)=O)C4)F,768738DF8BC951CB_6F6CDC58133B05AA_6038_DP,7.6656494,00000000000000000000000010000000000000000010000000000100010000100000000100000010101100010010111111111010010100110100010111001011100110100110001111100011111111111111110,DWGABYIXANJIEM-UHFFFAOYSA-N
C1(=C(C=C(C=C1F)F)Br)NC(COC)C2CCCOC2,EDD49023DBC5DC07_66B37DEF8132E945_7022_UN,7.8616877,00000000000000000000000000000000000000000010001000000000010000000000000000000000000000110011010101100000100101010001001000000010110011110110000011010011010111111111110,RVBBAMZBAOKCFL-UHFFFAOYSA-N
C1(=C(C=C(C=C1Cl)F)Cl)NC(COC)C2CCCOC2,B573FE6BC4CCC97F_83F40D96CD8CAEF0_7022_UN,7.861679,00000000000000000000000000000000000000000010000000000000010000000000000000000000000000110011010101100001100101010001001000000010110011110110000011010011010111111111110,OEIBXZUTKVMMJY-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC3CCN(C)C34CCCNC4,FA431F81377B70FC_B24D8B2286AFEFE5_6041_DP,7.217785,00000000000000000000000000000000000000000010000000000100010000100010000010010001101101110011010010101000110111011001101011110000110111110110001011011011010011111111110,LJJADEAFDVQMJC-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C3=C2CSCC3)CC4CNCCC45CCN(C)CC5,59AACDBD65DEED32_C6525B487AD884E2_6034_UN,7.618625,00000000000000000000000000000000000010000000001000000000000000000110000000010000101101111011010010101100110100011001101011100100110000100110001011011001010110101111010,YIRGGRINHDQUON-UHFFFAOYSA-N
CSC1=CC(=CC=C1)NC24CC3CC(C2)CC(C3(F)F)C4,C30FB062075F5879_DFEDE18FBDCD8FED_7022_UN,8.2014065,00000000000000000000000000000000000000000010000000000000000100001010000000000000010000011001010000000100110100011000000000000000100001110000000001000001000010101111010,GDVSJRKGADMIDB-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC2OC3(CC2)CCOCC3,5FD0F7669C95805C_6A6F0A42F29460BB_6041_UN,7.4941397,00000000000000000000000000000000000000000110000000000000010000000010000000000000001100110111000110101000010111001000001010000000110011110110001011010011110111111111110,OWXWVZXIVSZSEH-UHFFFAOYSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NC3CCN(CC3C)CC4CCCO4,F24E2B6FE2A99B5E_172ABDC7AF817EC6_6041_UN,8.113361,00000000000000000000000001000000000000000010000000000000010000000100000000010101100101110010010110101100111111010001101011100100110011110110001011011111110111101111110,OLYVMKISZDCVFB-UHFFFAOYSA-N
CC1=C(N(C(=N1)C2CNCCC2)CC3CCCN3CC4=C(C=CC=C4)Cl)C,52C930F85247B2BF_B8156066BB7ECB30_6034_UN,8.301996,00000000000000000000000000000000000000100000000000000000000000100100000000010101101101110011000010101001100110010000101011100100110000100110001011011111010110101111010,LRTGQZQYJRSJFL-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC4OC3(CCC(C)(CC3)C)CC4,A062C57664966994_A406795CBCDDB488_7022_UN,8.169538,00000000000000000000000000000000000000000010000000001000010000000110000000110000101100010011001110001000010100011001101011101100110011110110001011011111110111101111110,MWDCQENQTWFNLS-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2OC(CC2)C3CC3)F)CC4,29DCBE04009CB783_B396D03A854C31AD_6041_UN,7.4551864,00000000000000000001001000000000000000000010000000000000010000100000000000010001101101110011010110001000000110010001101011100000110011110110001010011011110111101111110,KVNACPMFGQFOED-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CCCC2CCNC2)C=CC(=C3)Br)C4,49007C552B38593B_A8896131E80D47FA_6034_UN,8.102235,00000000000000000000000000000000000000000000001000000000000000000110000000110000001101110011000010001100110100011001101011100100110000100110001011011101010110101111010,KXADFXBHLBMMNQ-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC[C@@]23CCN[C@@H]2CCC3,4A59E9F2E114C2EE_ECE687F41F8A49FF_7022_DP,7.826155,00000000000000000000100000000010000000000000000000000100000000000010000000100000101100100011010010001100110000011000001001000000110101010110011000011101010110101111010,XEGIKODUQKSUDS-IAGOWNOFSA-N
N4CC1=C(C=C(C=C1)NC2=CC=C(CO[Si](C)(C)C)C=C2)C3(CC3)C4,90385FEBAA2E07E1_DA91A80D52E79E07_6041_DP,7.4262114,00000000000000000000101000000010000000000000000000000000000000000010000000100000001000100011010000101110010001001000100001001110110101010110011011011101010111101111110,GHJFOTLWUAYYEH-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NC2CC3(NC2)CCOCC3,CA424F7A865BAFB4_218B4DFE53FF7B6C_6041_DP,7.492557,00000000000000000000000000000000000000000110000000000110010000000010000000000001101100110011000011101000110101011000001011000000110111110110001011010011010011101111110,ROWIRLNTZAHWED-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C(C)(C)C3=CC(=C(C=C3)Cl)Cl)=O,29C81E01F95A8344_01EA24E3DF5AC95A_6038_UN,8.052485,00000000000000000000000000000000000000000000000000000000010000000010000000100000001100010001100010001001110110111000011000000000110010100100000011010111111111111111110,VBYNHYBWOQKKBO-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C(C)(C)C3=CC(=C(C=C3)F)F)=O,69D929F4A207E842_2A32BD9056009B5A_6038_UN,8.052482,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010001100010001000110110111000011000000000110010100100000011010111111111111111110,BLBLIXLYYZLKCH-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C(C)(C)C3=CC(=C(C=C3)F)Cl)=O,095DAA314F2355A2_D437C941A17FAB80_6038_UN,8.05247,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010001100010001001110110111000011000000000110010100100000011010111111111111111110,UXGVRAZRXLTKJX-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NC3CCCCC3CC4CCCC4,36FF734E7C1B95F7_398C3E090D75C8D9_6041_UN,7.8021917,00000000000000000000000000000000000000000010000000000000000000000100000000000000100000010011000010100100110100010000001001000100110001110100001011010011000110101111010,TVZPFZCHOQFBFP-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC(C)(C)C2CCOCC2)F)CC3,338301463EB46FC2_D808EE172485A25B_6041_UN,7.468093,00000000000000000001000000000000000000000010000000000000010000000010000000110001101001110001010000101000000111011001101011100000110011110110011011011111010111101111110,DEJURBUEYKEUNM-UHFFFAOYSA-N
CC1=C(C2=C(S1)N=C(N=C2NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C5CC5)C,A68AEEF59EAC6861_09E2DF533DFD0FB2_6041_DP,8.120054,00000000000000000000001000000000000010100010000100000100000000100100000000000100111100111011000010101100110100010000001011000100110101110110001011010111010110101111010,YNJOPXDYZBHMHQ-PKOBYXMFSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3N(C)CC4(CC3)CC4,967329DF8B176D7C_F9837E8BDF5A99CA_6041_UN,7.6825614,00000000000000000000001000000000000000000010000000001000000000000110000000010001101101110011011010101100010110011001101011101100110001110110001001011111010110101111010,SWOIGLDZRKGHAM-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CC3(SCC2)CCC3)F)CC4,2F067B1DE8483EB0_ED6D5CED264E7819_6041_UN,7.2601695,00000000000100000001000000000000000010000010000000000000000000000010000000010001110001111011010000101000110110011001101011100000110001110110001011011011010110101111010,JKCVYENBCCFNJR-UHFFFAOYSA-N
FC2=C1C(=C[NH]C1=CC=C2)[S](=O)(=O)N4C3(CCCCC3)CC=CC4,C327E7F751D00FAA_5E4BF2B6815622B0_6026_UN,8.8106575,00000000000000000000000000000000110000000010000000010001001111001111000001010000110100011000001011111110011100011000011011101100111000101100001001011001010010110111110,KFTATXZQNPWTEE-UHFFFAOYSA-N
CCC5CCC1=C(C4=C(N1CC2=C(C=C(C=C2)Br)N3CCOCC3)C=CC(=C4)C)C5,0FC9080C3AE6A734_5C19FF964DDFD1C9_6034_UN,7.81993,00000000000000000000000000000000000000000000001000000000010000100100000000010000100101110000000110101100010111010010101011100100110011110110001011011110010111101111110,KXYVQPXPNACMMA-UHFFFAOYSA-N
O(CC2COC1=C(C=C(C=C1)[N](=O)=O)O2)CC4=CC3=C(CNC3)C=C4,FFEDE77BCED8A14C_BD620A34CB01F181_6039_DP,8.082559,00000000000000000000000010000000000000000000000001000000110000010000001110000000001100100101001011101110010001000100000111101110111011010110101011101001110111110111110,YQHCNOXOTWQTKE-UHFFFAOYSA-N
NCC23CCCC(CN(CC1=CC=CC=C1)C2)C3OC5=C4C=CC=CC4=CC=C5F,5A84C7B31889B998_9DCD61C39E7F9222_6035_UN,8.27367,00000000000000000000000000000000000000000010000000000000000000000010000000010000101011110011000001101100010100001100001001100111110000100110001111011011110101100111110,QOMLUDQINVPICU-UHFFFAOYSA-N
BrC1=CC(=CC=C1)C2=NC=CN2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,722CC7CD60ECC130_CAC5196BBAF9D479_6034_UN,7.8422117,00000000000100000000000000000000000000100000001000000000000000100110000000110101000101010000000010001000010110011000101011100100110000100100001011011110010110101111010,WMSLEHKBGSBXDM-YXJHDRRASA-N
CN(C)CC1=C(C=CC(=C1)NC3=NC=C(CC2OCCC2)S3)F,7FC18BC96B5C669A_6B63D4CAC1398A77_7022_UN,8.064301,00000000000000000000000000000000000010000010000100000000010000000100000000100100010101111001010010001000001101000001001011100100110011110110001010011111110111101111110,BBTZMTVWHFHRSJ-UHFFFAOYSA-N
NCC23CCCC(CN(CC1=CC=CC=C1)C2)C3OC5=C4C=CC=CC4=CC=C5Br,8DB9E4DD0C8EED36_B7A76ACC2515FE1D_6035_UN,8.273647,00000000000000000000000000000000000000000000001000000000000000000010000000010000101011110011000001101100010100001100001001100111110000100110001111011011110101100111110,CFEQVNRUYJVGHH-UHFFFAOYSA-N
NCC23CCCC(CN(CC1=CC=CC=C1)C2)C3OC5=C4C=CC=CC4=CC=C5Cl,4EA0526B7DF41DF0_A4EF3465FDC20E8E_6035_UN,8.273642,00000000000000000000000000000000000000000000000000000000000000000010000000010000101011110011000001101101010100001100001001100111110000100110001111011011110101100111110,BKHAMAHZPZXWFU-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NC3C[C@H]2CCC[C@H](N2C)C3)N=CC=C4,DC2B6DD3CBF0C905_74C84CE4B9FF7639_6041_UN,7.983679,00000000000000000000000000000000000000000010000000000000000000000100000000010001100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,PBKBUHLFRCZPAG-MQVJKMGUSA-N
C(C2CCC1(CC1)CC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,1B97BC53EF0CDFD5_7302B739C49BEBEF_7019_UN,7.898343,00000000000000000000001000000000000000000010000000000000000000000010000000000000000001010000010010010000010110011000101000100000110001110000000011011010000010101111010,GHGOUQOCHXOHRE-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2C[C@H](F)CN2CC3=CC=CS3)Cl)C4CC4,B2896DC8D60C3E0D_BE30858E16619179_7022_UN,8.47163,00000000000000000000001000000000000010000010000000000000000000100000000000010001011101111011000010001001000110010000000011100100110001110110001010011011010110101111010,XBQRCUNILQDNJO-HOTGVXAUSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NCC3CC4(CN3)CCC4,3B7DAABD64235D54_FEF3FE616D8BC2D5_6041_DP,8.03242,00000000000100000000000000000000000000000010000000000010000000000110000000100001101100010011000010101100110100011000001011000100110101110110011011010111010110101111010,QBEDZZKMKWKVHC-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)CCC2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4,5D3B9B70DD1B6F88_273F19DEA0127DCF_6041_UN,8.156301,00000000000000000000000000000000000000000010000000000000000000100000000000010000101001110011010010101100010110010001101001100100110001110110001011011011010110101111010,SUZNZVJROWREGW-AVRDEDQJSA-N
CC1=C(N(C(=N1)C2CNCCC2)CC(CC)NCC3=C(C=C(C=C3)Cl)Cl)C,9B17B991ABEF0466_E4E4004402CA0319_6034_UN,8.505224,00000000000000000000000000000000000000100000000000000000000000100100000000010101101101110011000010101001100110010010101011100100110100100110011011011111010110101111010,RYTQNZYMXGVNNL-UHFFFAOYSA-N
FC1=CC2=C(C(=C1)F)C(=C(C#N)C=N2)N[C@@H]3[C@@H](C(C)C)NCC3,0FD1FEBBDC96B80E_52ECC4B1269448A7_6041_DP,7.956785,00000000000000000000000000000000000000000110000000000110000000000100000000100001101100010011000010101100110110010000001011000100000101110100001011010111010010101111010,DVBWXMIEUMPTHW-XJKSGUPXSA-N
C[N]1C2=C(C=N1)N=CC(=C2)NC3=C(C=C(C=C3Cl)C56CC4CC(CC(C4)C5)C6)Cl,1CC58F83085394F9_B6EE5EA940AF0646_7022_UN,8.198232,00000000000000000000000000000000000000000000000000001000000000100110000000010001100100010000011010100101010100001000000011101100100001110100001011001011000010101111010,QQIZEYJAPSIDMB-UHFFFAOYSA-N
C(C2CC1CC1C2)=CC3=C([N](N=C3C)CC4=C(C=CC=C4Cl)Cl)C,0AB8265C105BC03E_73073947805C2B55_7019_UN,8.742947,00000000000000000000001000000000000000000000000000001000000000000100000000010000100100010000001010011001010110010000100011101100110000100100001011001110010110101111010,ZDAVNQUAKLYLAT-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC4CN(CC3=CC=CC=C3)CCC4(F)F)C5CCNCC5,934B6FC370278BBA_17F7366755782A15_6034_UN,8.459638,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110001000010101100110100011000001011100100110000100110001001011011010110101111010,UQVZJJFOCPNZKS-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4=CC(=CC=C4)C5=C(C=CC=C5F)F,3DBC4CC7FD408DB6_38A2E3FA2213CE92_6041_DP,8.039461,00000000000000000001000001000000000000100010000000000000000000100100000000000100100101010011010010100000111100010000101011100100110101110100001011011011000010101111010,DXWUIRBIPUCAGS-REPLKXPHSA-N
CCC2=C1N(C=C(C1=CC=C2)C3=CCNCC3)C[C@H]4[C@@H](CNC4)C5=CC(=CC=C5)F,37F8DE6CC1BCB067_0E82C1CCA2FD04A4_6034_UN,8.195677,00000000000000000000000000000000000000000010000000100000000000100100000000011000101101110011000010111100110100010010001011100100110100100110001001011011010110101111010,XNGLPQXZJNIHQT-URXFXBBRSA-N
CN4CCC1=C(C3=C(N1CCC2CC2(C)C)C=CC(=C3)Cl)C4,C4CE81A2727086C1_2C165E3586155D12_6034_UN,7.785236,00000000000000000000001000000000000000000000000000000000000000000110000000110000100101110000010010101101010110011001101011100100110000100110011011011110010110101111010,WEYPYAGDNZDFMM-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC34CCC(CC3)C4,0168D6821D363054_576F21241CA83066_6041_UN,8.053897,00000000000000000000000000000000000000000010000000001000000000000110000000010000101100010011011010001100010100001000001011101100110001110100001001011001010110101111010,OXJNGPXFCNUOQU-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3CCC2(COC2)O3)F)CC4,6A076FA06E603E79_B9450EF6747FD619_6041_UN,6.7956657,00000000100100000001000000000000000000000010000000000000010000000010000010010001101101110011010110001000010111011001101011100000110011110110001010011011110111111111110,KVKSCPSXGPFMBA-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3C4(C3)C5=C(OCC4)C=CC=C5,685DFC57A2AC8A86_9DE206854509BA16_6041_UN,7.8189206,00000000000000000000001000000000000000100010000000000000010000000110000000000100001000010011000000101100010111001100001011000100110011110110001011010111110111101111110,ZEDYIKHAJVTPIS-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4=CC(=C(C(=C4)F)N5CCCCC5)F,23E22CF371196155_EF34734577F00A73_6041_DP,7.768444,00000000000000000001000001000000000000100010000000000000000000100100000000010100100101110011010010101000111100010000101011100100110101110110001011011011010010101111010,ASOZLUSXCWQVHP-ALXJQNPVSA-N
FC1=C(SC=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,20D4CC4ED8D79917_049CCE5F12399EFA_6041_UN,8.518414,00000000000000000000001000000000000010000010000100000000000000100100000000010101111101011011010010101000000100010000001011100100110001110110001010011011010110101111010,NBZNSQDOLFTNFY-WBMJQRKESA-N
CC2=C1N=C[N](C1=CC(=C2)NC3C4CC(C3)C(C4)F)C,B4FE08A154CFF31D_C2371FD351F6A7F8_6041_UN,9.091729,00000000000000000000000000000000000000000010000000000000000000000100000000010101100101010011010010000100110100010000000011100100110001110100001001001101000010101111010,PDKZOFUGEHMFSQ-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NCC(C2CCCN2)(C)C,FB28E9768F751326_D250CBEC60EAE114_7022_DP,8.447822,00000000000000000000000000000000000000000010010000000100000000000010000000100000101100010011000010011000100110011001101001000000110100100110001000010101010110101111010,UZXPMENRSSHYTR-UHFFFAOYSA-N
C2(=CC(=C1OCCC1=C2)CC#N)NCC3=CC4=C(C=C3)[S](CC4)(=O)=O,40055C21AB7748BC_AEA8A887F2C050CD_6041_UN,7.7437625,00000000000000000000000000000000000010000100000000010001011111000001000001000000011100001001000010001110010001011100001010001101101011011110001111111001110111110111110,JVFXJOJAHJXPDB-UHFFFAOYSA-N
C(CC2C1CC3CC(C1)CC2C3)=CC4=C([N](N=C4C)C5=CC=C(C=C5)Cl)C,678CA9BC8F7E4FB4_E2F0211B89AB6A28_7019_UN,8.193499,00000000000000000000000000000000000000000000000000001000000000100100000000010000100100010000001010010101010100000000000011101100110001110100001011001110000110101111010,ZIDLHDUSBYNHQV-UHFFFAOYSA-N
C(CC2C1CC3CC(C1)CC2C3)=CC4=C([N](N=C4C)C5=CC=C(C=C5)F)C,5B6A3A4592B8BDD4_CA2A663F894A63F8_7019_UN,8.193488,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000001010010100010100000000000011101100110001110100001011001110000110101111010,POKWXGJKFKRAOL-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)F,7FEB16AB1186C1C6_AE570766B6475A1F_6041_UN,8.90008,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,KXAXYLBBCASGPP-HOTGVXAUSA-N
CC2=C1SC(=NC1=CC=C2F)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,1BDBDA467FD25731_1934D813530C12DE_6041_UN,8.08035,00000000000000000000001000000000000010000010000100001000000000100100000000010101111101011011011010101100011100010000001011101100110001110110001011011111010110101111010,FETMWVGEONBKFD-KUHUBIRLSA-N
CC1=C(C3=C(C=C1)N=C2CCCCC2=C3NC[C@@H]4CN(C)C[C@H]4C5=CC=CC=C5)F,BD72A0771854C465_F720E3C10D5829A2_6041_UN,7.339183,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101100010110010001001011100100110001110110001011011111010110101111010,RCAILHASNWVMMA-CTNGQTDRSA-N
FC2=C1N=C(N(C1=CC=C2)CC3=C[N](N=C3[C@H]4CC[C@@H](C)O4)C)C5CCNCC5,487D754C64080C8B_805D193E66941924_6034_UN,8.614059,00000000000000000000000000000000000000100010000000001000010000100100000000010101101101110001011111101100110110010001101011101100110010100110001011011111110111101111110,KEWSMPQCZZJLFO-AUUYWEPGSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NCC3C(CCCC3)C4CC4)C,2472352187BC48DE_52E5224635F56B73_6041_UN,8.1691885,00000000000000000000001000000000000000000010000000000000000000100100000000000000101000010011000000101100010110000000001001000100110001110100001011010111010110101111010,HMRQHVGQTXOVQB-UHFFFAOYSA-N
FC1=CC(=C(C(=C1)F)NCC2CCCCC2C(C)(C)C)F,D79BE26C54759158_F4C995EC01DE01EE_6041_UN,8.66344,00000000000000000000000000000000000000000010000000000000000000000010000000100000001000010011000000001000000110001000101000000000110001110000010011010111010110101111010,PDDKFBYAVWJKAR-UHFFFAOYSA-N
N(CC12CC(C1)OC2)C(=O)C3(CCCC3)C4=CC(=CC(=C4)F)F,EC9F00374DC3A9AC_B7107426211F43F6_6038_UN,7.103198,00000000000100000000000000000000000000000010000000000000010000100010000000000000001100010011100011001000010101101000011000000000110010100110000000010001111111110111110,WMZVGNZQWXOCPE-UHFFFAOYSA-N
C(CC1CCCC1)=CC2=C[N](C)N=C2C3=C(C=CC(=C3)F)F,CBD20DBFAB3539CB_1EDC120B897BB4EB_7019_UN,8.384749,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010000000100000000001011101100110000100100001010011010000110101111010,AZGBNWBHMLTTFB-UHFFFAOYSA-N
FC1=C(N=CC=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,404938C2B47D600F_447259664A6EA868_6041_UN,8.452114,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,UVNQNJZIQUARMS-DYVFJYSZSA-N
CCOC(OCC)C5=NC1=C(N=CC(=C1)NCC23CC(C2)CN3CC4=CC=CC=C4)[NH]5,37D9B89E457FB050_3C38E096DE973D93_6041_UN,8.188098,00000000000100000000000000000000000000100000000000000000000000000110000000010101101101100011000110101100010001011010000011110110110101010110001001001111010111111111110,HSUCPMRVVIMVJD-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NCC3CCCC(O3)C4CC4,5777A70FDF860A2C_174D1CEF2F48A579_6041_UN,8.154011,00000000000000000000001000000000000000000010000000000000010000100100000000000000101000010011000100101100010100000000001011000100110011110100001011010011110111101111110,CMJBPRKAWSXUIZ-UHFFFAOYSA-N
C(C1=NOC2=C1CCCCC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,DCBFFCDA3F35F982_0962DFF1D64DACBF_7019_UN,8.063611,00000000000000000001000000000000000000000010000000000000010000000100000100000000000101010000011011010110010110010000101011101100110011110100001010011010100010101111110,DQCBYAZIAHICAJ-UHFFFAOYSA-N
C1CC(CCN1)C2=CN(C3=C2N=CC=C3)CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,DD2081DAB68BB73C_19285E4B15D3A8D9_6034_UN,8.584985,00000000000000000000000000000000000000000000000000000000000000100100000000010001101101110001000010101101110110010010101011100100110100100110001011011011010110101111010,MBHNALDZWOUZLI-UHFFFAOYSA-N
C[N]1N=C(N=C1NC2CC(OCC2)C3=CC=C(C=C3)F)C4CCOCC4,179CC1C099AC23E2_9B8C2B901D353574_6041_UN,7.614622,00000000000000000000000001000000000000100010000000001000010000100100000000010101100100110010011011100000101101010000001011101100110011110110001011011011110011111111110,ONFLMSQNABFMMK-UHFFFAOYSA-N
N2CCC(OC1=C(C=C(C(=C1)F)F)C#N)CC2C3=CC=C(C=C3)F,4AB85E2C691276D7_DD476AC105EE0C00_6003_DP,7.6401224,00000000000000000000000000000000000000000110000000000000000000100000000000000000001000010001000001101000100100010100001001000111110010100100001111010011110011100111110,FPZPHGUSZYYCHG-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2CCC3(CC2)CC3,1820AE6ED3C161D4_C67B6E8646D94CDF_6041_UN,7.292297,00000000000000000100101000000010000000000000000000000000000000000110000000100001001000100011010000101000010000001000001001000000110001010100011011011111010110101111010,DXCYNRIMEQGXIW-UHFFFAOYSA-N
N1CC2CCCC1C2C=C[C@@H]3CCO[C@H]3C4=NC=C[N]4CC,D539668F3D7C4F30_303A57FA9BC36578_7019_DP,7.8451877,00000000000000000001000000000000000000100000000000000000010000100100000000010101001101000011000110011000110001010010001011100000110010000110001010011011110111101111110,NEEWWPYGNPZPNB-AREZLUIZSA-N
C1(=CC2=C(N=C1)OCCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,D49AB14D247C6187_CAA66EB822CEEFC1_6041_UN,8.918255,00000000000000000000000000000000000000000010000000000000010000100100000000010001100101110011110010101100110111110101111011100100100011110110001011011011010011101111110,BNBZTAHVZVBJLP-MSOLQXFVSA-N
CN4CCC1=C(C=CC=C1NCC2(C)CCC3(CC2)CC3)C4,D2B87E103E8A65E3_E52761D8116A028E_6041_UN,6.8146405,00000000000000000000001000000000000000000000000000000000000000000010000000010000001001100011010000101100010000011001101001100000110001010110001011011101010110101111010,SQDDHIWYLDOWGW-UHFFFAOYSA-N
CN1CCN(CCC1)C2=NC=C(C=C2)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,5DF23BA2E09287DA_A8BDB4DCB34D98E4_6041_UN,7.3736434,00000000000000000001000000000000000000100010000000000000010000100100000000010101101101110011010011101000000111010001101011100100110011110110001001011011110111101111110,KAZVBNNCALPOLT-AVRDEDQJSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3(C)CCC4(CC3)OCCO4,08E03A1F9ADEFC98_BCC768DA80A42E19_6041_UN,7.54991,00000000000000000000000000000000000000000010000000001000010000000110000010010000100100010010011010000100110101011001101011111100110011110110001001011101110011111111110,DFPXQPJBRDIZID-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NCC34CCCNC3C4,0401DB1EDBA02C6E_F46BEBC13665920A_6041_DP,8.401584,00000000000000000001001001000000000000000010000000000100000000000110000000010101101101010011010010101100111110011000001011100100110101110110001011011011010110101111010,RRZTXAOZAAORAA-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC(C2CCCN2)(C)C)F)CC3,78590C5B91A19453_01E26C0C763F1D0E_6041_DP,8.064302,00000000000000000001000000000000000000000010000000000100000000000010000000110001101101110011010010001000100110011001101011100000110101110110011010011111010110101111010,ASHOJHIOGQNOLZ-UHFFFAOYSA-N
NCC(OC2=C1CNCCC1=C(C=C2)F)C3CCOCC3,73226D4BACCCDDCB_1AE852BDCACE3CB9_6035_UN,8.252382,00000000000000000000000000000000000000000010000000000000010000000000000000000000001010110001000101101100110101010100001011000011110110100110001111010001110101110111110,DZRIOXRACCJJMT-UHFFFAOYSA-N
N1CC(C1)[N]2C=C(C=N2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,05AE5B281B7AA56D_440C04FC15ED34DE_6041_DP,8.485984,00000000100100000000000000000000000000000010000000001000000000100100000000010001101101110011011010001000100110010001101011101100000101110110001000011011010010101111010,ZUGZHQQBBRWTHD-SJORKVTESA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CCCC4=CC(=C(C=C4)F)F,BEF7831A70146426_5D68A9302AC3FD49_6038_UN,7.4170012,00000000000000000000000000000000000000000010000000000000000000000000000000000000000000010011100000000100110100110000011000000000100011100000000011010011001110100111110,WVCMDDCUIJJLHD-UHFFFAOYSA-N
C2(=CC1=C(C=CC=N1)S2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,9D72DF3EA5484F23_36FC4D7FB2A0BA3F_7022_UN,8.142289,00000000000000000000000000000000000010000000000100000000000000100100000000010000111101111011010010101101010110010001101011100100110001110110001001011011010110101111010,FFFMNVDPHLROII-UHFFFAOYSA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CCCC4=CC(=C(C=C4)Cl)Cl,D11C0F4669AF59B9_C194CBAD9CBFD1DA_6038_UN,7.41693,00000000000000000000000000000000000000000000000000000000000000000000000000000000000000010011100000000101110100110000011000000000100011100000000011010011001110100111110,CQMYKRDGWSGSTE-UHFFFAOYSA-N
CN3CC[C@@H](NC(C2C1CCC(N1)C2)=O)[C@@H]3C4=CC(=C(C=C4)F)F,C5E213EFC466D7FC_AB38E9FE02FDE73C_6038_DP,7.741014,00000000000000000000000000000000000000000010000000000100000000100000000000010001100101110011110011001000110110110001111011100000110101100100001011011011011010101111110,TVCILRLCNQNVBX-BNDLUWFVSA-N
CN3CC[C@@H](NC(C2C1CCC(N1)C2)=O)[C@@H]3C4=CC(=C(C=C4)Cl)F,D287F172FD9358C9_E854DB80A0DEDB11_6038_DP,7.7410035,00000000000000000000000000000000000000000010000000000100000000100000000000010001100101110011110011001001110110110001111011100000110101100100001011011011011010101111110,GTNBTBSJSHHRJF-BNDLUWFVSA-N
FC1=CC4=C(C(=C1)NC3=C(CN(C)C2CCCCC2)C=CC=C3)C=CO4,73B65F2826B36A2A_FE54C3887531DF0C_6041_UN,8.166723,00000000000000000000000000000000000000000010000000000000010000000000000000000000100101110010010011001100010110010001101000100100110001110100001011011011110110101111110,WUXWPLPPWAYYHI-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3(CCOCC3)CC4=CC=C(C=C4)F,6FDDC19BD283EA28_567E148E4D00E761_6041_UN,7.77328,00000000000000000000000000000000000000100010000000000000010000100110000000010100100101110010010011101000100111011001101011100100110011110110001001011011010111101111110,NNFBYBLGRQDQMQ-FQEVSTJZSA-N
N(CC1C2=C(CC1)C=CC=N2)[S](C3=C(C=CC(=N3)C4=CC=CC=C4)C#N)(=O)=O,CEEEDFE7CE0FAC71_B18E09DF4F3BC642_6028_UN,8.158439,00000000000000000000000000000000110000000100000100010001001111101101010001000001111000001011001110101110011000001000011011001100111000001100001011011011010110110111110,UZEQRBIGRKERAX-UHFFFAOYSA-N
CC1=C(C=CC(=C1)NCC2N(C)CC3(CC2)CCC3)F,E13A832FB3FB4482_004232B6114935C4_6041_UN,7.288951,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011111010110101111010,IBMYMLCMMGGLQO-UHFFFAOYSA-N
O(C(=O)CC1=C[NH]C2=C1C=CC(=C2)F)CC3CC4CCC3C=C4,09631B2F8EE149B5_C82E8C5FA8B1D909_6031_UN,7.9920025,00000000000000000000000000000000000000000010000000000000000000000100000000000000000100010011000010010100010101000000001001010110110010100100000001010001011111010111110,RGSUKKCZHMRAGT-UHFFFAOYSA-N
O(C(=O)CC1=C[NH]C2=C1C=CC(=C2)Br)CC3CC4CCC3C=C4,ECB8A9C364B8170A_A5E7FA7309DE0188_6031_UN,7.991949,00000000000000000000000000000000000000000000001000000000000000000100000000000000000100010011000010010100010101000000001001010110110010100100000001010001011111010111110,RIBUAPSTPHELTI-UHFFFAOYSA-N
O(C(=O)CC1=C[NH]C2=C1C=CC(=C2)Cl)CC3CC4CCC3C=C4,97CA582EBE07A6FA_02024755F830CB01_6031_UN,7.991935,00000000000000000000000000000000000000000000000000000000000000000100000000000000000100010011000010010101010101000000001001010110110010100100000001010001011111010111110,DBRNPHNECQLPPN-UHFFFAOYSA-N
CC1=C(C=CC(=C1)NCC2N(C)CC3(CC2)CCC3)Cl,CC45AF741FBB45D1_8C6F121E524E8910_7022_UN,7.2889643,00000000000100000000000000000000000000000000000000000000000000000010000000010001001001110011010000101001010110011001101001100000110001110110001011011111010110101111010,VKUGMEMZHJRHSS-UHFFFAOYSA-N
C[N]1N=C(C(=C1)C2=C(C3=C(C=C2)C=CC=C3)F)C4NCCCC4,A152946957A513B0_FDE6273BE85B3C82_6005_UN,8.558577,00000000000000000000000000000000000000000010000000001000000000100100000000010001101100010011011010101100110100010000001011101100110000100100001011011011010010101111010,HMJFUEUPETUHGA-UHFFFAOYSA-N
C5CC1=C(N(C=N1)CC3=CC(=C(N2CCN(C)CC2)C=C3)F)C4(CCOCC4)N5,D3D5CC589C60AF0F_1D680EEC400AB4D9_6034_UN,7.3185472,00000000000000000000000000000000000000000010000000000000010000100110000000010101101101110011010011101100110101011001101011100100110011110110001011011011010111101111110,QLIWXWWYKIXWGH-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CCC3)C4=C(C=CC=C4F)F,009FDB3033B6238E_21227D8EF2592E0B_6041_UN,7.9643426,00000000000100000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,HISZEORDUPNORZ-SFHVURJKSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NCC4=C5C(=CC(=C4)F)COCO5,8D14A7F8AC5B308B_DF325543159171E8_6041_DP,8.387139,00000000000000000001000000001000000000100010000000000000010000000100000000000101101101110111010011101100110101010100101011110100110101110110001011011001110111111111110,QDAXAGAYJNDPDT-BCDXTJNWSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC4=CC=CC(=C4)CC5CCCN(C)C5,D49C86AC462FC326_35B3DA6F68A26393_6041_UN,7.1836095,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101110001010010101100010111010001101011100100110011110110001001011001010111101111110,HKOBSQMKQLTGEI-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC3(CCOCC3)C4=CC(=CC=C4)F,CD4EFF34D958A3BB_534FAEBFDDE199D9_6041_DP,7.6878777,00000000000000000000000000000000000000100010000000000000010000100110000000010101101101110011010011101000100111011000001011100100110111110110001011011011010011101111110,OVACUFGFWGQGMT-UHFFFAOYSA-N
C1(=CC=C(C=C1)C[N]2C=CN=C2)NC34CC5(C)CC(C3)(CC(C4)(C5)F)C,C6C80C6617C8A79F_7275AB503C879B94_7022_UN,7.678038,00000000000000000000000000000000000000000010000000000000000000000110000000010101000101010001000010001100110110011001000011100100100001110100001001001101010110101111010,OOWKUGOMMSSLKV-UHFFFAOYSA-N
CC(C=CC1=C[N](C)N=C1C2=C(C=CC(=C2)F)F)C3CCCC3,0BCC8CD8020B42D6_25D90A798CF4022D_7019_UN,8.153784,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010000000110000000101011101100010000100100001010011110000010101111010,PYBJYLPSNKICDK-UHFFFAOYSA-N
O([C@H]1C[C@H](NCC1)C2=CC=CC=C2)C3=C(C=C(C=C3F)C#N)Br,150ABE98627B02DF_7836D2BD3F1B9F47_6035_UN,7.588443,00000000000000000000000000000000000000000110001000000000000000100000000000000000001000010001000001101000100100010100001001000111110010100100001111010011110011100111110,IBJWOUZILLJAJI-PBHICJAKSA-N
O([C@H]1C[C@H](NCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Cl)C#N)Br,9DB7F801F4A20482_3A6DC07B894425E6_6035_UN,7.5884295,00000000000000000000000000000000000000000100001000000000000000100000000000000000001000010001000001101001100100010100001001000111110010100100001111010011110011100111110,SWXLAOXZUDGZNK-PBHICJAKSA-N
O([C@H]1C[C@H](NCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Br)C#N)Br,6C244C4B4297381E_82E52DCD147607FF_6035_UN,7.588429,00000000000000000000000000000000000000000100001000000000000000100000000000000000001000010001000001101000100100010100001001000111110010100100001111010011110011100111110,RRCGGWLBAWRRNC-PBHICJAKSA-N
CN4CCC1=C(C3=C([N]1CCC2CCCNC2)C=CC(=C3)Cl)C4,82DB8B867390E664_FD88D5D1744B922F_6034_DP,7.489538,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101110011010010101101110100010001101011100100110000100110001011011001010110101111010,DFNJVTONTUQWNP-UHFFFAOYSA-N
FC1=CC5=C(C(=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)[NH]C=C5,073A5902221D9B94_24D1A4D383C08020_6041_UN,8.420551,00000000000000000000001000000000000000000010000000000010000000100100000000010101101101010011010010101100010100010000001011100100110101110110001011011011010110101111010,RAVUFIOZWNPCMU-VFNWGFHPSA-N
CN3CCCC(CCOCC1CNCC2(O1)CCC2)C3,59FB0CCBF7119981_9B2694216A14A531_6039_DP,7.4484015,00000000000100000000000000000000000000000000000000000000010000000010000010010000001001100011010101101000010011011001101011100010110010000110001001011001110101111101110,WBRVKUFTQDTEMU-UHFFFAOYSA-N
C1(=C(C(=CC=C1)C#N)Cl)NC(C2CNC2)C3=CC=C(C=C3)F,C9875D084E9BE71B_B7E04A299B6A33E2_7022_DP,7.853129,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110010000000001001000100000000000001000100000101110110001011000011010010100111010,HRDDACNENUYERK-UHFFFAOYSA-N
C(C2COC1(CCCCC1)O2)=CC3=C[N](C)C4=C3C=C(C=C4)F,6421D15600E572C2_9B381CAC565156BF_7019_UN,8.256136,00000000000000000000000000000000000000000010000000000000010000000100000010010000000101010000010010010100010101001000001011110100110010100100000001011000110011111111110,HQLPQAPXSVDVQH-UHFFFAOYSA-N
C[N]1N=C(C=C1NCC2(CCC2)C3=CC=C(C=C3)F)C4CCCC4,8B93151140E0ECB5_ED1AD1AA99D5145B_6041_UN,7.7802496,00000000000100000000000000000000000000100010000000001000000000100110000000010101101100010011011010001000000110001000001011101100110001110100001010011011010110101111010,RXBQEBWXPZLFQR-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3OC4(CC3)CCC4,8FEA09053FE61C0A_C50F1D6F9E8A29DB_6041_UN,7.2864304,00000000000100000000000000000000000000100000000000001000010000100110000000010101101101000011011110001000010010001000001011101100110011010100001010011111110111101111110,AAKJBRSSHVEUCU-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)N[C@@H]4C6=C(OC5(C4)CCCC5)C=CC(=C6)F,76DF549F796C93D2_3BFFC6B471786689_6041_DP,8.18021,00000000000000000001000000000000000000100010000000000000010000000110000000000101100101010011010011100100110100011100101011100100110111110100001011011001100011101111110,XGIMAPNAIBDJSW-JTJHWIPRSA-N
N3CCC(C)(COCC2CCC1(CCOCC1)CO2)C3,86F5D2D44467B4E7_B84D084CF330F3C2_6039_DP,7.4894366,00000000000000000000000000000000000000000000000000000000010000000010000010000000001100100011000011101000110011011001101011000010110010000110000001110001110101111101110,SPQROAOPZNTQGD-UHFFFAOYSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NCC4=C(C3CNC3)OC=N4)C5,827B458BD9427B45_F781E68119904F14_6041_DP,7.9033723,00000000100100000000000000000000000000000000000000000000010000100100000000010001101101100011010111101100110000110001111011100100110101010110001011011011110110101111110,BPXKNJNEKKZKFN-UHFFFAOYSA-N
C2(=C1OCCCC(C1=CC=C2)=O)NC4=CC3=C(C=C[N]3C)C=C4,705F19222C842AAE_1D26A404D8C514E4_6041_UN,9.478685,00000000000000000001000000000000000000000000000000000000010000000100000000010000100101000101010110000100010001000100001011100101000011010100001111011001111011111111110,FEANCVQNDBNIHC-UHFFFAOYSA-N
C1CC(CCN1)C3=CC2=C(C=CC=C2)[N]3CCC4CNC(C4)(C)C,D9D03DBD75EB2A3E_508504BAEC0B9AD8_6034_DP,7.7066402,00000000000000000000000000000000000000000000000000000000000000100110000000110000001101100011000010101100110010011001101011100100110100000110001011011111010110101111010,BZCDSZZJSJKFDO-UHFFFAOYSA-N
CC1=C(SC(=N1)C2OCCO2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,145404B5B76F9E4B_A3038A88C5666486_6041_DP,7.417658,00000000000000000000000000000000000010000010000100000100010000100100000010000001111100111011000110101000100111010000001011010100110111110110001011010011010111111111110,IRWHGPCPRPYUJQ-GOEBONIOSA-N
O=[N](=O)C2=C1C=CC=NC1=C(C=C2)NC4=C3OCCCC3=CC(=C4)F,7B8E3399D71417D3_14A5B38D070F7F9B_6041_UN,8.162809,00000000000000000000000010000000000000000010000001000000110000010100001100000001100000010001001100100110010101000100001111101100101011110100001011111001110011110111110,ZBFLGBSUADGREW-UHFFFAOYSA-N
C[C@@H]1CNC[C@H]1C=CC2=C(Cl)C=CC=C2N3CCCCC3,3EC0903A76090BCF_198D260E1829428A_7019_DP,9.090724,00000000000000000000000000000000000000000000000000000000000000100000000000010000001101110001000010111001000110010001101011100000110001110110001011011011010010101111010,VOUUDMQKDIAHKK-HUUCEWRRSA-N
CC1=C(C=CC(=C1F)C#N)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F,546D8AFAC1C1C625_F8ACF57CD76DF9E4_6041_DP,7.820942,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010101111010,CMDDLGMWCJFZIK-RDTXWAMCSA-N
FC1=C(C=CC(=C1)NCCC2CCN(C)CC2)OC3CCOCC3,B6AA58846134F571_9ECEDE737921D02A_6041_UN,7.4236035,00000000000000000000000000000000000000000010000000000000010000000000000000010000001001110101010000101000100101010101101011100011110011110110001111011011110111111111110,UYEORIPWHQKYCS-UHFFFAOYSA-N
CSCC1=C(C=CC=C1)NC2CNCC23CCOCC3,0B538A63435CDDB3_7A3343A90BAE3291_6041_DP,8.459535,00000000000000000000000000000000000000000000000000000110010000000010000000000001101100101011010010101000110001011001001011000000110111010110001011010011010111101111110,GRKZMBAUOAIZBH-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)CCC2)NC(CC)CC3=C[N](C)C4=C3C=CC=C4,9C7813B7905872AE_40FA1567F3E0827B_6041_UN,7.7833467,00000000000000000000000000000000000000000010000000000000000000000100000000010000000101010011010010000100110110010010101001100100010001110100001011011111000110101111010,RYYILZLDBYEXRA-UHFFFAOYSA-N
C1(=CN=C(S1)C2CCCCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,F67B8E4000CE3C68_1E8E5ADED84E7E7E_6041_UN,8.20622,00000000000000000000000000000000000010000010000100000000000000100100000000010001110101111011010010001000100110010001101011100100110001110100001011011011010010101111010,UGCBVVUVQCFXPQ-MJGOQNOKSA-N
CC1=C(N=CC(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,C15BC6F73F2FCAAC_AEC698714190C29C_6041_DP,7.1127343,00000000000000000000000000000000000000000110000000000100000000100100000000000001101000110011000000101000100100010000001011000100110101110110001011010011010110101111010,WRXNNEKBXDWOEY-MAUKXSAKSA-N
N(CC1CC2CCCC(C1)C2)C(C=C(C)C3=C(C=C(C=C3)F)F)=O,BFC4A89A9173A9AE_96E6E8276712D692_6038_UN,7.8898935,00000000000000000000000000000000000000000010000000100000000000000000000000001000001000010010100000011100010100100000011000000000110000100000000011010011011110101111110,DRGSSZBTPXDKDQ-UHFFFAOYSA-N
CC5(C)CN(CCC1CCC2=C(C3=C(N=C12)N=CC=C3)C4=CC=C(C=C4)F)CCS5,30A32924C8691619_F0125566166E0768_2201_UN,8.737243,00000000000000000000000000000000000010100010000000000000000000100110000000110100010001111000000010101100010110011001101011100100110000100110001011011100010110101111010,FVLPGALMVYXOCQ-UHFFFAOYSA-N
C1(=CC2=C(C=C1)OCC(=O)C2)NC3=CC=C(CSC)C=C3,70F843DDF74C7E4C_C2F32F76B8C20E0E_6041_UN,8.56217,00000000000000000000000000000000000000000000000000000000010000000000000010000000000000101001010000100100010001000101000000000101100011010110000111000001111111111111110,GACBOUXFAVUSRV-UHFFFAOYSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NCC3CNCC(O3)(C)C,710ADA4B3EF974DD_11367B58937FD3F9_6041_DP,8.236828,00000000000000000000000001000000000000000010000000000100010000000110000000110101101101110010010110101100011110001001000011100100100111110110011011001111110111101111110,XQNJSZMXKRDZKZ-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CCCC3=CC(=C(C=C3)Cl)Cl,5F854FD6D0F0A867_1D848B06881C8D24_6038_UN,7.8552628,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010011100000001101110100110000011000000000110010100000000011010011011110100111110,PUINNGAMHVJBET-UHFFFAOYSA-N
FC5(F)CCC1(CC1C=CC2=C[N](N=C2C3=C(C=C(C)C=C3)C)C4=CC=CC=C4)CC5,082AD0BC6ED4743F_4B51417269D2D360_7019_UN,7.9798613,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011110000010101111010,JRQZITPQSCNCNY-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CCCC3=CC(=C(C=C3)F)F,184D2267EF15F56E_8178E99B3E60A1B7_6038_UN,7.8552437,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000001100110100110000011000000000110010100000000011010011011110100111110,PBOKUALXRHMFNF-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(CN(C)CCC2)C)F)CC3,ADE22D1447CDE775_DE02F4D9174F2E90_6041_UN,7.6293855,00000000000000000001000000000000000000000010000000000000000000000010000000010001101001110011010000101000000110011001101011100000110001110110011011011111010110101111010,CXWQSKSSAGPZKV-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C3=C(SC)C=C(C=C3)F)=O,1DC79AA89771D5A8_3B6100E92602D168_6038_UN,8.085926,00000000000000000000000000000000000000000010000000000000010100001000000000000000011100011001110010001000110100110000011000000000110010100100000011010011111111111111110,OCHXIPSBDPISGZ-UHFFFAOYSA-N
C(C2=CC1=NON=C1C=C2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,0D20FF2F8F584DF1_C783B722578E5ED2_7019_UN,8.595736,00000000000000000000000000000000000000000010000000000000010000000100000100000101000101010000011011010110010110010000101011101100011001110100001011011010000010101111110,OQRIQOMRYFDDLZ-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC[C@H]4[C@@H](C4)C5=C(C=CC=C5F)F,2E4DA1E32A4E67BC_7F5B657710B66172_6041_DP,7.8283887,00000000000000000001001000000000000000100010000000000000000000100100000000000101101101010011010010101000110100010000101011100100110101110100001011011011010110101111010,PEPZZTIHDCTKHE-ZOFXXKQRSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC3CCN(C)C4CCCC34,D736B6494B14CF0A_A6C52D84368B30CC_6041_UN,7.5325108,00000000000000000000000000000000000000000010000000000000010000100000000010010000100101110011010010101100110111010001101011110000110011110110001011011011010011111111110,KNLJXJIDEXVUTM-UHFFFAOYSA-N
FC2=C(C=C1OC=CC1=C2)NC3=CC=CC(=C3)C4CCN(C)CC4,E401E641F42663C9_E2359D7800F79799_6041_UN,7.839416,00000000000000000000000000000000000000000010000000000000010000100000000000010000000101110000010011101100010100010001101011100100110001110110001011011011110010101111110,FRWAIOTYYZCZGN-UHFFFAOYSA-N
OC(CF)C1=CC=C(C=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,DC08E348B77B106F_E91CFA8DDDD78351_6041_DP,8.798139,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101100011010010001000100010000000000011100100110111110111001010001011110111101111110,DCTMDLJHUXASMU-GZJFXKPMSA-N
OC(CBr)C1=CC=C(C=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,907AAB6D68EB5F16_9EC2990A7F5C543A_6041_DP,8.798129,00000000000000000000000000000000000000000000001000000100000000100100000000010101101101100011010010001000100010000000000011100100110111110111001010001011110111101111110,NDZUVBBTRZJOQF-GZJFXKPMSA-N
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)CC3N(C)CCCC3,B48D26D0463A2FA4_ABEB677B03086003_6039_UN,8.283113,00000000000000000000000000000000000000000010000000000000000000100000000000010000000001110000010100101000000111010001101001100011110010100110000111011010110111101111110,XVNSIRHYKDFQET-JGNLYWJMSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC(N3CCOCC3)C4=CC=C(C=C4)F,90F20258FF882B45_5C80C16F7E11E08B_6041_UN,7.7918115,00000000000000000000000000000000000000100010000000000000010000000100000000010101001001110001000100101100010111010000001011100100110011110110011011011111010111101111110,RALRQKRBORSROM-UHFFFAOYSA-N
NCCC(OC1=CC=C(C=C1)C2=CCNCC2)C3=CC(=C(C=C3)Cl)Cl,70F50DC73FD66AC4_C7D933C511A369CB_6035_UN,8.203829,00000000000000000000000000000000000000000000000000100000000000100000000000001000001010110001000001111001100100010100001001000111110110100110001111010011110101100111110,ZTFURNNFHFZHEY-UHFFFAOYSA-N
C2(=C1OCCCC1=CC=C2)NC3=CC(=C(C=C3)Cl)CN(C)C,7CB81A692B3C800A_09537267C730C8E9_7022_UN,7.7264357,00000000000000000000000000000000000000000000000000000000010000000000000000100000000001110001010100101101010101000101001000100100100011110110001011011111110111101111110,OAJJQBGHJSFXEC-UHFFFAOYSA-N
C(C1COCCN1)C2=C[N](C3=C2C=CC=C3)CCC4CNC(C4)(C)C,722B2F0D57B03A72_6B2B0F929C1E693F_6034_DP,7.312386,00000000000000000000000000000000000000000000000000000000010000000110000000110000001101100011000110101100110011011001101011100100110110000110001001011101010111101111110,FHFZHDDGPMPPPP-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2OC3(CCC2)COCC3)F)CC4,0A08A1CC35B387B5_F1A2AF14976E237B_6041_UN,6.773638,00000000000000000001000000000000000000000010000000000000010000000010000010010001101101110111010110101000010111011001101011100000110011110110001011011011110111111111110,FYEQBHXGGVTTSN-UHFFFAOYSA-N
ON=C1CCCC2=C1C4=C(N2CC3CCNC(C)(C3)C)C=CC(=C4)Cl,D33CEDE88AFEFCDD_A2B4C36117D400D5_6034_UN,7.954103,00000000000000000000000010000000000000000000000000000000000000000110010100110010101101010011001010101111110110011001101111101100110101100111001011011101010110101111110,LRVHDMQTUYRHKA-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)C#N)F)NC(C2CNC2)C3=CC=C(C=C3)F,EEF8CF1B768CAE93_4F29D9BF530143E2_7022_DP,7.9861164,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110010000000001000000100000000000001000100000101110110001011000011010010100111010,ONXQTPVEVAFUAF-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NC[C@@H]2CCCO[C@H]2C3=C[N](C)N=C3,A6C48DA0F8F5C6A8_B0531D34D9B9BEAA_7022_UN,8.479645,00000000000000000000000000000000000000000010010000001000010000100100000000010000101100010011011011111000000101000000001011101100110010100110001001011011110111101111110,KXKJXZGSQVCQFE-KBXCAEBGSA-N
N(C(CF)C1=CC=C(C=C1)C#N)C(CC3CC2CCC(N2)C3)=O,747F8ED500F1D0FA_570A797209477739_6038_DP,8.090961,00000000000000000001000000000000000000000110000000000000000000000000000000000000000100000011100010100000110000110000011001000000110110100100001001010001011110100111110,WSYJFRPQFTVKIK-UHFFFAOYSA-N
FC1=CC=C(C=C1)[N]4N=C(C=CC2=C([N](C)N=C2)C3CC3)C5=C4CCC5,1EBDD74CC4F2E07B_4BE0A5FDEF7CAF34_7019_UN,7.8253555,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010000011010010100010110010000001011101100011001110100001010011010000010101111010,XKDAQXKNVAMYAO-UHFFFAOYSA-N
C1(=C(OC=C1)Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,E34F901F127E5102_4A6E416E13BD4D8B_7022_UN,7.907287,00000000000000000000001000000000000000000000000000001000010000100100000000010001101101010011011111101001000100010000001011101100110001110110001010011011010110101111110,AKMSLFBQBHOBAH-WBMJQRKESA-N
C[Si](C)(C)C1=C(C=CC=C1)NC3=C2CCCC2=CN=C3,E57A2EC651CCE586_B2520756623ADDF6_6041_UN,7.72165,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100011010010100100010000001000001001000100010001010100011011011111000010101111010,PYNAQYHCZXKDKP-UHFFFAOYSA-N
N4CC1=C(C=C(C=C1)N[C@H](CC)C2=CC(=C(C=C2)C)F)C3(CC3)C4,69FB7BAE63C3C956_528401B92D947EBF_6041_DP,8.112547,00000000000000000000001000000000000000000010000000000000000000000010000000000000001000110011000000101100110100011010000001000100110101110110001011010111010110101111010,UTVBYLXDQWLWCG-HXUWFJFHSA-N
CN(C)C1=CC2=C(C=C1)N=C(Cl)N2CC3CCCC3OC4CCCCO4,33652A7D222E9EC1_45849A47AC4390C2_6034_UN,7.7105308,00000000000000000000000000000000000000000000000000000000010000000100000000110101100101110000010011101101011101000000001011110111110011110110001111011110110111111111110,GXLDVRDKHVQDCH-UHFFFAOYSA-N
BrC2=CC(=NCCC1=NC=CC=C1)C=CN2CC4[C@@H]3C[C@@H](C3(C)C)CC4,3C8A5019D70730AD_8678A7BE6E45CC20_6034_UN,7.984294,00000000000100000000000000000000000000000000001000000000000000000110000000110010100001010000000000101000010110011000101111100100110001110110001011011110010110101111010,AIOBIQHZPXKIBR-IZVBFETMSA-N
CN3CCN(CC1=C(C=CC=C1)NCC2(COCCNC2)F)CC3,D97FF05B79BE3840_3FBAB96718090C83_7022_DP,7.283246,00000000000000000001000000000000000000000010000000000100010000000010000000010001101001110011010101101000100101011001101011100000110111110110001011011011010111101111110,NQNNYQSMKNJGGO-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC3CC4(C3)CCOC4,1278860D14D12D7E_8B0BAF3124F4FEA5_6041_UN,7.400465,00000000000100000000000000000000000000100000000000001000010000100110000000010101100101100001011010000000110001011000001011101100110011010110001010011111010011101111110,RSSCQHWANBIBLW-UHFFFAOYSA-N
CC2=C1N=CC=CC1=C(C=C2)NCC(N3CC(C)OC(C3)C)C4=C(C=CC=C4F)F,B54F78D939572F6A_C9B23952CDAB060E_6041_UN,8.45178,00000000000000000000000000000000000000000010000000000000010000000100000000010001101001110001000100101100010110010001000011100100110011110110011011001111110111101111110,BGTFPCDGABIOHM-UHFFFAOYSA-N
CC2=CC1=C(C(=CC=C1)Cl)N2C[C@H]3[C@@H](CNC3)C4CCOCC4,1CCD3593D6BBD912_8876888634726741_6034_UN,8.283685,00000000000000000000000000000000000000000000000000000000010000100100000000010000101101110011000010101101010101000000101011100100110010100110001011011011010111101111110,IFBVORLSWFKJFF-IRXDYDNUSA-N
CC2=CC1=C(C(=CC=C1)F)N2C[C@H]3[C@@H](CNC3)C4CCOCC4,81BE736C4F32C69B_7F01BA9CF9159D99_6034_UN,8.283673,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011000010101100010101000000101011100100110010100110001011011011010111101111110,QUSIFILVRPEPDD-IRXDYDNUSA-N
CC2=C1CCCC1=CC(=C2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,90473ECBC34EBFB1_290D58E13809136D_6041_UN,7.7955337,00000000000000000000000000000000000000000000000000000000010000100000000000010000101001100001010110101100010011010001101011100100110011010110001011011111110111101111110,SWVSIXQYMHBDDM-VXKWHMMOSA-N
C1(=CC2=C(N=C1)OCCC2)NC3=CC=C(CO[Si](C)(C)C)C=C3,E4C92393B4BC68EC_7160BE41D971200A_6041_UN,7.8525257,00000000000000000000100000000010000000000000000000000000010000000100000000100001000000100001110000100110010001101100111011001110100011010110011011011101010111111111110,OPFOMLDQKCXNRV-UHFFFAOYSA-N
C1(=CC2=C(C=C1)CC3CCC(C2)C3=O)NC4=C(C=CC(=C4F)F)C#N,D829C3183C53E36C_38150DF6601A5A85_6041_UN,8.229744,00000000000000000001000000000000000000000110000000000000000000000000000000000000100000010001000010000100010100000000001000000101110001110000001111010011101010100111110,QUMQXCZYDVEXCS-UHFFFAOYSA-N
FC1=CC2=C(C=C1)[NH]C=C2NCC3CCCC(CC)CC3,63CA403479E61809_12ED1D611C2121B2_6041_UN,8.633112,00000000000000000001000000000000000000000010000000000110000000000100000000000001101100010011000010001100010110000010101001000100110101110100001000010001010110101111010,GGUWSMHXDOLNGQ-UHFFFAOYSA-N
C1(=CC=C(C=C1)CN2CCCCC2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,CB05CE6071810668_9313E4B9287AD306_7022_UN,8.05743,00000000000000000000000000000000000000000000000000000000000000100000000000010000101001110011010000101001000110010001101011100100110001110110001001011011010110101111010,GKPWVQKYMYZMOP-UHFFFAOYSA-N
C[N]1C(=NC=C1C#N)NC3(CC2=C(C=C(C=C2)F)F)CCOCC3,0A544FBE89F12A1A_428DCC74AF455C45_6041_UN,6.9164762,00000000000000000000000001000000000000000110000000000000010000000110000000010101100101110010010011100000101101011000001011100100110011110110001011011011010111101111110,DQKSUVYYTFLCIT-UHFFFAOYSA-N
BrC1=CC(=CN=C1)NCC2=NC=CN2CC4[C@@H]3C[C@@H](C3(C)C)CC4,5467E7D3071E3DAB_32200D08B972E352_6034_UN,8.10688,00000000000100000000000000000000000000100000001000000000000000000110000000110101001101010001000010101000010110011000101011100100110001110110001011011111010110101111010,WSNSGUPXCXKRJK-HUUYTVAOSA-N
FC2=C(C=C1C=COC1=C2)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,B771A9704BD48BF6_7BF1F67324F3EDAF_6041_UN,8.921325,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011010010101100010110010001101011100100110001110110001011011011110110101111110,MLUZQVYROAMNPO-KXBFYZLASA-N
CC1=C(C=C(C(=C1)NCC2C3(CCNC2)CCOCC3)Cl)C4CC4,29E26E7C3C8B0737_1DC8CD234DFE1BA3_7022_DP,7.6170473,00000000000000000000001000000000000000000000000000000100010000100010000000000000101000110011000000101001110111011000001011000000110111110110001011010011010111101111110,KNGNINBLQQPIDO-UHFFFAOYSA-N
FC1=CC3=C(C(=C1)NCC2(CCCC(C)C2)N(C)C)OC=C3,9686F8CDFB0F4774_B1891CB4C8AAF1D4_6041_UN,7.754496,00000000000000000000000000000000000000000010000000000000010000000010000000100001001101110011010110001100010110011001101000100100110001110100011001011101110110101111110,JFPGHJKCIZSOIB-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CO2)NC(CC)C3CCCCCC3,48DD2A2FF940B5ED_C87052FF3FADAF96_6041_UN,7.868335,00000000000000000001000000000000000000000010000000000000010000000000000000000000000100010011000110000100110110010010001000000100110001110100000010010011100110101111110,QBBSVIMZXZXXLO-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)F)N[C@H]2[C@H](OCCC(C)C)CCCC2,99EFAA20FFAB2988_AC39851AFCA8A2A7_6041_UN,8.251462,00000000000000000000000000000000000000000010000000000000000000000000000000100000000000010011000100000000100101010001101000000011110011110000010111010111110111101111110,ZMPXILWMGHNUQR-IAGOWNOFSA-N
CC1=C(C=CC(=C1)NCC2C(CCCC2)(F)F)OC3CCOC3,67683293499BA309_81467262A5F4AE86_7022_UN,7.9783792,00000000000000000000000000000000000000000010000000000000010000000000000010000000001100110111000010001000000101001100001000000011110011110110000111010011110111111111110,JIZLSLMQMBQHEI-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=CC(=NC=C2)C3=CC(=CC=C3)F)C4,0BDE66CC456A9C6A_9B46572F5ADCC680_6035_UN,8.2156,00000000000000000000000000000000000000000010000000000000000000100100000000100000000001110000010011101000010100000101001001100111110000100100001101011110110111101111110,HPWNAJMZCZIUKX-RPQWFQIESA-N
CN(CC1CCNCC1)C2=NC(=CN=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,0F3E494CE51B3F7A_C43C54AD0497527C_6041_DP,8.256776,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100110101110110001001011111010110101111010,MHCPHJMKXVQEPK-KNQAVFIVSA-N
COCC[N]1C=CC2=C1C=C(C=C2)NCC3(CC3)C4=CC5=C(C=C4)OCO5,FA2B0BE7D06465F6_CCFBB2B5C6BD0501_6041_UN,7.9929943,00000000000000000000001000001000000000000000000000000000010000100110000010010000101101100011010110001100010001011101101011110110010011010110001011111001110111111111110,YEIVWGUOZNNMRC-UHFFFAOYSA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=N3)CC(C)(N)C4=CC(=CC=C4)Br,981AF2B58713B731_5E82300335C0A994_6034_UN,8.167299,00000000000000000000000000000000000000100000001000000000000000100110000000010101001111110011000010101100110100011001001011100100110100100110001001011001010110101111010,CRKOMJKOVQODIL-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NCC3CCN(C(CC)C)C3,11B0FACBBB1C2F1B_D25C39932D21A854_6041_UN,8.119726,00000000000000000000000000000000000000000010000000000000000000000100000000010000101101110011000010101100010110010011101011100100110001110110011011011111010110101111010,USHSMKFWTYNLMP-UHFFFAOYSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,5A15E5B6B92F7E9D_990B1B556DBD43E5_6034_UN,7.997717,00000000000000000000000000000000000000000000000000000000010000000100000000010001001101110001000110101101110111010010101011100100110110100110001011011011010111101111110,ZRIPZAKMGPYXEJ-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCC3)C4=C(C=CC=N4)F,30BA7C55CDBCB8E1_13177C3242FA8E69_6041_UN,8.200224,00000000000100000000001000000000000000000010000000001000000000100110000000010001100100010011011010100000100100011000001011101100000001110100001010011011000010101111010,QGMNUMJVLLSYMW-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NC3C[C@H]2CCC[C@H](N2C)C3)[NH]C=C4,25CD336C723F6A92_21B8EB8E9AB6E56E_6041_UN,8.0635805,00000000000000000000000000000000000000000010000000000010000000000100000000010001100101010001010010100100110110010000101011100100110101110100001001011001000010101111010,GQELQLIAYSSMKK-GOOCMWNKSA-N
CC(C)C1=CC=C(C=C1)NC2C3CC4CC2CC(C3)(F)C4,F17C3651E4E43023_D878EE32A61E3862_7022_UN,7.491723,00000000000000000000000000000000000000000010000000000000000000000010000000100000000000010010000000000100010100001000000000000000100001110000000001000101000010101111010,YESFLYBVKRMUEA-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC4=CC(=C(C(=C4)F)N5CCCC5)F,DCB7D2A3AFA7B4E5_EA6EBB203039060A_6041_DP,7.9180326,00000000000000000001000000000000000000100010000000000000000000100100000000010101100101110011010010101000110100010000101011100100110101110110001011011011010010101111010,GXDHFLAJQUTHHH-SCAQPMJSSA-N
OC(=O)C1=C(C4=C(C(=C1)NCC23N(C)CC(C2)C3)N=CC=C4)F,DD3CBD16B110F983_AEA6686912A7F30B_6041_UN,8.080464,00000000000100000000000000000000000000000010000000000000000000000110000000010001001101110011010010101100010110011001100011110100110101110111001011001011011111111111110,HZGIBWDWSXGHFL-UHFFFAOYSA-N
CN1CCC2=C1C=CC(=C2)OC4=C3N=CC=CC3=C(C=C4)[N](=O)=O,D312125879AE97B6_F36C9043D253953E_7022_UN,7.8835187,00000000000000000000000010000000000000000000000001000000100000010100001100010000100101100000011110101110010010010101101111101111001001010100001111111000110011111111110,FJKDKVNCPMOELE-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)C3(CCCC3)C4=CC(=CC(=C4)F)F,9864DD58D775DB23_5D4B11C76B579709_6038_UN,7.6357474,00000000000000000000000000000000000000000010000000000000000000100010000000010000101001110011110010101000010110111001111001100000110000100110001001011001011110101111110,DWGMVGAMNWBVCY-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)NC(CCC)C2=C(C=CC(=C2)F)F)C3[C@@H]4CNC[C@H]34,A4AE7BBA683C456B_81D5BE8797524FC4_6041_DP,8.032174,00000000000000000000001000000000000000100010000000001000000000000100000000000101101101110011011010101000110110010011001011101100110101110110001011011111010110101111010,BMBRTTSXWAMXHE-OSHAMATESA-N
CC1=C(C=C(C(=C1)NCC[C@H]2CCO[C@H]2C)Cl)C3CC3,F5109121C6DDCEBF_67BEC0A1E40493E1_7022_UN,7.9919386,00000000000000000000001000000000000000000000000000000000010000100000000000000000001100010001000010001001100111010000101000000000110011110110000010010111110111101111110,RXQJGMTWYPARGM-STQMWFEESA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC3(C)C(OCC3)C4CC4,8ACC3887999E2F48_B56C63D343082004_6041_UN,8.261376,00000000000000000000001000000000000000000010000000000000010000100110000000000000101100010011000011101100010111001001101011000100110011110110001011010111110111101111110,DTIIPAZWEGGBLK-UHFFFAOYSA-N
FC2=C(C=C1C=C(N=CC1=C2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4)F,7B7E8B25318BDC65_4C96A1432758C7D5_6041_UN,8.351348,00000000000000000000000000000000000000100010000000000000000000100100000000010100101001110011010000101100010110010001101011100100110001110110001011011011010110101111010,STSHQYXIQSOCPR-AOMKIAJQSA-N
N(CCN1CC2C(C1)C3CCC2C=C3)C(C4NC5=C(C4)C=CC(=C5)F)=O,2283475CC3BA23FE_B0890482B371ABED_6038_DP,8.145843,00000000000000000000000000000000000000000010000000000010000000000000000000010001001101110011100110011100110100110000011011100000110100110110001011011001011110100111110,VUZMDWUXYSXFJF-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC[C@@]34[C@@H](CCC3)CCO4,F679FE0E78EFE605_58662657432B2CE2_6041_UN,7.7956004,00000000000000000000000000000000000000000010000000000000010000000110000000100000101100010011000110101100010101001000001011000100110011110110011011010111110111101111110,HWSBAIMYQBGLGW-YCRPNKLZSA-N
CN(C1CCNCC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=CC(=C(C=C4)F)F,497B6B2E62A8D37B_9633A7907B28A758_6041_DP,8.558666,00000000000000000000001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010000101011100100110101110110001011011011010010101111010,MPNFRVZCVHKFOD-WMLDXEAASA-N
[NH]1C=CC2=C1C(N(C=C2)CC3(N)CC4=C(OC3)C=CC=C4)=O,4BED7B21F003CAD1_E6D31D64D4D4D375_6034_DP,8.552571,00000000000000000000000000000000000000000000000000000000010000000110000000010001000111000001100111101100110001111100010011100101100101000110001111001011111111110111110,BUHZSWMPMRNVDG-UHFFFAOYSA-N
CC3CCCC(CC=CC1=C[N](C)N=C1C2=C(C=C(C=C2)F)F)C3,D4A3A3C87D927C51_F6769984F2EF5FD2_7019_UN,8.167614,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010000000110000001101011101100110000100100001011011110000110101111010,JHPUUSNLXXEHPK-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NCC3C(C)(C)C4CCC3C4,7B8BD3851AD6558C_C29CCD1064176769_6041_UN,7.643145,00000000000000000000000000000000000000000010000000000000000000000010000000100000001000010011000010001100010110001000101000000000110001110000000011010111010110101111010,MIMOMZXAJSASCY-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)N(C=N2)CC(C)(N3CCNCC3)C4=CC=C(C=C4)Br)C,D98D67DD8B8F0CA3_D311E3139EBD2DC6_6034_UN,7.8619995,00000000000000000000000000000000000000000000001000000000000000000110000000010101001101110001000010101100110110011001101011100100110000100110011011011111010110101111010,AXCHHEXRFOJRRM-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC3CCN(CC2CCOC2)CC3)Cl)C4CC4,94D8D7924F38E1EE_77253D18B7B291AD_7022_UN,7.615359,00000000000000000000001000000000000000000000000000000000010000100000000000010000100101110010000011101001100111010000001011100000110011110110001011011011010111101111110,MFKXPMOKRRKRLU-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCCCC2(C)C)F)CC3,94F9B2E138571728_DB6FF40FC6D70183_6041_UN,7.7885237,00000000000000000001000000000000000000000010000000000000000000000010000000110001101001110011010000001000000110011001101011100000110001110110011011011111010110101111010,DDDFCEAEIRRSMM-UHFFFAOYSA-N
FC2=C(C=C1C=COC1=C2)NCC3CCCC(CC)CC3,B3FBB8878AA9948F_03E3947497634F79_6041_UN,8.187878,00000000000000000001000000000000000000000010000000000000010000000000000000000000001100010011000010001100010110000010101000000100110001110100000010010011110110101111110,PHLMFYTYNVAIOJ-UHFFFAOYSA-N
CC2C(C1=CC=CC(=C1O2)F)NC(=O)CC3CC4CCC3C4,FB7993024AA2F00B_55ABBBE6BF4D26B5_6038_UN,7.615943,00000000000000000000000000000000000000000010000000000000010000000000000000000000000100010001100111000100110100110100011000000000110011100100000011010011101111111111110,MMPCVDGHYRCPGM-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CCC2CCCN2C)C=CC(=C3)Cl)C4,EEE2C4A920A5A787_46F849A43AF347E8_6034_UN,7.433856,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101110010010010001101110110010011101011100100110001100110001011011111010110101111010,DXNVNZGAFXTCFW-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC2=CC=N[N]2CC3CCCCC3,FE07BF4ACDD13B0D_5EF6C334C94DAB31_7022_UN,7.418092,00000000000000000000100000000010000000100000000000001000000000000100000000110101100100100010011010001000000000011000001011101100110001010100011011011111010110101111010,MJOIOJLSPOHOMP-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)NCC(C2CCNCC2)C3=CC=CC=C3)F)C#N,79183A6208217D94_6A28852CCC517271_6041_DP,7.722772,00000000000000000000000000000000000000000110000000000000000000000000000000000000001000110001000000101000100100010000001001000100110101110110001011010011010110101111010,BUUOHNKYIOPCPF-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CC2=CCNCC2)C=CC(=C3)C)C4,43E2A2D4837129DC_1AC20FB0DCCB0382_6034_UN,8.450644,00000000000000000000000000000000000000000000000000100000000000000100000000011000001101100001000010111100110010010010101011100100110000000110001011011101010110101111010,DKJOFXJAZJHLDW-UHFFFAOYSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC4=CC3=C(C=CC(=C3C)C)[NH]4,D97609E03E9538DD_9751EA118FB5BBCD_7019_UN,8.868761,00000000000000000000001000000000000000000000000000000000000000100100000000000000000100000001000010010100010000000000000001000100110000000100000010010111000110001111010,HLZJLGICVIBIPG-QAPCUYQASA-N
O=[N](=O)C1=CC(=C(C=C1)F)NC2=CC4=C(C=C2)OC3(CCCC3)O4,797DBE358A680792_830097A5BD3B7A5C_6041_UN,8.317953,00000000000000000000000010000000000000000010000001000000110000010000001110000000100100010000001011000110010100001100001110111100011011110100101011111011100011110111110,DVMXIISMYGLFIR-UHFFFAOYSA-N
CN1CCC(CC1)C=CC3=CC=C(C2=C(F)C=CC=N2)O3,041E5CF5FFFE9BF4_E083C58C1D57FD31_7019_UN,8.227202,00000000000000000000000000000000000000000010000000000000010000100100000000010000000101110000010110111000000100010001101011100100110000100110001011011010110010101111110,RZMHELOIJOAPQU-UHFFFAOYSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3CCN(CCC)CC3)C4,E85D8BCCB7FB994C_5171A9B8523B70DB_6041_UN,7.5991263,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101100011010010101100110010010011101011100100110101010110001011011101010110101111010,VITFYWVJCULOTJ-UHFFFAOYSA-N
CCCC1=CC2=C(C=C1)N=CC=C2NCC3(C(C)(C3)C)C4=C(C=C(C=C4)F)F,51EE68159ECFA7E0_7909DC5F1F901D74_6041_UN,8.05563,00000000000000000000001000000000000000000010000000000000000000100110000000100000101000010011000000101100010110001011101001000100010001110100011011010111010110101111010,XLTPCJXKAOPMIF-UHFFFAOYSA-N
N2C5COC1=C(C(=CC(=C1)Cl)C24CCN(CC3=CC=CC=C3)C4=O)C5,7DA94825B1E56E20_6F9E022F8A01C450_2238_UN,7.7820015,00000000000000000000000000000000000000000000000000000000010000000010000000010001100101110011100110101101110101111100011011100101110000100110001111011011111111110111110,VQMFCWVDBXTNNO-UHFFFAOYSA-N
N4CCC1=C(C=CC(=C1)NC2=CC(=C(C=C2)N3CCCCCCC3)F)C4,F1C9E709AE9ABF74_3B322488C7C9F91A_6041_DP,7.7180552,00000000000000000000000000000000000000000010000000000000000000100000000000010000001001110001000000101100110100010000001011100100110101110110001011011011010010100111010,CXCLXIXMLRCGBL-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4)C5=CCNCC5,D75AEE1825E4BE11_C623CA5DBA61081F_6034_UN,7.7036977,00000000000100000000000000000000000000000010000000100000000000100110000000111000001101110001000010111100110110011000101011100100110000100110001001011101010110101111010,ZALVWDJVAUCPEF-NJNPRVFISA-N
FC1=CC=C(C=C1)C2=CN(C(=N2)C3CCCN3)C[C@H]5[C@H]4CNC[C@H]4OC5,9B752EEC5CB5A05D_12095BA153621BA7_6034_UN,8.634264,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101110011000111001100110101010000001011100100110110100110001010011011110111100111110,UNRMACPOCSGDKE-HTGGYDROSA-N
CC1=C(C=C(C(=C1)NC3C2CCCCC2OC3)Cl)C4CC4,A77ED872CD1E4F8C_9725BEA12A8E31CE_7022_UN,8.027854,00000000000000000000001000000000000000000000000000000000010000100000000000000000000100010011000111000101110111010000001000000000110011110100000011010011110011101111110,LJQOXOCBRMAXPR-UHFFFAOYSA-N
CN4CCN(CC1=C(C=CC=C1)NC[C@H]2C3CCC([C@@H]2C(F)(F)F)CC3)CC4,CCD9A2AF5C7E7803_62CF6CF3B216A80C_7022_UN,7.5423374,00000000000000000000000000000000000000000010000000000000000000000000000000010001101001100011010000101000011100011001101011100000110001110110001011011011010110101111010,XTRCGLORIZNQCN-RHZYHWHBSA-N
CC2=C1N=CC=C(C1=CC=C2)NCC(N3CC(C)OC(C3)C)C4=C(C=CC=C4F)F,38039BED656416D8_814740450291680F_6041_UN,8.462951,00000000000000000000000000000000000000000010000000000000010000000100000000010001101001110001000100101100010110010001000011100100110011110110011011001111110111101111110,YQIGHRFSFOJCEN-UHFFFAOYSA-N
N(C(CF)C1=CC=C(C=C1)C#N)C(C3C2CCC(CN2)C3)=O,3A5A6A8D70C8D956_A99178E7FFBB6002_6038_DP,8.2507715,00000000000000000000000000000000000000000110000000000100000000000000000000000000101000000011100001101000110000110000011001000000110100100110001001010001011110100111110,PSGPTEMRDUGTKL-UHFFFAOYSA-N
CN1C(COCC1)CCOCC3CC2COCCC2O3,8435D8DEBA54BE98_F7EC8B045D4FD2F7_6039_UN,8.03646,00000000000000000000000000000000000000000000000000000000010000000000000010010000000101100100010111101100010011010001101011100010110010000110100001111010110111111101110,KAENVVKXMSEZEH-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCC(CC3)C4=CC=CC=C4,6E8DC28A8F6BD1E0_797A19F0D3FCB1D1_6041_UN,7.762353,00000000000000000000000000000000000000000010000000001000000000100100000000010000101100010011011010001100010100000000001011101100110001110100001001011001010110101111010,NNNFDHMWZQEYQM-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC2C3(CCNC2)CCC3,F9583EF5F3CBB4AF_ABEB48539911590D_6041_DP,7.7298803,00000000000100000000000000000000000000000110000000000100000000000010000000000000101000110011000000101000110110011000001001000000110101110110001011010011010110101111010,METMOLDXMQELKO-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC4=C(C=CC=C4)C5=CC(=C(C(=C5)F)F)F,FD9AC6CF2DD94705_FECFAFBAFF6649B8_6041_DP,8.154809,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110001010010101000010110000000000011100100110101110110001011001011010010101111010,YXYGAKLNORNAIE-SZLXDWMPSA-N
C(C1CC12CC2)=CC3=C[N](C)N=C3C4=C(C=CC=C4)Cl,A83B74C7AF9958E2_032FFEC51E6C66CD_7019_UN,7.57023,00000000000000000000001000000000000000000000000000001000000000100110000000010000100100010000011010010001010100001000000011101100010000100100001010011010000010101111010,HJZIHCVRCFNPIB-UHFFFAOYSA-N
FC2=C1N=CC=CC1=CC=C2NCC3N(C)CC4(CC3)CC4,F00785333B538F7D_5DA8BAA5BFA80339_6041_UN,7.9392257,00000000000000000000001000000000000000000010000000000000000000000110000000010001101001110011010000101100010110011001101011100100110001110110001011011011010110101111010,VVADWFIZHZVNTJ-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2CCC3(CCC2)CC3)F,3829CC10FF56F563_FA8396A39CE581FB_7022_UN,7.936524,00000000000000000001001000000000000000000010000000000000000000000010000000100000000001110011010000001000110100011001001000100000110001110000001010011111010110101111010,UUYMCUMEAUKKSU-UHFFFAOYSA-N
CC(C)(C)C2=CC1=C(C=CC(=C1)F)N2C[C@H]4CN3CCC[C@H]3CN4,76405E17F6AB7C4C_709AAE72F00672D2_6034_UN,7.961261,00000000000000000000000000000000000000000010000000000000000000000110000000110001101101110011000010101100110110011000001011100100110000100110011011011111010110101111010,DONCQLALUPYUNM-SJORKVTESA-N
C1CNCC(C1)C3=CC2=C(C=CC=C2)N3CC4=CC(=C(C=C4)N5CCCCC5)F,9E0739359E1D0430_1574B76FDC59CADA_6034_UN,8.383586,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010101100110100010000001011100100110001110110001011011011010110100111010,FCOQCXVIKBLEFR-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC3CCC2COCCC2C3)C=CC(=C4)Cl)C5,E2399FA86678AC2B_114D206A87F1476F_6034_UN,7.626086,00000000000000000000000000000000000000000000000000000000010000000100000000010000100101110000010010101101010101010001101011100100110010100110001011011000010111101111110,ZXYMYBKWTFSUBT-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)COCC2)[S](C4=CC(=C3[NH]C=CC3=C4)C)(=O)=O,E7867C25B6FFEAA4_8AD6256CDA1ECD6B_6029_UN,8.617035,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100101000001010101110011001001000011011001100111110001110001011111001010111111111110,UVZOQAZCVXSAFQ-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C(C)C4=C(S3)C=C(C=C4)F,A7A6E8505CD3D390_43BD233E96A7B156_7019_UN,8.450297,00000000000100000000000000000000000010000010000000000000000000000010000000000000010100011000000010010100010100001000001000000100110000100100000011010010000000001011010,HALOODPUPCZRBG-UHFFFAOYSA-N
C2(=C1OC=CC1=CC(=C2)F)NC[C@@H]3CCCN(C)[C@H]3C4=CC=N[N]4C,070C165BFC15A39E_F32CBA3F49AFB8B4_7022_UN,7.61684,00000000000000000000000000000000000000000010000000001000010000100100000000010001101101110011011110101100010110010001101011101100110001110110001011011111110110101111110,CVLHNEWEERGDON-KBXCAEBGSA-N
CSCC3(C=CC1=CC=CC2=C1NCCC2)CCOCC3,E145B2D3A15774F1_B1E7A2D141A33A4A_7019_DP,7.536216,00000000000000000000000000000000000000000000000000000000010000000010000000000000001000101011010000111100110011011001001011000000110010010110000011010001010111101111110,ZKMMZYYMVGBWDF-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC3=C2CCCC2=CC=C3,AB27F42C61CD22E4_DEFD431500CB8F59_6041_UN,7.8683677,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100001010010101100010000001000001001000100110001010100011011011111010110101111010,DKNGUDXLPHRFNZ-UHFFFAOYSA-N
C2(=C1OCCCC1=CC(=C2)CC#N)NC3=C[N](=CC=C3)=O,7B072C258832E1AF_FFB2431B75EDBC02_6041_UN,8.20129,00000000000001000000000010000000000000000100000001000000010000000100000100010001000000000001001101100110010001010100001011101101100011010100001111011001110111110111110,VJOWFSIWEAOMTP-UHFFFAOYSA-N
C[N]1N=CC=C1C4CCCC5=C(C2=C(SC3=C2CCC(C)C3)N=C45)C6=CC=C(C=C6)Br,19B9E4574C2154F8_AD33E1DBA1942083_2201_UN,7.4136896,00000000000000000000000000000000000010000000001100001000000000100100000000010000110100011000011010100100010110000001101011101100110000100100001011011110000010101111010,KYEQTZMHMPZIKY-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC3(CC3)C4=CC=C(C=C4)F,5AE07DCA711AAE54_75041025B64EB047_6041_DP,7.565902,00000000000000000000001000000000000000100010000000000000000000100110000000010101101101010011010010101000100110011000001011100100110101110100001011011011010010101111010,AAELJAQSMCOIHI-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC=C3CCSCC3,E6A252D2416C8D99_752F94A0DC1AAC94_6041_UN,7.559649,00000000000000000000000000000000000010100000000000100000000000000100000000001100001000101001000000111100010010000000001011000100110001010110011011010111010110101111010,RWNTXDCPTQBCRS-UHFFFAOYSA-N
CC1=CC(=C(C=C1)F)NCC2N(C)CC3(CC2)CCC3,F2AAC7368D9EA4F2_1D7CD29C2F401740_7022_UN,7.645506,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011111010110101111010,LXZDZRFWTNVQFH-UHFFFAOYSA-N
C([C@]12C[C@H]1COC23CCC3)=CC4=C(C=C(OC(C)C)C=C4)Cl,BC8D017FCC399F65_5AED6B357E241ADE_7019_UN,7.7869487,00000000000100000000001000000000000000000000000000000000010000000010000000100000000100010000000010110001010101001100001000000011110010100100000111010110110001011011110,MGTUZZCKJMWVFG-YJBOKZPZSA-N
CN4CCC1=C(C3=C(N1C[C@@H]2CC(C)(CN2)C)C=CC(=C3)Cl)C4,9412D38C82083673_0906A94F5089E64C_6034_UN,7.9103823,00000000000000000000000000000000000000000000000000000000000000000110000000110001101101110011010010101101110110011001101011100100110000100110011011011101010110101111010,ATNJPVJBJPQNKX-AWEZNQCLSA-N
CC1=C(C=C(C(=C1)NCC3OC2(CCC(C)(CC2)C)CC3)F)[N]4C=CC=C4,91BDC0701B4279EC_403D3FBE177312E9_6041_UN,7.6425514,00000000000000000000000000000000000000000010000000000000010000100110000000110000001101010011000110001000010100001001101011100100110011110100011011011111110111101111110,BWBDNVINBQOWSY-UHFFFAOYSA-N
N(CC12CCC(CC1)CO2)C(=O)C3(CCCC3)C4=C(C=C(C=C4)F)F,32E8CBFDB2D3CF3E_06947EDA889F529B_6038_UN,7.6228437,00000000000000000000000000000000000000000010000000000000010000100010000000000000001000010011100110101000010101101000011000000000110010100110000011010011111111110111110,ZCSWZJYLFSEWIW-UHFFFAOYSA-N
BrC2=C1N(C=CC(C1=CC=C2)=O)CC3C(CCN3)C4CC4,944B8AF24730446E_AE5FD4CCA9CE1785_6034_DP,8.43975,00000000000000000000001000000000000000000000001000000000000000100100000000010001001101010011000011101100110100010100001011100101110000100110001101011011111110100111110,ARKYYEYMHBNQSC-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CC3(CNC3)C4=CC=CC=C4)CC#N)F,DF1DFB4ACFA1211F_949AA90663D87567_6034_UN,7.5922146,00000000100100000000000000000000000000000110000000000000000000100110000000010000101101110010000010001100010100011000000011100100100000100110001011001011010110100111010,FKRSXCPNYOSMAN-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CCC(CC)CC)C3=CCNCC3)F,74E0E57016CCB721_3774FDD88A3023C2_6034_UN,8.726104,00000000000000000000000000000000000000000010000000100000000000100100000000011000001101110001000010111100110110010010101011100100110000100110001011011111010110101111010,HWPJKZRIOUKEBC-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=NC=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,F980CA2B6BE55596_AE4C14D2EA693C8D_6041_UN,8.137386,00000000000000000000000000000000000000000010000000000000000000000100000000000000100001110010010000101100010110010001101001100100110001110100001011011011010110101111010,UDHIPFMTAAFXLU-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NC[C@@H]3CN[C@@H]4CCCC[C@H]34)C,7CBBFFBDBF1FEDE2_072CBD55997847B9_6041_DP,8.232127,00000000000000000000000000000000000000000010000000000100000000000100000000000000101100010011000010101100110110010000001011000100110101110110001011010111010110101111010,BQOZNLZLEFWRIP-YXJHDRRASA-N
CN(CC1CCNC1)C2=NC(=NC=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,D3BAB6999A431FAC_3ED740025EDE36C2_6041_DP,8.242392,00000000000000000000000001000000000000100010000000000000000000100100000000010101101101110011010010101000101110010001101011100100110101110110001001011111010110101111010,JYRIWLHEDQIJPF-JFSACEIJSA-N
CN(CC1CCNCC1)C2=NC(=NC=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,15F6732FE8D185CF_44DCA57DD5A206DE_6041_DP,8.24115,00000000000000000000000001000000000000100010000000000000000000100100000000010101101101110011010010101000101110010001101011100100110101110110001001011111010110101111010,YHELKIYGYMBHML-CTNGQTDRSA-N
C[N]1C(=NC2=C1C=CC=C2F)NCC34COC(C)(CC3)C4,9900DAAAE529F912_2D7D431B4F024BF5_6041_UN,7.198778,00000000000000000000000001000000000000000010000000000000010000000110000000010101001101010011010011101100011111001001101011100100110011110110001011011111110111101111110,QOWNQZUHFAKLFX-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CC3=C[NH]C4=C3C=C(C=C4)F,FBACBFD5C02103C3_5FAC70696EBE0202_6038_UN,7.7514653,00000000000000000000000000000000000000000010000000000000000000000100000000000000001100010011100010001100110100110000011001000100110110100100001001010001011110100111110,LJZKVWFQEAEHNF-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)SC=C2)NCCC3CCCN(C)C3,286A76030ED88672_DD7BE4DADEF1D61F_6041_UN,8.170059,00000000000000000000000000000000000010000010000000000000000000000000000000010000011101111001010010101100110110010001101011100100110001110110001011011011010110101111010,JSWSAWJCIVAFOR-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CNCC(C2)(C)C)F)CC3,140716647A41C7B5_4BEA82D289DD7110_6041_DP,7.775889,00000000000000000001000000000000000000000010000000000100000000000010000000110001101001110010010000101000000110011001101011100000110101110110011011011111010110101111010,JVXHOQBKOFPGEK-UHFFFAOYSA-N
CC(C)C1=C(C=C(C=C1)NCC2CCCN(C)C2C3=CC=CS3)F,3D3F5B8172482B73_EDA44737CBF99E8F_6041_UN,8.118382,00000000000000000000000000000000000010000010000000000000000000100000000000110000111101111011010010101000000110010001101011100100110001110110011011011111010110101111010,XIFLCFFCTBFSKO-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC(CC2COCC2)C#C)Cl)C3CC3,C7F0CA705E8AAC49_3B29460E44A60321_7022_UN,8.024802,00000000000000000100001000000000000000000000000000000000010000100000000000000000000100110001000010000001100111010000001000000000110011110110000010010011010111101111110,ZUVVJVKLKUFVCC-UHFFFAOYSA-N
N(C2C1C3CC4C1CC5C2C3C45)C(C6=C(CC)[N](N=C6)C7=CC=C(C=C7)F)=O,613C6036485747E8_18C8F634F29CED60_6038_UN,8.468656,00000000000100000001000000000000000000000010000000001000000000100100000000010000100100010001101011000100010100110010010011101100110001110100001011001011001110101111110,SGPWGFCXAQFIGS-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NCC2CCCCN(C)C2)C3CC3,7857B6EED42C70BF_76FBD4B7AD41064B_6041_UN,7.738825,00000000000000000001001000000000000000000010000000000000000000100000000000010000101001110011010000001000000110010001101001100000110001110110001010011011010110101111010,ONKXRHONTLIQLZ-UHFFFAOYSA-N
CC[C@H](OCCN1CCSCC1)C2=CC(=C(C=C2)F)C,3AFB733F905856CB_64B529B21B391C8B_6039_UN,8.921654,00000000000000000000000000000000000010000010000000000000000000000000000000010000000001111000000100101000000111010010001011100010110010100110000011011110110101101111110,QBVPHHFUFPGJLT-INIZCTEOSA-N
CC1=C(C4=C(N1CC3CC2(CC2F)C3)C=CC=C4)C5=CCNCC5,C3999926241851B0_664C48317E583C8D_6034_UN,8.378794,00000000000100000000001000000000000000000010000000100000000000100110000000011000001101110001000010111100110110011000101011100100110000100110001011011011010110101111010,GUTVQUSVKSBYIY-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(CCC2)C3CCC3)Cl)C4CC4,941F5A8F8B52DD2E_75F626BED1A11D5B_7022_UN,7.6248226,00000000000100000000001000000000000000000000000000000000000000100010000000000000001000010011000000001001000110001000001000000000110001110000000010010011010110101111010,HIDRBSDYDGTLDU-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=NN=C(C=C2)C3=CC=C(C=C3)F)C4,B253BA3623E96125_EC019CF319462EDF_6035_UN,8.044012,00000000000000000000000000000000000000000010000000001000000000100100000000100000000001110000111111101000010100100101011011101111110000100100001101011110110111101111110,GVTHACZPFWLVPC-NVALYEJGSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC4(CC3=C(C=CC=C3F)F)CCCCC4,7F07ED970E62A619_A25872B5F181FF8A_6041_UN,8.20433,00000000000000000000000000000000000000100010000000000000000000100110000000010100100101110011010010101000100110011001101011100100110001110100001011011011010110101111010,FWISQFNOJXCBHU-NRFANRHFSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CCCCCN2)F,5D5BF36FB84FB7C4_A1EC359407D25471_7022_DP,7.6827908,00000000000000000001000000000000000000000010000000000010000000000000000000100001001001110011010000001000100100010001001001100000110101110110001010011111010110101111010,HGNPGGCFXJHSPQ-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)C[C@@H](CC)NCC3=CC=CC=C3)C4=CCNCC4)F,1EDF7A1A2DD8736C_E9875299A1FE1A3C_6034_UN,8.265108,00000000000000000000000000000000000000000010000000100000000000100100000000011001001101110001000010111100110110010010101011100100110100100110001011011011010110101111010,AEDATBMXSMBLKF-LJQANCHMSA-N
CC1=C(C=C(C(=C1)F)NCC2(CCCCC2)OC3CCCC3)F,DBF3E3B392CB2250_7266229ECBC361DE_6041_UN,8.374133,00000000000000000000000000000000000000000010000000000000000000000010000000000000001000010011000110001000000100001000001000000011110011110000000111010011110111101111110,HRWVZCRUUZKFEB-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC3C(CCN3)C4CC4,B2688F5AE5511B75_DA6BB0324D8FD18B_6041_DP,8.022292,00000000000000000000001000000000000000100000000000001010000000100100000000010101101100000011011010001000100010010000001011101100110101010110001010011111010110101111010,PATVLULOWVXPAM-UHFFFAOYSA-N
N(CC23CC1CC(CC(C1)O2)C3)[S](C5=CC=C4[NH]C=CC4=C5F)(=O)=O,D8060E29D6B52B4C_0AB1615F6BD32646_6029_UN,7.6076403,00000000000000000000000000000000110000000010000000010001011111001111010001000000011100011010001110101110011100001000010011001100101110101100001011101011110111110111110,VLWLZAMXAHTSOV-UHFFFAOYSA-N
CN5CC(C1=NN=C(C)N1CCC2CC3CCC2C3)C4(CNC4)C5,3701635432EBD45D_0FE82732317CB0F7_6034_UN,7.471695,00000000100100000000000000000000000000100000000000001000000000100110000000010101101101100011011010001000010010011001101011101000110000000110001010011111010110101111010,BNLRPBPQRHYZMW-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2C(CCCC2)N3CCCC3)F,EB1618052A93F182_944D6281C7181A16_7022_UN,7.921707,00000000000000000000000000000000000000000010000000000000000000100000000000110000101101110011010010001000000100010001001001100000110001110110001011011111010110101111010,KOEJZOWZRZKKFP-UHFFFAOYSA-N
C2(=C1C=CC=CC1=C(C=C2)Cl)NCC3N(C)CC4(CC3)CC4,8799F71B7F8F1391_C7C30124E86BC45D_7022_UN,7.9990234,00000000000000000000001000000000000000000000000000000000000000000010000000010001001001110011010000101101010110011001101001100100110001110110001001011011010110101111010,AURZHXZZGSMRGK-UHFFFAOYSA-N
FC1=C(C=C(C=C1)N[C@@]34[C@@H]2OC(C)(O[C@@H]2[C@@H](CC3)C4)C)C5OCCO5,8478F0780FD9C9D4_489FF2B26D7C076F_6041_UN,7.9014096,00000000000000000000000000000000000000000010000000000000010000100010000010100000000100010011000111000100110101011000001010010000010011110110100011110111110011111111110,VQSKRIYIDBNBGG-CQBORDEHSA-N
C(C1=NC(=NC=C1)C3CC2=C(C=CC=C2)O3)=CC5=C(N(C)C4CCCC4)C=CC(=C5)F,26AD6475E5ED3606_9B3CF910A7F63E8C_7019_UN,8.336168,00000000000000000000000000000000000000100010000000000000010000100100000000000100100101010000010110110100010110010100101011100100010011110100001011011010100011101111110,IYPULZHKHMTPBA-UHFFFAOYSA-N
C(CC2C1CC3CC(C1)CC2C3)=CC5=CC4=C([N](C)N=C4)N=C5Cl,D8C3C678958FD462_0E9F0B427E27F82B_7019_UN,8.347639,00000000000000000000000000000000000000100000000000001000000000000100000000010101100100010000011010110101010100000000000011101100110000100100001011001010000110101111010,JXJCSRPCACXBDZ-UHFFFAOYSA-N
NC4CCC1=C(C3=C(N1CC2(CC)CCNCC2)C=CC(=C3)Cl)C4,715E5F30D9BE39BB_A63E9B399DBAEF0E_6034_UN,7.923896,00000000000000000000000000000000000000000000000000000000000000000110000000010000001111110011000010101101110110011010101011100100110101100110001011011001010110101111010,DPUCSDSXRKOHDI-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC2=C[N](N=C2)CC3=NN=C4CCCC[N]34,F77705A2D2DFC7BB_F2B909F8AC134851_7022_UN,7.7766967,00000000000000000000100000000010000000100000000000001000000000000100000000110101100101100001011010101100010000011000001011101100111001010110011011011101010110101111010,WQTFFCDRCHBUFR-UHFFFAOYSA-N
FC3CCCC(C=CC1=N[N](C)C(=C1)C2=CC=CS2)C3,B076F616B26AFFB1_226F3F3E719C1636_7019_UN,7.5821266,00000000000000000000000000000000000010000010000000001000000000100100000000010000110100011000011010010000000100000000001011101100110000100100001010011010000010101111010,ZSYRREFQQQTDEM-UHFFFAOYSA-N
NC(=O)NC1=CC(=C(C=C1)F)NCC2C3CCC(C2)C3,6430F27803A045B2_D5B209CAC3C81A06_6041_UN,8.30647,00000000000000000000000000000000000001000011000000000100000000000000000000000100101010010011000010001000011100100000011000000000110101110000001011010011011110100111110,UOHCQKGXBLJFPE-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC=CC=CC)C3=CCNCC3,175F324DF17BD327_7FC5A85D4BC8707B_6034_UN,9.208488,00000000000000000000000000000000000000000010000000100000000000100100000000011000001101110001000010111100110100010000001011100100110000100110001001011001010110101111010,QMHXGFNUORDHNS-UHFFFAOYSA-N
CCC(C)C1=CN(C2=C1C=C(C=N2)Br)C[C@]35CCC[C@H]3CN(CC4=CC=CC=C4)C5,44FD858AEBD6F360_847AD0061F3FF8BE_6034_UN,8.367624,00000000000000000000000000000000000000100000001000000000000000000110000000010100100101110000000010101100010100001011001011100100110000100110001001011100010110101111010,NVGKAEVISYILAX-PAEZVXATSA-N
CC1=C(C=N[N]1C)C2=C4C(=CC(=C2)C=CC3CCC(F)CC3)OCO4,7DD32E0797681B3A_36A8CE70C8E95814_7019_UN,8.420517,00000000000000000000000000001000000000000010000000001000010000100100000010010000100100010000011010010100010101000100001011111100110000100100001011011110110011111111110,HFTZIXMEVFVXLH-UHFFFAOYSA-N
FC2=C(C=C1C(=NC=CC1=C2)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4)F,F1A27AED2B9F3805_79BDAABF6901B011_6041_UN,8.911161,00000000000000000000000000000000000000100010000000000000000000100100000000010100101101110011010010101100010110010001101011100100110001110110001011011011010110101111010,YIIUGYLEPVNMEI-KXBFYZLASA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC34CC(OC3)C=CC4,264EBEC5F08005E8_27521276BCB99A8A_6041_UN,7.6410794,00000000000000000001000000000000000000100010000000001000010000100110000000010101100100010000011111110000110101011000000011101100110011110100001011001011110011101111110,BOBBMNLTYDHXJR-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)C4(CCC4)C5=CC(=C(C=C5)Cl)F,AFBA86F73AC07834_004842DFC2772766_6038_UN,7.148007,00000000000100000000000000000000000000000010000000000000000000100010000000000000001000010011100010001001010100101000011000000000110000100000000011010011011110100111110,UBAGECXXBHPEKF-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCCC3)C4=C(C=CC=C4F)F,6E2392C84929BEEB_8AC9E49D301D21AA_6041_UN,8.111777,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100010001110100001010011011000010101111010,LHGSWAFFYRGEJC-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)COC2)[S](C4=CC3=C(C=C[N]3CC)C=C4)(=O)=O,F7F88723E56ED560_A1935CD2F3867CFB_6029_UN,8.589436,00000000000000000000000000000000110000000000000000010001011111001101010001010000010101101001001010001110011001001010010011101100011001011110001011101001010111111111110,CUFSVSRQWNLMEE-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)C4(CCC4)C5=CC(=C(C=C5)Cl)Cl,FFBAF9E10DCCA411_CFAD18D719415E40_6038_UN,7.147986,00000000000100000000000000000000000000000000000000000000000000100010000000000000001000010011100010001001010100101000011000000000110000100000000011010011011110100111110,XQHABNBRMUOQAI-UHFFFAOYSA-N
ClC1=C(C=CC=C1)N2C=CN(C2=O)C[C@H]4N[C@H]3CCO[C@H]3C4,FFFA5124A4B68D6D_1CC8B371762BCD13_6034_UN,8.416998,00000000000000000000000000000000000001000000000000000000010000100100000000010101000101010011000111001101111101110100011011100101110011110110001110011011111111110111110,XGQQKDDTRHNBHH-WHOFXGATSA-N
NCC3(OC1=C(C=C2C(=C1)CNCC2)F)CCCNC3,49BB75FE8C962446_16295EA2155F85BC_6035_DP,8.077003,00000000000000000000000000000000000000000010000000000100000000000010000000000000101010110011000100101100110100011100001011000011110110100110001111010011110101100111110,KMQKHAYKEQAPRL-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC[C@]23C[C@H]2CCC3)Cl)C4CC4,0D91E61D98BD2BB1_F38FDFD4146694C2_7022_UN,7.361788,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010001000010001001110110011000001000000000110001110000000011010011010110101111010,ADQAKRPVBPBFAG-RDTXWAMCSA-N
C[Si](C)(C)C1=CC(=CC=C1)NCC2CC3(NC2)CCC3,48A797DB7129ED41_255FD3411D5DBF11_7022_DP,7.442021,00000000000100000000100000000010000000000000000000000100000000000010000000100000101100100011010010001000110000011000001001000000110101010110011000011101010110101111010,VNVPTEWNSLZLQM-UHFFFAOYSA-N
OCC1=CC(=NO1)C=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,C360E6A2AD082F64_43F83B05138A058F_7019_UN,8.143605,00000000000000000000000000000000000000000010000000000000010000000100000110000000001101010000011011010010000111010000101011101100010011110101001010011010110111111111110,ORLCARKDTIJING-UHFFFAOYSA-N
C(C1COCCN1CC2=CC=CC=C2)C3=CN(C4=C3C=CC=C4)CC5CC5(C)Br,70E265EDA7F9C395_EEC086E50FBBDC05_6034_UN,8.089018,00000000000000000000001000000000000000000000001000000000010000000110000000010000000101110000000110101100010111011001101011100100110010100110001001011010010111101111110,HRYLIFCYYALDDI-UHFFFAOYSA-N
N(CC2=NC1=C(C=CC(=C1)F)O2)C(C4=CC3CCC(N3)C4)=O,1BCB53AE9B597994_F8B8A9ABD6ADD38E_6038_DP,8.377695,00000000000000000001000000000000000000000010000000100000010000000100000000001001001100010011100110111100110100110000011011000100110110100100001001010001111110110111110,YAVMAZFXXMPTTJ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@H]3[C@H]2CCCO[C@H]2C3)F)CC4,205F48B53D02191F_548917F4D832083B_6041_UN,7.3746715,00000000000100000001000000000000000000000010000000000000010000000000000000010001100001110011010001101100110111010001101011100000110011110110001011011011110111101111110,KPEINDHGOHGWMV-RLLQIKCJSA-N
BrC1=CN=C(N(C1=O)C[C@H]2[C@@H](CNC2)C3=CC=C(C=C3)Cl)C4CC4,93D399F4416B227D_E025E5037F604C4B_6034_UN,7.957204,00000000000000000000001000000000000000100000001000000000000000100100000000010100101101110011100011101001000100100100010011100101110000100110001111011011011110100111110,ONGLRXANLZJVJN-ZFWWWQNUSA-N
FC1=C(C(=CN=C1)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,E86261A000432C93_E263CAE08995D790_6041_UN,8.711967,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,QCZJGHHPOUPODR-ZFWWWQNUSA-N
C(C1CC2CCC1CC2)=CC3=C[N](C)C4=C3C=C(C=C4)F,B52508BBA35893BB_6C878DC190000BC4_7019_UN,8.1624155,00000000000000000000000000000000000000000010000000000000000000000100000000010000000101010000010010010100010100000000001001100100110000100100000001011000000010101111010,HNYBOZOOHSBLNN-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)NCC2C(CCNC2)(C)C)F)C#N,866E83B45B4A3B7C_6521CF2F2088272A_6041_DP,8.092386,00000000000000000000000000000000000000000110000000000100000000000010000000100000101000110011000000101000100100011001101001000000110101110110011011010111010110101111010,YULHCSNSTCTJPV-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC3(C)CCC4(CC3)CC4,6D4B788172FC0FA7_BF7670CA9E0C2F88_7022_UN,7.9311132,00000000000000000000001000000000000000000010000000001000000000000110000000010000101100010011001010001000010100011001101011101100110001110110001011011011010110101111010,NJXVYGUPRLKRLV-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NC(C[N]2C=NC3=CC(=C(C=C23)C)C)C4CC4,16436DA62C026701_C2E8C83B8FC39203_7022_UN,8.611623,00000000000000000000001000000000000000000010010000000000000000000100000000010101000101010011000010011100110100010000000011100100110000100100001011011111010110101111010,VLWZGRFCSAIDCV-UHFFFAOYSA-N
CC34CCC(C=CC1=C(Cl)C2=C(O1)C=CC=C2)(CC3)CO4,35838561EAD96038_E84D92CE764EF61A_7019_UN,7.8146505,00000000000000000000000000000000000000000000000000000000010000000010000000000000000100010000000010110101010101001001101010000100110010100100000011010010110001011011110,HCOFYLUSNNTJCO-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C(C2)C3CCCC3)F)[N]4C=CC=C4,A2D1D6255DC8A12A_C3D1B262F870D021_6041_UN,7.850932,00000000000000000000001000000000000000000010000000000000000000100100000000010000001101010011000010001000000100000000001001100100110001110100001010011011010110101111010,XVEDVFITRUESLT-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=CC=C2)NC3=C(C=C(C=C3Cl)C56CC4CC(CC(C4)C5)C6)Cl,CEEEEE36BAD59BA9_191143E7E86B8011_7022_UN,7.877645,00000000000000000000000000000000000000000000000000000000000000100010000000000000000000010000000000000101010100001000000000000100100001110000000011000011000010101111010,OGYDUHHCDBVOFN-UHFFFAOYSA-N
NOCC1=C(C=C(C=C1)F)NCC3OCC2(CNC2)C3,3B3028D663DF02B1_C380E0A574382460_6041_DP,7.699064,00000000100100000000000010000000000000000010000000000000010000000010010100000000001110110011001111001010110101011000000011001010110111110110001010000011110111110111110,QCOLPHJQISBQEO-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(CCCC3)C4CC4,265E1647B2BCD1F5_54E28D9D8B11EC7D_6041_UN,7.4319983,00000000000000000000001000000000000000100000000000000000000000100110000000000100001000000011000010101100010010001000001001000100110001010100011011010111010110101111010,FQSMHYMWILCZOK-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NCC2C(CCCN2)(C)C,A47BD4354B699F45_E4778AD99C93E05A_7022_DP,8.1875,00000000000000000000000000000000000000000110000000000010000000000010000000100001001000010011000000101001100110011001101001000000110101110110001011010111010110101111010,NEOWSSRXMVEZHU-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CC3=C[NH]C4=C3C=CC(=C4)F,5FF0D0C850D1C88E_414F8C507E7B014A_6038_UN,7.6800203,00000000000000000000000000000000000000000010000000000000000000000100000000000000001100010011100010001100110100110000011001000100110110100100001001010001011110100111110,PIEBSFMCELHAHP-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CC2(CCCO2)C3CC3)C=CC(=C4)Br)C5,48149D1FFC255360_046D041CEED79356_6034_UN,7.9097686,00000000000000000000001000000000000000000000001000000000010000100110000000110000000101010000000110001100010101011001101011100100110010100110000011011100110111101111110,YYXXENOPBCFOTK-UHFFFAOYSA-N
FC2=C1C=CN=C(C1=CC=C2)NC4=C(C=C3OCCCOC3=C4)[N](=O)=O,E701C52829776914_52ECE5E98D69B857_6041_UN,8.127424,00000000000000000001000010000000000000100010000001000000110000010100001110000101000000010100001001100110010101000100001111101100001011110110101011111011110011110111110,LVQFKFPGIQFAAZ-UHFFFAOYSA-N
N(CCC12CC(C1)CO2)C(=O)C3(CCC3)C4=C(C=C(C=C4)F)F,D097A7898ED30C0B_CE5BA317F7315703_6038_UN,7.7985597,00000000000100000000000000000000000000000010000000000000010000100010000000000000001100010011100011001000110101111000011000000000110010100110000010010011111111110111110,WGQZICQKFMCEQT-UHFFFAOYSA-N
CCC(C)C2=C[N]1C=CC=C(C1=N2)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,D0ED099EA548CC77_FAB0E435DACE53B3_6041_UN,7.778167,00000000000000000000000000000000000000100010000000000000010000100100000000000101001101010011000011101100010101000011001011100100110011110110001001011111110111101111110,VVUNEMKBKFOZFE-DJYSHGJYSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC3=C(C=CC=C3)C4=CCCNC4,FA00E91C1BC5C940_A377C49BCE2C46A9_6035_UN,8.382513,00000000000000000000001000000000000000000010000000100000000000100010000000001000001010110011000001111000100101011100001001000111110100100110001111010011110101100111110,XALFBAUWBCCKNZ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2OC3(CC2)CCCCC3)F)CC4,4511F3C8CEAF5005_BCD7FE2B3F8BB369_6041_UN,6.903492,00000000000000000001000000000000000000000010000000000000010000000010000000010001101101110011010110001000010110011001101011100000110011110110001011011011110111101111110,BOXCIYKNUWFYIN-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)C#N)N[C@H]3[C@H](C2=C([N](N=C2C)C)C)OCC3)F,9D3D5CB130690C2F_8933F2AF9C1FD3F8_6041_UN,7.668953,00000000000000000000000000000000000000000110000000001000010000100100000000010000100100010011011111000000100101010000001011101100000011110100011010011111110011101111110,MDLFPOFRDBFFSY-CXAGYDPISA-N
FC1=C(C2=C(C=C1)C=CC=N2)NC4CCOC(C3=CN=C[N]3C)C4,1955CA242E4567C9_61C0221F120876B3_6041_UN,7.7175574,00000000000000000000000000000000000000000010000000000000010000100100000000010101000101010010010111100100110111010000001011100100110011110100001011011011110011101111110,PZVBQJCNMBHXOW-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC2NCC3(C2)CCSCC3)C=CC(=C4)Cl)C5,763B6E351D3E7AC5_A05197EEBEE73872_6034_UN,7.0260487,00000000000000000000000000000000000010000000000000000000000000000110000000010001101101111011010010101101110100011001101011100100110000100110001011011001010110101111010,KAYOWAWHYDSRSD-UHFFFAOYSA-N
C2(=C1CCCCC1=NC=C2)NC3=C(C=CC(=C3)CN(C)C)C,381D5A1AD2ABC186_C0DBA09FD9569353_6041_UN,7.3032594,00000000000000000000000000000000000000000000000000000000000000000100000000100000100001100011010000101100010000010001001001100100110001010100011011011111010110101111010,CKASFYYSAZKOTP-UHFFFAOYSA-N
FC1=C(C=C(C=C1)N[C@H]3C4=C([C@H](N2CCN(C)CC2)C3)C=CC=C4)C5OCCO5,722D4860CF524738_C23D796B9CB6407A_6041_UN,7.570474,00000000000000000000000000000000000000000010000000000000010000100000000010010001100101110000010010101100110101010001101011110100110011110110001011011011010011111111110,SIPBSJRROHZNAZ-FGZHOGPDSA-N
CC1=C(C=NC(=N1)C2CC2)C3=CC=C(C=C3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,556030AC0FF7860E_A45F717278EE904B_6041_UN,8.359958,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101110011010010101000100110010001101011100100000001110100001011011111010010101111010,ZPOPFXZUGXHFPO-RPWUZVMVSA-N
C[Si](C)(C)C1=C(C=CC=C1)NCC2CCCC23CCNCC3,7870AB98127EE003_370F6E63394A5078_6041_DP,7.357802,00000000000000000000100000000010000000000000000000000000000000000010000000100000001000100011010010101000110000011000001001000000110101010110011011011111010110101111010,RRRVGKMRCNVSIF-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4(CC4)CC5=C(C=C(C=C5)F)F,FA2BA1BE64E569D9_208C9BDDB37AC562_6041_DP,8.065184,00000000000000000001001001000000000000100010000000000000000000000110000000000100100101010011010010100000111100011000101011100100110101110100001011011011000110101111010,IYKCMMLHNXBTKN-BCDXTJNWSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3(CCCCC3)C4=C(C(=CC=C4)F)F,53C6C229C9CD2F61_BA1C553A59EB9A02_6041_UN,7.7456055,00000000000000000000000000000000000000100010000000000000000000100110000000010100100101110011010010101000100110011001101011100100110001110100001011011011010010101111010,XNNXIZIYKYWFPP-IBGZPJMESA-N
CC1=NC(=C(C(=C1)C)F)NC[C@@H]2C[C@H](F)CN2CC3=CC=CS3,AF1DEEE6B728A13F_219E0BAAFDCA8037_6041_UN,8.597328,00000000000000000000000000000000000010100010000000000000000000000100000000010101011101111011000010101000000100010000000011100100110001110110001010001111010110101111010,XGLWOHGZSHTFOW-KBPBESRZSA-N
FC1=CC4=C(C(=C1)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C)OC=C4,5305ED7D7B4F72E1_B0012689AF6F1256_6041_UN,7.999218,00000000000000000000000000000000000000000010000000000000010000100100000000010101101101110011010110101100010110010001101011100100110001110110001011011111110110101111110,JBGITOQKBILNOB-KBXCAEBGSA-N
C[N]1N=C(C=C1NCC2(CCC2)C3=C(C=CC=C3)F)C4CCCC4,9FC3243172F0BFD5_2228C46AC1E518D3_6041_UN,7.796292,00000000000100000000000000000000000000100010000000001000000000100110000000010101101100010011011010001000000110001000001011101100110001110100001010011011010110101111010,IIOZPHMUXODTRP-UHFFFAOYSA-N
O(C(CBr)C1CCOC1)C3=CC=C([C@@H]2[C@H](C)CCNC2)C=C3,E4029F3682245A72_AD0987C634FE27A6_6035_UN,8.110758,00000000000000000000000000000000000000000000001000000000010000100000000000000000001100100101000010101000100001010101101011000011110010100110000101010011110101111111110,JAOSTDZOYGAGKZ-NQJSSHCRSA-N
FC1=C(C=C(C=C1)NCC2(CCN(C)CC2)N3CCOCC3)C4OCCO4,525EC4D8A8A9B341_DB4B47FFA9F709DB_6041_UN,7.2991247,00000000000000000000000000000000000000000010000000000000010000100010000010010001101101110011010110101000000101011001101011110000110011110110001011111011010111111111110,JZXJRTHLGLNZEB-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2C(C)(C2)C3=C(C=CC=C3F)F)C4CCCC4,BCFB30E6BB12AD86_1AB60C7D6E0C9262_6041_UN,8.237195,00000000000000000000001000000000000000100010000000001000000000100110000000010101100100010010011010000000100100011001101011101100010001110100001010011111000010101111010,RTIILEFGCYWYSO-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCCC(C)O2)F)CC3,0A9FF64D8A35C87C_C6F5D3BE502634DD_6041_UN,7.354199,00000000000000000001000000000000000000000010000000000000010000000000000000010001101001110011010100101000000110010001101011100000110011110110001011011111110111101111110,PBIKLJCJAAHESE-UHFFFAOYSA-N
N5CC1=C(C=C(C=C1)N[C@@H]2CCN(C)[C@H]2C3=CC=C(C=C3)F)C4(CC4)C5,DDDFCF5C0FE48360_87B0CCD1E4B76A84_6041_DP,7.8942046,00000000000000000000001000000000000000000010000000000000000000100010000000010001101101110011010010101100110110011001101011100100110101110110001011011011010010101111010,IGOGUVBWRLYBCC-RTWAWAEBSA-N
N(CCC1CC2CCC1O2)C(C3=C(C)C=NC(=C3)F)=O,BED92F838037807E_F9B777B17D5EF3BA_6038_UN,8.11045,00000000000000000000000000000000000000000010000000000000010000000100000000000000001100010001100010101000110100110000011011000000110010100100001011010011111111111111110,YCBXSFQBQWXOOU-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)OC4CCC5C2CC(C3OC23)C45)F,A31EDBC4E30A8945_D661DE8DBC911B35_7022_UN,8.560196,00000000000000001001001000000000000000000010000000000000010000000000000000100000000001110000010010101100010100000101001000100011110010100100000111011110110101111111110,BBTRVPKOCIWNJN-UHFFFAOYSA-N
CN(CC1CNC1)C2=NC(=CN=C2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,8819E7D2C093C7C9_FF2620E914FACA26_6041_DP,8.696489,00000000100100000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100100101110110001011011111010110101111010,DUTOEOUZBQTQSX-XLIONFOSSA-N
C[Si](C)(C)C1=CC=C(C=C1)NCC2C3(CCNC2)CCC3,6F3A53614E19E180_3C5927E31D27A3F9_7022_DP,7.342614,00000000000100000000100000000010000000000000000000000100000000000010000000100000101000100011010000101000110000011000001001000000110101010110011001011101010110101111010,AIXVLVJUGRNWJM-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCCC3CC(C)CC(C3)(C)C)F,0AD7B87BF40C2382_DC7CF361DC73D166_6041_DP,7.880562,00000000000000000000000000000000000000000010000000000000000000000010000000100000001000010011000000101100110110011001001001000000110101110110011011010111010110101111010,USCJPDOEHIWLOD-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NCC3=C(CN(C)C2CCCCC2)C=CC=C3)C4CC4,39D55DA67A35B65B_9072C805652BAD16_6041_UN,8.283276,00000000000000000000001000000000000000000010000000000000000000100000000000000000001001110001010000001000000110010001101000100100110001110010001011011011010110101111010,BBUHBEQHZRQBBC-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CCN(C)C2CNCCC2)C=CC(=C3)C)C4,DC35B8FFEDFC3D10_4B5B969977A5BD31_6034_UN,8.267417,00000000000000000000000000000000000000000000000000000000000000000100000000010001001101100011010010101100110010010011101011100100110001000110011011011101010110101111010,HXPMAWXNTQHYPZ-UHFFFAOYSA-N
C1CC(CCN1)C2=CN(C3=C2C=CC=N3)CCC4CCCCN4C,988125545D929714_54BC9F6013B393BA_6034_UN,7.7395215,00000000000000000000000000000000000000100000000000000000000000100100000000010100101101100001010010101100110010010001101011100100110000000110001001011011010110101111010,XGUJPNAFSRENLH-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CCC2)C3CCCCO3)F)CC4,FB2EB0C756BCD757_68D7B3754B0AC217_6041_UN,7.491774,00000000000100000001000000000000000000000010000000000000010000100010000000010001101001110011010001101000000111011001101011100000110011110110001011011011110111101111110,ZGEOZJRKCXAVGZ-UHFFFAOYSA-N
CC1=C(C=CC(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)CC#N,00BC96291D6BAD2D_CCA726A09976A5C7_6041_DP,7.4712057,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000101001000100110101110110001011010011010110101111010,HBWISVJSBLVZDZ-GHTZIAJQSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC4CCCC3(CCC3)C4,3A4F6C27DD46608B_6E9658CC5B14FF87_6041_UN,8.153985,00000000000100000000000000000000000000000010000000001000000000000110000000010000100100010011011010000100110100011000001011101100110001110100001001011001000010101111010,KNWVPSMHFKAOLQ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC3C2(CC(C)(C2)C)C3)Cl)C4CC4,E765C6834B54BC21_BE771065008944AF_7022_UN,7.706487,00000000000100000000001000000000000000000000000000000000000000100010000000100000000000010011000000000001110110011001000000000000110001110000010010010111000010101111010,RPGZBFNIMTXELM-UHFFFAOYSA-N
[NH]1C=CC2=C1C(=CC=C2)[S](=O)(=O)N4CC3=C(C=C(COC)C=C3)CC4,910491330C07DF8D_01C8597F364A3832_6026_DP,8.996121,00000000000000000000000000000000110000000000000000010001001111001101000001010000110100101000011011101110011001011001011011101110111000001110001011111001010111111111110,VQKGJCYTOLQXOV-UHFFFAOYSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3=C(C=CC(=C3)C4OCCO4)F)C5,5DDDF0B141C52926_36C2B6335F846116_6041_UN,7.2451797,00000000000000000000000000000000000000000010000000000000010000100100000010010000101101110011010010101100110101010001101011110100110111110110001011011011010111111111110,KVSHLAMSXRRQJF-UHFFFAOYSA-N
C2(=CC1=NC(=C[N]1C=C2)C3CC3)NC4=CC=C(CC[Si](C)(C)C)C=C4,052FC7A6F2717361_1B3515571C6C6111_6041_UN,8.463308,00000000000000000000101000000010000000100000000000000000000000100100000000100101100101100000010010100100010000001001101011100100000001010100011001011101010110101111010,BUPNVILXUKOUQT-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NCC2CC3(NC2)CCC3,4836DBA20676916B_815C0340A52AB1B8_7022_DP,7.4416113,00000000000100000000100000000010000000000000000000000100000000000010000000100000101100100011010010001000110000011000001001000000110101010110011000011101010110101111010,XTDUXDRGYIZLAH-UHFFFAOYSA-N
COCC14CC(C1)(CNC(=O)C3=NC=C2OCCOC2=C3)OC4,86E6EBDBE7A773D9_08068E210564B982_6038_UN,7.508017,00000000000100000000000000000000000000000000000000000000010000000110000010000001001100100111110111101100010011101101011011000010110010000110101011110001111111111111110,DKJWJTVIFWPSPL-UHFFFAOYSA-N
CC[C@@H](OCCN1CCSCC1)C2=CC(=C(C=C2)C)F,2C7FCBA04A078062_4B187E00DC03829C_6039_UN,8.765749,00000000000000000000000000000000000010000010000000000000000000000000000000010000000001111000000100101000000111010010001011100010110010100110000011011110110101101111110,HZQNNHSHYCNYIQ-MRXNPFEDSA-N
N(CCC1CC2CCC1O2)C(C3=CC=C([N]3C)C4=CC=C(C=C4)F)=O,1DFA5AB859D35F86_DAF98625599C94C6_6038_UN,7.734506,00000000000000000000000000000000000000000010000000000000010000100100000000010001001101010001110110001000110100110000011011100100110010100100001011011011111111111111110,QOOMLIPMYCEQHC-UHFFFAOYSA-N
CC1=C(C=CC=C1)NC2=NC(=CS2)C=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,8AA289EDAF5D9F2B_9778CD782DD403E2_7019_UN,8.068356,00000000000000000000000000000000000010000010000100000000000000000100000000000100010101011000010010010000001110010000101011100100010001110100001011011111000010101111010,RJDRZWFYRGCXRF-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC2=NC=C[N]2C[C@H]3CNCC(O3)(C)C,78A1225FEF9A43B4_48F25CAAA0A44C53_6034_DP,8.122659,00000000000000000000000000000000000000100000000000000000010000000110000000110101101101110011000110101001000110011001000011100100110111110110011011001111110111101111110,KXTNPGAOULQIBF-CQSZACIVSA-N
C2(=C1C=CC=CC1=C(C=C2)Cl)NC3CCN(C)C4CCCC34,AE3F8354DC7EEE1F_2F9C7E452F2927F7_7022_UN,8.259326,00000000000000000000000000000000000000000000000000000000000000000000000000010000100001110011010010101101110110010001101001100100110001110100001001011001010010101111010,PPQHPZKEFFHPHQ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC3=CC=C(CCN2CCN(C)CC2)C=C3)C4OCCO4,14D3B503EC4AED0F_A838A3FA41C06049_6041_UN,7.5130186,00000000000000000000000000000000000000000010000000000000010000100000000010010001000101110000010010101000000101010001101011110100110011110110001011011011010111111111110,JOHKCYLQKZWIOB-UHFFFAOYSA-N
FC1=CC2=C(C=C1)OC=C2NCC3N(C)CC4(CC3)CC4,72ADAA1BAEEF8393_E760A188C66A7753_6041_UN,8.085607,00000000000000000000001000000000000000000010000000000000010000000010000000010001001101110011010111101100010110011001101011100100110001110110001001011011110110101111110,CEPDQHLQOUCTPW-UHFFFAOYSA-N
CC1(CCO1)C2=C(C=CC=C2)NC3C4CC5CC3CC(C4)(F)C5,A2B47C619BE28DFC_C01DD165EB443DA4_6041_UN,7.045318,00000000100100000000000000000000000000000010000000000000010000100010000000000000000000010011000001000100010101001001101000000000100011110100000011010011110011101111110,JLFWCMHNVLPQKD-UHFFFAOYSA-N
C[N]1N=C(C=C1NCC2=CC(=C(C=C2)N3CCOCC3)F)C4CCCC4,79D258246646EDAE_ACC9695DA723A019_6041_UN,8.1204195,00000000000000000000000000000000000000100010000000001000010000100100000000010101101101110000011110101000000111010000001011101100110011110110001011011011010111101111110,WVBFAJIPUUUFQV-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NC3(CCOCC3)C4=CC=C(C=C4)F,A0CB1EFF53BB2B36_DD0DC32A124FB134_6041_UN,7.6665325,00000000000000000000000000000000000000100010000000000000010000100110000000010100100101110011010011101000100111011001101011100100110011110110001011011011010011101111110,WZYWDOMBVHHAAP-IBGZPJMESA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC3C5=C(C4CCC3C4)C=CC=C5,7D37CB9D4CA29A0D_9BBE0458CD040D52_6041_UN,7.7674227,00000000000000000001000000000000000000100010000000001000000000100100000000010101100100010011011010100100010100000000001011101100010001110100001011011011000010101111010,MEZLYLFRBAOIKH-UHFFFAOYSA-N
O(C(=O)[C@@H]1CSC(N1)C2=C(C(=CC=C2)Cl)Cl)CC4=CC3CCC(N3)C4,AC78E4D1F233D206_5B233A067A4D245D_6031_DP,7.9277687,00000000000000000001000000000000000010000000000100100000000000100000000000001000010100011011000110110001110101010000001011010010110100100110001011010011011111110111110,KWDWAMXBXONMRL-IQGLFJIHSA-N
CC1=C(C=C(C(=C1)NCC2CCOC(C)(C2)C)Cl)C3CC3,90B4B384B9580615_B364343D0D1CB5E8_7022_UN,7.9306507,00000000000000000000001000000000000000000000000000000000010000100010000000100000001000010011000000101001000111001001101000000000110011110110010011010111110111101111110,PWUXNCJOWCJJSR-UHFFFAOYSA-N
NCC23CCCC(CN(CC1=CC=CC=C1)C2)C3OC4=C(C=C(C=C4)C5=CN=CC=C5)Cl,15A5D577C7CA58A3_5C1E1A75AFF57742_6035_UN,8.277305,00000000000000000000000000000000000000000000000000000000000000100110000000010000101011110011000001101101010100001100001011100111110000100110001111011011110101100111110,VZJDLGVUPPFWMC-UHFFFAOYSA-N
OC3CCCC(C=CC1=C[N](C)C2=C1C=C(C=C2)F)C3,5B17451F7487BA16_EC690D1B03AF3E61_7019_UN,8.994593,00000000000000000000000000000000000000000010000000000000000000000100000000010000000101010011010010010100110100000000001001100101110010100101000101011000100011101111110,YHSZMCDJSIMUNC-UHFFFAOYSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC3=C4C(=CC=C3)CNC4,C9BF0EB54ECFC52A_6F16291FAEDD965B_6035_UN,8.081142,00000000000000000000001000000000000000000010000000000000000000100010000000000000001110110011000011001100010101001100000001000111110100100110001111000011110101100111110,HJOWCRFRMNCRRG-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC4=CC=C(C(=C4C)F)F,01837780F542784B_97805680E552FA29_6041_DP,8.5725355,00000000000000000001000000000000000000100010000000000000000000000100000000000101100101010011010010100000110100010000101011100100110101110100001011011111000010101111010,HZTMJCYKXIAZOZ-BTTYYORXSA-N
C[N]1N=CC(=C1NC2=CC=C(C=C2)C35CC4CC(CC(C3)C4)C5)F,C1EEB96C52F595BA_AB0277C240C2499A_6041_UN,8.352238,00000000000000000000000000000000000000100010000000001000000000100110000000010101100100010000011010000100010100001000000011101100100001110100001011001011000010101111010,YKYNHNMAFYLSDD-UHFFFAOYSA-N
C[N]1C2=C(C=N1)N=CC(=C2)NC3CCC(C(C)C)CC3CC4=CC=C(C=C4)Cl,952D172E041C0859_C8E55E85E2D419E8_7022_UN,8.559597,00000000000000000000000000000000000000000000000000001000000000000100000000110001100100010010011010100101110110010000101011101100110001110100011001011111000110101111010,ZKJOXZAHOWNCLU-UHFFFAOYSA-N
NCC23CCCC(CN(CC1=CC=CC=C1)C2)C3OC4=C(C=C5C(=C4)CNCC5)F,6E91E99EB8B58786_7D2D4D2E9EC73374_6035_UN,7.625822,00000000000000000000000000000000000000000010000000000000000000000010000000010000101011110011000001101100110100011100001011100111110100100110001111011011110101100111110,OLBPACHRFNYVDD-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC3(F)CNCC3C4=CC=CC=C4)C5=CCNCC5,3EC9A3126CAA92A9_3D67E4391A133C8F_6034_UN,8.258458,00000000000000000000000000000000000000000010000000100000000000100110000000011000101101110011000010111100110100011000001011100100110100100110001001011011010110101111010,PGWYSYWVORFSAK-UHFFFAOYSA-N
CN(CC1CC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=CC(=C(C(=C4)F)F)F,6FC92435A854B648_76D11CD19E940F96_6041_UN,8.466041,00000000000000000000001000000000000000100010000000000000000000100100000000000101100001110010010000101000100110010001000011100100010001110100001011011011010110101111010,IBSRRLJEMZEBDC-SWLSCSKDSA-N
CCN3CCC1=C(C(=CC(=C1)NC(CC)C2=N[N](C=C2)C)F)C3,F7F7FBA8944D7958_882AFE1C82A7DC69_6041_UN,8.315298,00000000000000000000000000000000000000000010000000001000000000000100000000010001100101110001011010101100110110010010101011101100110001110110011011011101010110101111010,VMFYCMWUFVHWET-UHFFFAOYSA-N
O[C@H](CCl)C1=CC=C(C=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,CF14CC25736DD0C7_9AE536FFB79546A1_6041_DP,8.809924,00000000000000000000000000000000000000000000000000000100000000100100000000010101101101100011010010001001100010000000000011100100110111110111001010001011110111101111110,QESRPZPZAMJGAQ-YSVLISHTSA-N
C(C1(CCC1)C2CCCCO2)=CC4=CC(=C(N3CCN(C)CC3)C=C4)F,F7238EA80FF34A85_F64002C56CFEF75B_7019_UN,7.3603735,00000000000100000000000000000000000000000010000000000000010000100010000000010001000001110000010000111000000101011001101011100000110011110110001011011010110011101111110,YJXFMNUHHYZKOI-UHFFFAOYSA-N
CC1=NC(=CS1)C2=CN(C=C2)CC3CCCN3CC4CCCN4,7C2602AF5309235C_25CE7FE425D02360_6034_UN,7.9649534,00000000000000000000000000000000000010000000000100000000000000100100000000010001111101101011000010001000100000010000001011100100110000000110001000011011010110101110010,YUUGMWZSTXRYBB-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC(CC)CCC3CCCCC3,8F62E4D0BFEA456F_5A8F0AD8B0A96F0D_6041_UN,7.7536783,00000000000000000000000000000000000000100010000000000000000000000100000000000100000000010010000000100100110110010010101001000100110001110100011011010111000110101111010,XKNGQCWDSMFCCN-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=NC=C2)NCC[C@@H]3CC[C@H]4C[C@@H]3C4(C)C,5C90F57A54722278_3BF91DA8D969DC18_6041_UN,8.473927,00000000000100000000000000000000000000000010000000001000000000100110000000100000001000010001001000101000110110011000101011001100110001110100001011010111010110101111010,XEQBNKUNYPUEMS-WBAXXEDZSA-N
N1CCC(=CC1)C2=C[N](C3=C2N=CC=C3)CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,C795631A205BA260_09A6877B8DB2F27D_6034_DP,8.413908,00000000000000000000000000000000000000000000000000100000000000100100000000011001101101110001000010111101110110010010101011100100110100100110001011011011010110101111010,CLXLJEFOMZTGEM-UHFFFAOYSA-N
CCC2OC1=C(C=C(C=C1C2=O)NC35CC(OC34CNC4)(C)C5)F,8B92EBB123EDC79E_C99DDB450C57351C_6041_DP,8.194708,00000000100100000000000000000000000000000010000000000100010000000010000010000000101100110111000111001100110110011111000011000001110111110110001110100111111111111111110,XGTFQHLTWXQMHM-UHFFFAOYSA-N
N(CC2C1CCCC1C2)C(=O)C3=CC=C(C=C3)C4=CC(=C(C(=C4)F)F)F,22D39E4756FDA148_4A1A2A168DF4362F_6038_UN,7.838308,00000000000100000001000000000000000000000010000000000000000000100000000000000000001000010011100010001000010100100000011000000100110000100000000011010011011110100111110,PPLKJTBPHSXGIW-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(CCCNC2)F)F)CC3,A60D9AB03AFF21A1_4B391C6F64255916_6041_DP,7.9727936,00000000000000000001000000000000000000000010000000000100000000000010000000010001101001110011010000101000100110011001101011100000110101110110001011011011010110101111010,GLZWKYAEVGKVAB-UHFFFAOYSA-N
C1(=CC(=CC=C1)COC2CCOC2)NC[C@@H]3CNCC(O3)(C)C,5CC4E89714AFBB02_762A9D3F16F3D3C2_6041_DP,8.024812,00000000000000000000000000000000000000000000000000000100010000000010000010100000101100100111000110101000000011001001001011000011110111010110001101110101110111111111110,SDSFNHZQFQJLLM-DJNXLDHESA-N
O=[N](=O)C1=C(N=C(C=C1)NC2=C3C(=CC=C2)COCC3)C4=CC=C(C=C4)F,D5F48366E8DC2A17_59BFDAC1E99A0175_6041_UN,7.664196,00000000000000000000000010000000000000100010000001000000110000110100001100000101000000110011001001100110010101000000001111101100111011110110001011111011010011110111110,SPZMZIBPHGOYIX-UHFFFAOYSA-N
O([C@@H]1CCCC2=C1C=CC=C2)CC3=CC4=C(C=C3)NC(=O)O4,9004035FB3D38400_8B4F06CCC590EC0E_6039_UN,8.768057,00000000000000000000000100000000000000000000000000000000010000000100000000000000000100000000000110000100011001100100011011010111110010000100000111110001111111010111110,BXDGWFRRDYMZBG-MRXNPFEDSA-N
FC1=C(C(=CC=C1)C[N]2C=C(C=N2)NCC3CCNC(C3)(C)C)F,9D1CF38C005F1E9A_FC88943BB4A1DF5B_6041_DP,8.431269,00000000000000000000000000000000000000000010000000001000000000000110000000110001101100010011001010101000100110011001101011101100110101110110001011011111010110101111010,KOAHJBGATGFWSD-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3=CC=C(CO[Si](C)(C)C)C=C3,88948C16FD838C49_12B39CB209CF56CB_6041_UN,8.162222,00000000000000000000100000000010000000100000000000000000000000100100000000110100100101100000010010101010000011011001101011101110010001010110011001011111010111101111110,HGXGHNSNGBRLAR-IBGZPJMESA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NCC(N3CCCC3)C4=CSC=C4)C,1F52E1EFBE624099_0832EC1732510C7A_6041_UN,8.1315565,00000000000000000000000000000000000010000010000000000000000000000100000000010001101101111001000010101100010110010000001011100100110001110110001011011111010110101111010,BYADSKQMQLZZMZ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC4(CC3=C(C=C(C=C3)F)F)CCOCC4,832FE1FA720461C0_3FE96F14D252E2FC_6041_UN,7.9014907,00000000000000000000000000000000000000100010000000000000010000000110000000000100000000110010000001100100110101011000001011000100110011110110011011010111010111101111110,BFQFZDPAHKVYLU-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCC(C)CC2)Cl)C3CC3,11148776D19064FD_A6CB88B79A83B6A0_7022_UN,7.9137263,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010011000000001001000110000001101000000000110001110000000011010111010110101111010,USMIVBZENTVVDK-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)C2OCCO2)C)NCC3CNCC4=C3C=CC=C4,2663FD8DB25E7DFD_F96573FA811F3E60_6041_DP,7.3856144,00000000000000000000000000000000000000000000000000000100010000100000000010000000101100100010000010101100010011000000001011010100100111010110001011010111010111111111110,VMKWTMFHWBHCAE-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CC4(CN3)CCOCC4,776E9D1840DDFB9D_5CEC5389C2D0FF6A_6041_DP,7.33753,00000000000000000000000000000000000000100010000000000010010000000110000000000101001100110011000010101100110111011000001011000100110111110110001011010111010111101111110,BSXNOFAFYNNMFA-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=CC=N2)NCC3CCCN(C)C3C4=CC=CS4,BAAFC1AE223E5285_8BB1E20867E139EA_6041_UN,8.235522,00000000000000000000000000000000000010000000000000000000000000100100000000010001111101101011010010101100010010010001101011100100110001010110001011011111010110101111010,XKNDKDZJXHUHSZ-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C[N]2C=C(C=N2)NCC3CNCC(O3)(C)C)F,A22EF30724AB2C19_59A8D9DBB8DF526F_6041_DP,8.528052,00000000000000000000000000000000000000000010000000001100010000000110000000110001101100110011001110101000000110011001000011101100100111110110001011001111110111101111110,HVXLNOGWCHKEKT-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NCC2(CCCCC2)C3=CC(=CC=C3)F)F)C4,C7559F92495E53DA_CD1C7F6D67AAD1D2_6041_UN,7.354899,00000000000000000000000000000000000000000010000000000000000000100010000000010000001001110011000000101100010110011010101001100100110001110110001011011001010110101111010,MMJDZCWXKWDCSK-UHFFFAOYSA-N
C(C2C1CC3CC(C1)CC2C3)=CC5=CC4=C([N](C)N=C4)N=C5,0381DFF27421ABF8_AD24CD2C23006FFE_7019_UN,8.895526,00000000000000000000000000000000000000100000000000001000000000000100000000010101100100000000011010110100010000000000000011101100100000000100001001001000000010101111010,IPUPDBUCACPDNJ-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=CC=C2NCC3N(C)CC4(CC3)CCC4)C,3CEAA41AE075EF18_C7D9592488EB73F8_6041_UN,7.489864,00000000000100000000000000000000000000000000000000000100000000000110000000010001101101100011010010101100010010011001101011100100110101010110011011011111010110101111010,MAEDAHWVQDSOKW-UHFFFAOYSA-N
N(CC12CCN(CC1)CC2)C(=O)[C@@H]3C[C@H]3C4=CC(=C(C=C4)F)F,C2956917CEB034E8_457B0E79BD9E7DC8_6038_UN,7.465303,00000000000000000000001000000000000000000010000000000000000000100010000000000000001001110011100000101000010100111000011001100000110000100110001011011011011110100111110,KVDZGQFROCGXJL-UONOGXRCSA-N
CC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCC3)CC4NC5CC4C=C5,6DF5B8CC8DFE94D6_F311C74C4E84DEA8_6034_UN,7.7368536,00000000000000000000000000000000000000100000000000000000000000100100000000010101001101000011000010111000110000010000001011100100110100000110001011011011010110101111010,YGCBXUUJEQDTMM-UHFFFAOYSA-N
N(CC12CCN(CC1)CC2)C(=O)[C@@H]3C[C@H]3C4=CC(=C(C=C4)Cl)Cl,C2A0ACE8C9EAE343_E4E77E392408A985_6038_UN,7.4652934,00000000000000000000001000000000000000000000000000000000000000100010000000000000001001110011100000101001010100111000011001100000110000100110001011011011011110100111110,FTLQRYHWQHPWLX-UONOGXRCSA-N
CC1=C(C(=C(C=C1)N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)F)C#N,BCE612989A437CC9_20F2B4D9C34CC002_6041_DP,7.7245293,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010101111010,JSQKZKLJCQRFFZ-CRAIPNDOSA-N
FC2=C(C=C1C(=CN(C1=C2)C[C@H](CC)NCC3=CC=CC=C3)C4=CCNCC4)F,A869220EB57FA285_B52A559B6DE426DE_6034_UN,8.185469,00000000000000000000000000000000000000000010000000100000000000100100000000011001001101110001000010111100110110010010101011100100110100100110001011011011010110101111010,AEDATBMXSMBLKF-IBGZPJMESA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4=CC(=C(C(=C4)F)N5CCCC5)F,F6E728EA4F2E7191_323C9C9C86A0E5E8_6041_DP,8.142853,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101110001010010101000010110010000001011100100110101110110001011011011010010101111010,ISZKVUXPJYMOIZ-FSWDVZBNSA-N
CCC(C)C1=NC(=C(C=C1)C#N)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,86D8DA85FAB1F3B7_07D6BC0F5EA312EF_6041_DP,7.4392214,00000000000000000000000000000000000000100110000000000100000000100100000000000100101000110011000000101000100100010011001011000100110101110110001011010111010110101111010,VLULWBGAFZBMSL-RUTXASTPSA-N
C2(=C1OC=CC1=CC=C2F)NCC4=C(CN(C)C3CCCCC3)C=CC=C4,BD1E4FBFDE600DC7_6FBF521C5185C65A_7022_UN,8.111941,00000000000000000000000000000000000000000010000000000000010000000000000000000000001101110001010110001100010110010001101000100100110001110110001011011011110110101111110,RACBBCMAGVDRKZ-UHFFFAOYSA-N
CN(C)C6CCN(C1=C(C4=C(N=C1C2=C[NH]C3=C2C=CC=C3)C=C(C=C4)Cl)C5COCCC5)CC6,EA20136DE7B14863_03947207A9C7FA29_2201_UN,8.303223,00000000000000000000000000000000000000000000000000000000010000100100000000110001100101110000010010101101010111010000101011100100110011110110001011011111010011101111110,VGOJMKFFOGSTOR-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC23CC(C)(CC2)CO3)F)CC4,29059516FF5BE125_A7895FC99E5AF8D3_6041_UN,6.860238,00000000000000000001000000000000000000000010000000000000010000000010000000010001101101110011010110101000010111011001101011100000110011110110001011011111110111101111110,RYWRCUWSTUFEKH-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CC3(CN2)CCC3)F,3C2ED63281765358_56C14366C67698D7_6041_DP,7.0828695,00000000000100000000000000000000000000000010000000000010000000000010000000100001001101110011010010001000110100011001001001100000110101110110001010011111010110101111010,MJZYILWBIJUFIH-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC3CNC(CO3)(C)C,709841680EEE5E61_EDCD5A0D3B359FFB_6041_DP,8.433059,00000000000000000000000000000000000000100010000000001100010000100110000000110101101100010011011110101000100101011001100011101100010111110110011011001111110111101111110,HZHOYXNNMFKLPV-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CCC3(CC2)CC3)F,E670BFE5B9121C5F_3C0F2AFF1345BE55_7022_UN,7.6288185,00000000000000000000001000000000000000000010000000000000000000000010000000100000001001110011010000001000010100001001001000100000110001110010001011011111010110101111010,ZCVMEAKBUPPTQY-UHFFFAOYSA-N
FC1=C(C(=CC=C1)CC#N)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F,1E5F42351692C928_1981719D330988BD_6041_DP,7.2584267,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,FIPCMCBHKKGNLR-SJLPKXTDSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NCC3C(CCCC3)C4CC4)C,C7B9FED2357D8150_C781C91298CD01F0_6041_UN,8.193946,00000000000000000000001000000000000000000010000000000000000000100100000000000000101000010011000000101100010110000000001001000100110001110100001011010111010110101111010,JBVPZEBQOUXCLA-UHFFFAOYSA-N
BrC1=CC2=C(N=C1)N(C=C2CC3=CC=CC=C3)C[C@]4(C)COC[C@@H]5CCCN45,DCD74E9F01DE7DC7_F0EEAF6B1DAD81EA_6034_UN,8.033997,00000000000000000000000000000000000000100000001000000000010000000110000000010101000101110000000111101100010111011001101011100100110000100110001001011000010111101111110,RHDPHKPZUKAFDF-NZQKXSOJSA-N
CN(C)CC1=CN(C2=C1C=CC(=C2)F)CC3CCCN3CC4CCCN4,9E5DF0C699869DB2_CE963FE33F3F20A3_6034_UN,7.868764,00000000000000000000000000000000000000000010000000000000000000000100000000110001101101110011010010001100110100010001001011100100110000100110001000011111010110101111010,BJFYYCZNQOUEAP-UHFFFAOYSA-N
NCC1=CC2=C(C=C1)C(=O)C=CN2CC4=C3NCCC3=CC=C4,0A62C12420385708_9C6763B78E1F3D5C_6034_UN,8.928597,00000000000000000000000000000000000000000000000000000000000000000100000000010000101111000011000011101100110000010100001011100101100100010110001111011001111110100111110,IVXOWBKUFJDZEB-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NCC2(C)C(OCC2)C3CC3)C4CC4,4E6F30FB1DE32069_70F51121BACC9E55_6041_UN,8.186141,00000000000000000000001000000000000000000010000000000000010000100010000000000000001100010011000011001000000111001001101000000000110011110110000010010011110111101111110,ZYVNCEKRQHPDNQ-UHFFFAOYSA-N
O(C(CC1CCOCC1)C=C)CCCN2CCN(C)CC2,FD7B02E81B8D74C7_62B5B527FE4988E3_6039_UN,8.228147,00000000000000000000000000000000001000000000000000000000010000000000000000010001000001100000010001111000000001010001101011100010110010000110001001011000110101111101110,HQWUYWLRVAULTH-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)F)CC4,18E05B5E0F7EB256_74F8DC91D82DEE3B_6041_DP,7.8528557,00000000000000000001000000000000000000000010000000000100000000100000000000010001101001110011010000101000100110010001101011100100110101110110001011011011010110101111010,MCIXYODMARUIHI-XUZZJYLKSA-N
CC1=CC2=C(C(=C1)C)N=C(C=C2C)NCCC3CC(C)OCC3,4CEFB175D18F90A5_A8C136607E2AFD83_6041_UN,7.7515388,00000000000000000000000000000000000000100000000000000000010000000100000000000100001000000001000000101100110011010001101011000100110011010110011001010101110111101111110,SEEWIPMAPILCDE-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)[S](C4=C3C=CC=CC3=C(F)C=C4)(=O)=O,57BD411BA0355F0E_CC8E140E695BF473_6029_UN,7.872919,00000000000000000000000000000000110000000010000000010001001111001001010001000000011000011001001010001110111100011000011000001100111000101000000001011001010110110111110,JPLRMLGOHUEZQD-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)F)NC23CC(C)(C2)OC34CCC4)F,272EA3C31897DCB4_588BC113F6604F70_6041_UN,7.8858366,00000000000100000000000000000000000000000010000000000000010000000010000000000000000100010011000111000000110110011001001000000000110011110100000010010111100011101111110,RYFZLAWSZZZKLA-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CC3)C4=CC(=CC=C4)F,3EB3CC2DA4026FBC_107C807730864827_6041_UN,7.345968,00000000000000000000001000000000000000000010000000001000000000100110000000010001101100010011011010001000000100001000001011101100010001110100001010011011010110101111010,HHVVASKMRDIRBS-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CC4CCC(C3)S4,2448891100701F62_C4364A667EB54B40_6041_UN,8.180655,00000000000000000001000000000000000010000010000000001000000000000100000000010000111100011010011010101100010100000000001011101100110001110100001001011001010110101111010,RTJAPSIFWOZHBE-UHFFFAOYSA-N
C1(=C[N](N=C1)CC2CCOC2)N[C@@H](CC)C3=CC(=C(C=C3)C)F,E67FCDC21D15AE2C_37BB3939FD95509F_6041_UN,8.497736,00000000000000000000000000000000000000000010000000001000010000000100000000010001100100110001001011001000100101010010001011101100110011110110001010011111010111101111110,WLBLZBJDYJTZQP-IBYPIGCZSA-N
FC1=CC2=C(C=C1)SC=C2NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,0F5518E298CEC669_E0821A1A06AC0ADB_6041_UN,8.200338,00000000000000000000001000000000000010000010000000000000000000000010000000100000011100011011000010001100010100001001101000000100110001110100000011010101010110101111010,MGMGPNVEQOONCM-UHFFFAOYSA-N
N1CC2CCCC1C2C=CC3=C[N](CC)C4=C3C=CC=C4,E048E1EB1DC01DA8_EA88ED7F7B44A18C_7019_DP,8.462295,00000000000000000001000000000000000000000000000000000000000000000100000000010000001101000011000010011100110000010010001011100100110000000110001001011001010110101111010,IJKWPPLIZBTECG-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@H]3C[C@H](CCC3)C#C,071536D1A26231C7_23FCF46CCB89B1E4_6041_UN,7.565276,00000000000000000100000000000000000000100010000000000000000000000100000000000100001000010011000000101100010110000000001001000100110001110100001011010111010110101111010,WLWZXUOKBLMTFO-JKSUJKDBSA-N
C1(=C(C(=CC=C1Cl)Cl)Cl)NCCC2CC(C)CC(C2)(C)C,C42526AF5C3A702E_D48E36C7BEBF8713_7022_UN,8.615114,00000000000000000000000000000000000000000000000000000000000000000010000000100000001000010001000000001001100110011001001000000000110001110000010011010111010110101111010,NOUWMEQWOUNBNG-UHFFFAOYSA-N
N(CC12CCC(CC1)O2)C(=O)C4=C3C=C(C=CC3=NC(=C4)C5CC5)F,93F574BE5D7AC6B5_6716F18FDF06C7E9_6038_UN,7.838385,00000000000000000000001000000000000000000010000000000000010000100110000000000000001100010011100110101100010100101000011011000100110010100100001001010001111111110111110,IYDRLBXKHAATQW-UHFFFAOYSA-N
FC2=C1N=C(N(C1=CC=C2)CCC3CCCCN3C)C4CCNCC4,3474A95DAB4AFAEB_E1AEF9EF7CE8E9FE_6034_UN,7.8021507,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110001010010101100110110010001101011100100110000100110001011011011010110101111010,YXIKIZLFICETPB-UHFFFAOYSA-N
CC1=C[N](N=C1)CC2=CN=C(C=C2)NC3C4CC5CC3CC(C4)(F)C5,44122F8C4D73E8A0_2D8EF8C4A1B8C97A_6041_UN,7.5679426,00000000000000000000000000000000000000100010000000001000000000000110000000010100100100010010001010101100010110011000000011101100100001110100001001001001010110101111010,WYVZWIVNNLFHNV-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3C4CCC3CCC4,6A4F2BD6CCBFCD4C_D653FF6EBA14A248_6041_UN,8.373236,00000000000000000001000000000000000000000010000000001000000000000100000000010000100100010011011010000100010100000000001011101100110001110100001001011001000010101111010,RROULAFVPFGMJU-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NC(C2CNC2)C3=CC=C(C=C3)F,FF81AC861525100A_566F328E8EF5F57D_7022_DP,7.9875183,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110010000000001001000100000000000001000100000101110110001011000011010010100111010,UTYNGGYYPUZJFH-UHFFFAOYSA-N
CC2=C(C=C1N(C=CC1=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5)F,B14B5CEE0F8A66D6_A3817C91D510E445_6034_UN,8.152119,00000000000000000000001000000000000000000010000000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011110010110101111010,VYVSDSFUFQKWLK-VGSWGCGISA-N
FC1=CC2=C(C=C1)C(=CN2CC4(CC3=CC=C(C=C3)F)CCNC4)C5=CCNCC5,6B47ED5561BE1804_0BCA4205BC48C5B1_6034_UN,8.621264,00000000000000000000000000000000000000000010000000100000000000100110000000011000101101110011000010111100110100011000001011100100110100100110001001011001010110100111010,BNGYEWYFWIFLMB-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)OCO2)C(C45CC(C3CNC3)(C4)C5)=O,E0A2D4C7B228ECBD_A1C5A5BEE2951855_6038_DP,8.08972,00000000100100000000000000001000000000000000000000000000010000100010000010000000001100100011100010001100010001101100010011010000110100000110001010100001111111110111110,DOFDJABVKHLCLG-UHFFFAOYSA-N
N2CCC(CC=CC1=CC(=C(N(C)C)C=C1)F)(CC2)C#N,0034CF305D7DF7C0_80C85188EB097A6E_7019_DP,7.967164,00000000000000000000000000000000000000000110000000000000000000000010000000100000001001110001010000111000100100011000001001100000110001110110001011011111010110101111010,SLVBFETWUYEQOI-UHFFFAOYSA-N
N3C[C@@H](OC1=C(C=C(C=C1)C2=CC=C(C=C2)F)F)[C@H](CC#N)C3,B72CC4CFD1F61166_B73CC36A6F01A0D4_6035_DP,7.36301,00000000000000000000000000000000000000000110000000000000000000100000000000000000001100110011000111001000000100010100000001000111110010100110001111000011110101100111110,NAWDOPACGVKDPM-RDTXWAMCSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC3=CC=C(C=C3)C4NCCC4,2113943AD6F79A68_389D578FB00C9C8E_6035_UN,8.329128,00000000000000000000001000000000000000000010000000000000000000100010000000000000001110010011000011001000100101011100001001000111010100100110001101010011110111100111110,VPSPYZXNMDSEJK-UHFFFAOYSA-N
CCC(NC(=O)CC1CC2CCC1O2)C3=C(C=CC(=C3)F)F,8ACD6B4196F27D39_FE42CFA6AF462422_6038_UN,7.884666,00000000000000000000000000000000000000000010000000000000010000000000000000000000000100010001100010000000110100110010011000000000110010100100000011010011101111111111110,MZPABRTYLROFNV-UHFFFAOYSA-N
O(CC1CCCC1OC2CCCCO2)CCN(C)CC3=CC=C(C=C3)F,7B88F0C11325205D_C0E47DA8501DACF9_6039_UN,7.623518,00000000000000000000000000000000000000000010000000000000010000000000000000000000000001110100010110101000000101010001101000110011110010100110000101111010110101111111110,WOBARNVHMWETSF-UHFFFAOYSA-N
CC1=NC(=C(C(=C1)C)C#N)NC3C2CCNC2C3(C)C,0588D3C50F457BCB_1674908A969F23BD_6041_DP,7.943857,00000000000100000001000000000000000000100100000000000100000000000110000000100100101100000011000010101000110010011000001011000000000101010100011010010111010010101111010,AHHQQQLCZVTGNX-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)NC2=C(C=CC(=C2F)C)F)[C@H]3C[C@@H]4CC[C@H](C3)N4,6132FDF099B17222_8AB95F75D96C0216_6041_DP,7.7728424,00000000000000000001000000000000000000100010000000001000000000000100000000000101100101110011011010101000110100010001101011101100110101110100001011011111010110101111010,MCPJWPGQZYXRMI-MIFYACCESA-N
N(CC1C2CC(C1)C3CC23)C(C4=C(C)[N](N=C4)C5=CC=C(C=C5)F)=O,0639F83FDA349AC6_CC19FD8C1654A1F9_6038_UN,8.558609,00000000000000000001001000000000000000000010000000001000000000100100000000010000101100010011101011001000010100100000010011101100110001110100001011001011011110101111110,WCHXKRORCXMYFI-UHFFFAOYSA-N
NCCC(OC1=CC=C(C=C1)C2NCCC2)C3=CC=C(C=C3)Br,012DFE484306C5CD_B085A7F47F965302_6035_UN,8.202936,00000000000000000000000000000000000000000000001000000000000000100000000000000000001110010011000011001000100100010100001001000111010110100110001101010001110111100111110,GVCVNAIDRQUEMV-UHFFFAOYSA-N
C(CC2COC1(CCCC1)O2)=CC3=C(C)[N](C(=C3)C)C4=C(C=C(C=C4)F)F,FB9A03895BEF6BC5_30966D242710BB4D_7019_UN,7.8066034,00000000000000000000000000000000000000000010000000000000010000100100000010010000000101010000000010010000010101001000001011110100110011110100000010011110110111111111110,IZPRJMNSDXABQP-UHFFFAOYSA-N
C(CC1C2CCN(C1)CC2)=CC3=C[N](N=C3C4=CC=CC(=C4)C)C5=CC=C(C=C5)F,F3399F12A2B17B89_EDA1F1475B6CDA72_7019_UN,8.028753,00000000000000000000000000000000000000000010000000001000000000100100000000010000100101110000001010111000010100010000001011101100110001110110001011011010010110101111010,YIISVVGJMUPULA-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(C3=N[N](C=C3C)C4=C(C=CC=C4F)F)=O,6FB7E164F0B80AC7_73AECE7E2C3BAA7D_6038_UN,8.287769,00000000000000000000000000000000000000000010000000001000000000100100000000010001101100010011101111011000010100100000011011101100110001110100001011011011011110101111110,NMEXGAKLCYFLDQ-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C([N](N=C3C)C4=C(C=C(C=C4)F)F)C,1B6AA1422EE1F25E_34AE5E627405C98A_7019_UN,8.273636,00000000000100000000000000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011110000010101111010,CIHBWNLFJSFILY-UHFFFAOYSA-N
N2CCC(OCC1=C(F)C=C(C(=C1)C#N)F)CC2C3=CC=CC=C3,AA5F3ECF1536467E_1CB2C7C4FD07EEF6_6039_DP,8.380234,00000000000000000000000000000000000000000110000000000000000000100000000000000000001000010001000001101000100101010000001001000111110010100110001111010011110111100111110,ZQGSLWMVSNSVFM-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)C3CC(F)(C3)C4=CC(=CC=C4)F,E7E843DCA2857D30_67CC34D0A0364634_6038_UN,7.3510494,00000000000100000000000000000000000000000010000000000000000000100010000000000000001000010011100010001000010100101000011000000000110000100000000001010001011110100111110,HYUTWBDYVBJWML-UHFFFAOYSA-N
C1(=CN=C(C=C1)C2CCOCC2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,2458D16D72CEDDB5_9EF24F349A970CE9_6041_UN,7.4031663,00000000000000000000000000000000000000000010000000000000010000100100000000010001000001110000010000101000000101010001101011100100110011110110001011011011010111101111110,KYDGFYIZBVQLJW-UHFFFAOYSA-N
N3C[C@@H](OC1=CC(=C(C=C1F)C#N)F)[C@H](CC2=CC=CC=C2)C3,B5EA344F083EB6E5_BDA97A0C57ACEEC1_6003_DP,7.9605427,00000000000000000000000000000000000000000110000000000000000000000000000000000000001100110011000111001000000100000100000001000111110010100110001111000011110101100111110,YTRZQLDFDLAMDY-RDTXWAMCSA-N
FC1=C(C=CC(=C1)NC4=CC2=C(C3NC2CC3)C=C4)C5CC(=O)OC(=O)C5,CF38D5CF0061182C_70F29F84A16A7275_6041_DP,7.7523003,00000000000000000000000000000000000000000010000000000000010000100000000000000000000100010110000010100100110100010000001011010101100111111100001111110011001011110111110,HFPPLSMNOAMHMN-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[C@H]3[C@H](CCCC3)N4CCOCC4,B6842CE31EF31798_6677801F11C98069_6041_UN,7.9955263,00000000000000000000000000000000000000000010000000000000010000100100000000010001101001110011000100101100010111010000001011100100110011110110001011011011010111101111110,UPEHDQYFMJDDQS-PXNSSMCTSA-N
N4CCC1=C(C=CC=C1NC2=CC(=C(C=C2)N3CCCCC3)F)C4,32054960FA3C4BC5_377C82123A8B9A0C_6041_DP,7.712287,00000000000000000000000000000000000000000010000000000000000000100000000000010000001001110011000000101100110100010000001011100100110101110110001011011011010010100111010,USMMIRAOCYEHND-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)C#N)F)NCC2(CCNC2)C(C)(C)C,87B8421C57C31F38_F0793A21A440AD09_7022_DP,8.552048,00000000000000000000000000000000000000000110000000000100000000000010000000100000101100110011000010001000100110011000101001000000110101110110011010010111010110101111010,CSQGYHZXYYQNAX-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CCNC3(C)C)Cl,69D80A3D51FC4BD6_921A53F4384D3848_6034_UN,8.06798,00000000000000000000000000000000000010000000000100000000000000000110000000110110111101011011000010001001101110011000101111100100110101110110011010011111010110101111010,ZPRITWKSUZMMOG-UHFFFAOYSA-N
C(C12CCC(CC1)C2)=CC3=C[N](N=C3C4=CC=CC(=C4)C)C5=CC=C(C=C5)F,466572EE8684CFD2_9504974BE1AECE9D_7019_UN,7.917921,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011010000010101111010,QMMDBQDCNJRDFU-UHFFFAOYSA-N
FC1=C(C(=CC(=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)F)C#N,6882BC491DC3554A_720A35349057822E_6041_DP,7.8518143,00000000000000000000000000000000000000000110000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001011010110101111010,WBJOPHZVFHHPKS-GXFFZTMASA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NC34COC(C)(C3)CCC4,89DCA426AB58B819_3107758F8AF6347D_7022_UN,7.2248135,00000000000000000001000000000000000000000000000000000000010000000010000000000000000100010011000111000101110111011001101000000100110011110100000011010011110011101111110,VGFLGFDRGIQCBK-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Br)NC34COC(C)(C3)CCC4,01EDF4F41DF5B73F_61E73DB9617D500B_7022_UN,7.2248163,00000000000000000001000000000000000000000000001000000000010000000010000000000000000100010011000111000100110111011001101000000100110011110100000011010011110011101111110,JNWXIVMNRNHRHJ-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2CCC3(CC2)CC3)F,A7D64CDB3B1B0EEF_79E7AB932E6B4581_6041_UN,7.6281304,00000000000000000000001000000000000000000010000000000000000000000010000000100000000001110011010000001000110100011001001000100000110001110000001011011111010110101111010,DRROYZIECMFQAT-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NCC2CCNC(C2)(C)C,20F29820151D36D5_9176C92718E49980_7022_DP,8.342831,00000000000000000000000000000000000000000010010000000000000000000010000000100000001000010011000000111000100110011001101001000000110100100110001001010101010110101111010,NITCOZLKCAGYDL-UHFFFAOYSA-N
CC1=C(N=C(N1CC2CNCCC23CCN(C)CC3)C4CCCN4)C5=CC=CC=C5,3948FF5789E538BD_43FB93573220340A_6034_UN,7.7671504,00000000000000000000000000000000000000100000000000000000000000100110000000010101101101100011010010101000110000011001101011100100110100000110001011011111010110101111010,ALXUXOZBLCXHRN-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC3CCN(CC2CC2)CC3)C=CC(=C4)Cl)C5,00412AB4D1932278_D398B167285EDD10_6034_UN,7.415472,00000000000000000000001000000000000000000000000000000000000000000100000000010000100101110000010010101101010100010001101011100100110000100110001011011000010110101111010,CACHITOEONTDCK-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)NCC3OCC2(CNC2)C3)C#N,678889099ED0160F_6834D3E6D14D91DB_6041_DP,7.4542904,00000000100100000000000000000000000000000110000000000000010000000010000000000000101100110011000111001000010101001000000011000000110111110110001010000011110111101111110,IYEJDRVQGARONF-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC3CCCC34CCNCC4,241424417445FFC3_75EC5C99EED3622F_6041_DP,7.4480615,00000000000000000000000000000000000000100000000000001000000000100110000000010101101100100011011010101000110010011000001011101100110101010110001011011111010110101111010,DHBDUGZFJZBXTP-UHFFFAOYSA-N
COC1=C(C=CC(=C1)C(F)(F)F)NC2C5C3CC6C4CC(C2C34)C56,F0C1BA4E3D3B6B91_D8EA2D1C2AD383F5_7022_UN,8.804252,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000000001010110000100011100001100000000000011110001110000000111000011100011101111110,RGRRCJXBGVAKII-UHFFFAOYSA-N
CN1CCOCC1COCC3COC2(CCOCC2)O3,4C8D6CFF07C2DE27_D9BE70E45A38A9FE_6039_UN,6.89668,00000000000000000000000000000000000000000000000000000000010000000000000010010000000101100100010110101000010001011001101011110010110010000110100001111010110111111101110,HVHGHJSYADWLPF-UHFFFAOYSA-N
C1CC(CCN1)C3=CC2=C(C=CC=C2)[N]3CC4(NCCNC4)C,754170B8F3EA16F2_D707AA7C75194EE9_6034_DP,8.039733,00000000000000000000000000000000000000000000000000000010000000100110000000010001101101100011000010101100110010011001101011100100110100000110001011011011010110101111010,IBLSWBLRDKPHOZ-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=NC=C3)N[C@H]4C6=C(OC5(C4)CCCC5)C=CC(=C6)F,0AC94899BE50F72B_EF4298106E6CBAE2_6041_DP,8.680143,00000000000000000000001001000000000000100010000000000000010000000110000000000100101101110001010011101100111110011100001011100100110111110110001011011001110011101111110,WDQRFZKTDRWKJN-JAQBAERBSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCCCN2C3CC3)F)CC4,F99A4A0BEA5362B4_0C1857E4C85CDF8B_6041_UN,7.733986,00000000000000000001001000000000000000000010000000000000000000100000000000010001101001110011010000101000000110010001101011100000110001110110001011011011010110101111010,ZFKGZBDOXFGPNE-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C(=O)C=N2)CC3(N)CCCC4=C3C=CC=C4,385317337160E28A_AD5FD08DF830F7BB_6034_UN,8.553368,00000000000000000000000000000000000000000000001000000000000000000110000000010001000011010011100100101100110100111100011011100101110001100100001111011011011110100111110,VSSITKRJJRIKOE-UHFFFAOYSA-N
C([C@]12C[C@H]1COC23CCC3)=CC4=C[N](N=C4C5=CC=CC(=C5)C)C6=CC=C(C=C6)F,9801151509FE0E9C_7BF76BFAD47FB4EC_7019_UN,8.054979,00000000000100000000001000000000000000000010000000001000010000100110000000010000100100010000001010110000010101001000001011101100110011110100001011011010110011101111110,GJEUQBSECCERNB-OFVILXPXSA-N
C3CC1=C(N=C[N]1CCC2CNC(C2)(C)C)C(N3)C4=CC=CC=C4,55465B2DEA92D27F_DE171BAAA852A506_6034_DP,7.7635174,00000000000000000000000000000000000000000000000000000000000000100110000000110101101101000011000010101100110010011001101011100100110100000110001011011101010110101111010,HTGAKZDUZRHDPI-UHFFFAOYSA-N
C[N]1N=C(N=C1NC2C3=C(SCC2)C=CC(=C3)F)C4CCOCC4,39736EF950E7638B_02ABD1ECF3848896_6041_UN,7.8914976,00000000000000000000000001000000000010100010000000001000010100100100000000010101110100111010011010100100111101010000001011101100110011110110001011011011010011101111110,VJHIHIXTVCPWAQ-UHFFFAOYSA-N
ClC1=CC=C(C=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]5N[C@H]4CCO[C@H]4C5,3D0308F3C7D7BD3C_25B81AFC561C2D33_6034_UN,8.519591,00000000000000000000000000000000000000100000000000000000010000100100000000010101001101010011000111001101110101010000001011100100110110100110001010011011110111100111110,JQNQWAGJYYRWAA-JYDALHQQSA-N
N(CCC1=CC2=C(C=C1)OCC2)[S](C4=C3C=C[NH]C3=CC=C4)(=O)=O,A66046965DA87B7F_F408E0BCD70A5428_6029_UN,8.70566,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100001000001010001110111001011100011011001100101110001110001011111001110111110111110,WOOSJRGDUFZLJB-UHFFFAOYSA-N
CN1CCN(CC1)CCC=CC2(CCCCN2)CC=C,A1C46917CA05CC61_1D7510FC5A42B821_7019_DP,7.3450804,00000000000000000000000000000000001000000000000000000000000000000010000000010001001001100011010000111000100000011001101011100000110000000110001001011001010110101101010,OSDLISOIVKJZHW-UHFFFAOYSA-N
CC3=NC1=C(C=CC2=C1CCCN2)N3CC4CCN(CC4)C5CNCCC5,14158B586646DE71_8321A97975C37431_6034_UN,7.716678,00000000000000000000000000000000000000100000000000000000000000100100000000010101101101100011000010101100110000010000101011100100110101010110001011011011010110101111010,HHCBSSWBMVTWCE-UHFFFAOYSA-N
C[N]1C=NC2=C1C=CC(=C2)NC3C4OCC5CC3CC45,E6C68C6074849167_76D1612CCDA599A9_6041_UN,8.321875,00000000000000000001000000000000000000000000000000000000010000000100000000010101100101000011010110000100010001000000000011100100110001010100001001001001110011101111110,BSHPGCBMAPFUOE-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)N[C@H]2[C@H](OCCC(C)C)CCCC2)F)F,A5FE1D4374CD1695_0C7A8638C7728DFB_7022_UN,8.118286,00000000000000000000000000000000000000000010000000000000000000000000000000100000000000010011000100000000100101010001101000000011110011110000010111010111110111101111110,ZCYRTAWBLQYXJV-GDBMZVCRSA-N
N(CC1C2CCC(C1)C=C2)C(C3=C(C)N=C(S3)C4=CC=C(C=C4)F)=O,9D251737D2F5343F_8F644B58F48C1610_6038_UN,8.252678,00000000000000000000000000000000000010000010000100000000000000100100000000000000111100011011100011011000010100100000011011000100110000100100001011010011011110101111110,XNSAFXNVWNAOTJ-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCCC2OCC(C)(C)C2)F)CC3,76C55D9820418062_F2EA44478C4755F0_6041_UN,7.7892895,00000000000000000001000000000000000000000010000000000000010000000010000000110001101101110001010011001000100111011001101011100000110011110110011010011111110111101111110,ZIUAZHBUNJGSBP-UHFFFAOYSA-N
CC1(C)[C@@H]3C[C@H]1C2(CC2)C4=NC6=C(C(=C34)C5=CC=C(C)C=C5)C=C(S6)Br,0D0BA881490C518B_FF403B51D53C7622_2201_UN,7.780248,00000000000100000000001000000000000010000000001100000000000000100110000000100000010100011000000010100100010110001000100011000100110000100100010011010100000010001111010,IXYNNAWIMGVJPX-HZPDHXFCSA-N
CC1=C(C=C(C(=C1)F)NCC23CC(C)(CO2)CCC3)F,6B7371B04CB769ED_D7C85E5DF4239975_6041_UN,7.522063,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100010011000110001000010111001001101000000000110011110110000011010111110111101111110,AUPVEPBAMGDHPS-UHFFFAOYSA-N
CC2=C1OCC[C@H](C1=C(C=C2)C)OCCN3C(C)COCC3,68109E2A66045F92_B651AFCD8533B28C_6039_UN,7.9919357,00000000000000000000000000000000000000000000000000000000010000000000000000010000000001100100000100101100010011010101101011100011110010000110010111111110110111111111110,CIAAHQYTAYSUFH-OEMAIJDKSA-N
CC1=CC=C(C=C1)C2=C[N](C(=N2)C3NCCCC3)C[C@@]45CCN(C)C[C@H]4CNC5,2364F71FAE70A927_A0F5B00A1E576920_6034_DP,7.9652557,00000000000000000000000000000000000000100000000000000000000000100110000000010101101101100011010010101100110010011001101011100100110100000110001011011111010110101111010,LQLXOLXGOIOIEJ-QQVDTZSYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)COC3=CC(=CC(=C3)F)F,D934D41ABAD4C029_714DC8C889AA9DD1_6038_UN,7.8866243,00000000000000000000000000000000000000000010000000000000000000000000000010000000001000010011100100011000110101110100011000000011110010100010000101010001111111110111110,DFIOZPZLHKZKHQ-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)COCC2)[S](C4=C3SC=CC3=CC=C4)(=O)=O,B2CF8E2D1426D2D3_7301630AED251B54_6029_UN,8.201862,00000000000000000000000000000000110010000000000000010001011111001001010001000000010100101001001010100110011001001000011010001100111011011110000011111001010011110111110,XCKHQNBWQHROFD-UHFFFAOYSA-N
C2(=N[N](C1CCCCO1)C3=C2C=CC=C3)NC4=C[N](C[Si](C)(C)C)N=C4,768FF57DF81FC7D7_8762D943637404B7_6041_UN,7.4195175,00000000000000000000100000001010000000100000000000001000010000100100000000110101100100100001111110101100010001111001011011101100111011010110011001011101010111101111110,AQWNKZIPPKNYIA-UHFFFAOYSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)CC4CCCN4C,FBF0B5B860491CB2_93F4D333AD137BD8_6034_UN,6.941563,00000000000000000000000000000000000000000000000000000000010000000100000000010001001101100001010110101100110011010001101011100100110010000110001001011011010111101111110,JQSRZNDDERHPEY-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)N[C@H]3[C@@H](C3)C4CCOCC4,14D8A70A305E3659_08F932655DA7E544_6041_UN,8.612448,00000000000000000000001000000000000000100010000000001000010000100100000000010101100100110011011010100000100101010000001011101100110011110110001011011011010011101111110,XCDGFTQVEJOGEX-DZGCQCFKSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CC3)C4=CC(=CC=C4)F,79EF5C447B289427_40EE95AF8E6DDD34_6041_UN,7.726164,00000000000000000000001000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100010001110110001011011011010110101111010,NZBIHNHZKUEHCI-SFHVURJKSA-N
O(C(=O)CNC1=CC=C(C=C1)Cl)CC2C3CCC(N2)C3,8A7D190507EB7C24_034D473ED6933D24_6031_UN,7.6458464,00000000000000000000000000000000000000000000000000000000000000000000000000000000001100010011000110101001110101010000001001010010110111110110001001010001011111110111110,CPZCLCBXXVUYPE-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCCC3N4CCOCC4,D810D184A1D58497_0CA7D774657C3B01_6041_UN,7.7406683,00000000000000000000000000000000000000100010000000000000010000100100000000010100101001110011000110101100010111010000001011100100110011110110001011011111010111101111110,VXNJYCHRJBDELP-UHFFFAOYSA-N
O(C(=O)CNC1=CC=C(C=C1)Br)CC2C3CCC(N2)C3,587A7364BB87F94D_DCAA3AF3C5237058_6031_UN,7.645827,00000000000000000000000000000000000000000000001000000000000000000000000000000000001100010011000110101000110101010000001001010010110111110110001001010001011111110111110,BITNSLCYUUCEOF-UHFFFAOYSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC3=C2CCCC2=CC4=C3CCC4,6DA858D7E702D214_1EC3BC7E2F82000C_6041_UN,7.6678524,00000000000000000000100000000010000000000000000000000000000000000000000000100000000000100011010010000100010000001001001000000100110001010000010011011111010110101111010,NKYQJQAJURYANL-UHFFFAOYSA-N
ClC1=C2C(=NC=C1)N(C=C2C3CC3)CC(CC)NCC4=C(C=CC=C4)Br,3FFB86159C30DC1A_7254A7BD460498BF_6034_UN,8.264194,00000000000000000000001000000000000000100000001000000000000000100100000000010101001101010000000010101101110110010010100011100100010000100110001011011011010110101111010,XVRIAXWBGSRURJ-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)Br)C)NCC2=NC=CN2CC3C4CCC(C3)CN4,B194CCB4A163872B_06D077684063F70F_6034_UN,8.005077,00000000000000000000000000000000000000100000001000000000000000000100000000010101101101010011000010101000110110010000001011100100110101110110001011011111010110101111010,LVUWPORRHVICHE-UHFFFAOYSA-N
FC2=C(C(=C1N(C=C(C(C1=C2)=O)C#N)C[C@H]3[C@@H](CNC3)C4=CC=CC=C4)F)F,3B25721113E90660_10013F9C97102BCF_6034_UN,7.770429,00000000000000000000000000000000000000000110000000000000000000100100000000010000101101110011000011101100010100000100000011100101110000100110001111001011111110100111110,NFGSHFOMTNWZKC-HOCLYGCPSA-N
CC1=C(C=C(C=C1)C2=N[N](C=C2C=CC3CC34CCC(F)(F)CC4)C5=CC=CC=C5)C,1634DE8C19036DBF_C76402E7726D0AB6_7019_UN,8.083023,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011110000010101111010,QCHKRQUUSXUPAN-UHFFFAOYSA-N
O=[N](=O)C2=C1NCCCC1=C(C=C2)C4=C3OC=CC3=CC(=C4)F,3B209B4CD5C60062_0533265F534E69D2_6004_UN,7.89374,00000000000000000000000010000000000000000010000001000000110000110000001100000001001100010011001011101110110100010000001111101100101001110100001011111001110010110111110,QMKOWPZVEAKGJT-UHFFFAOYSA-N
CN1CCC2=C1C=CC(=C2)NCC3CCN(C)C3C4=CC(=C(C=C4)Cl)F,A383F513DB6305E7_4557BA93D96DCCE1_7022_UN,7.6987543,00000000000000000000000000000000000000000010000000000000000000100000000000010000101101110011010010001101010110010001101011100100110001110110001011011111010110101111010,AASXAVKDKOWPMU-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C(C3=C(C=C(CC)C=C3)F)=O,48C1653ABAEEFB7E_2C41D8FDCEDA22D2_6038_UN,8.175229,00000000000000000001000000000000000000000010000000000000010000000000000000010001001101110001100110101000110100110010011011100000110010100110001011011011111111111111110,HZNLMSQRDHXTCK-UHFFFAOYSA-N
CCOC2CC(OCC1N(C)CCC1)C23CCOCC3,432C5E83D780BA8E_E73ABEE4CB9249B8_6039_UN,7.513702,00000000000100000000000000000000000000000000000000000000010000000010000000010000000101100100010110101000010011011011101011100011110010000110000100111110110111111101110,FNZSGCCDOHIFJB-UHFFFAOYSA-N
O(C3CCN(CC1CCCC2=C1C=CC=C2)CC3)CC4=CSC(=N4)C(C)(C)C,2D970E9EC4882E2C_CA2584F994EDA3A4_6039_UN,8.005106,00000000000000000000000000000000000010000000000100000000000000000110000000110000010101101000000111101100010001011000001011100111110010000110011111011100110111101111110,IDAZQQXUSCEJGL-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC[C]3(C[C]2(C[CH2]C2)C3)C4=NC=CC=C4)F,F78F851BB78F562D_D3A96EDFFC338F6C_7022_UN,7.9596343,00000000000100000000000000000000000000000010000000000000000000100110000000100000101001110010010000101000010100001001001001100100110001110110001011011111010110101111010,HIPPZVCUOXPFMM-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC(CC)C3CCOCC3,52C69EB249D42433_0C1145BB8875EAEE_7022_UN,8.305783,00000000000000000000000000000000000000000010000000001000010000000100000000010000101100110011001010101000000111010010101011101100110011110110001011011011010111101111110,FOGUDRPCGCSIAO-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=NC=C2)NCC3CCCN(C)C3C4=CC=CS4,40061E6866871ED0_67FE7BF557875164_6041_UN,8.455069,00000000000000000000000000000000000010100010000000000000000000100100000000010100111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,YPNFVEGQZLUCDD-UHFFFAOYSA-N
CC1(C)CCSC2=C1C=C(C=C2)N[C@H]3[C@H]4O[C@@H](C3)[C@@H]5C[C@H]45,EFFE06181E1D47B6_F838C52FE0E2C19D_6041_UN,8.439548,00000000000000000001001000000000000010000000000000000000010100000010000000100000010100001001000111100100110000011001101010000000110011010100000011010101110011101111110,PLYKSMPPAILLLD-KSRBRMDJSA-N
CC1=CC(=C(C=C1)OC2CCCC2)N[C@@H]3[C@@H](N(C)C)CCC3,662FA04AD8C6AC78_4415E0D3DAD9D219_7022_UN,7.710888,00000000000000000000000000000000000000000000000000000000000000000000000000100001000001100011010110000000100010010100101000100011010011010000011110011111100011101111110,VHGJPSBRLJGTLK-WMZOPIPTSA-N
CCC1=C(C(=CC=C1)F)NC[C@H]2[C@H](CCCC2)N3CCOCC3,2F6A36D5BC4131BE_B154B6A6F73CC3D3_6041_UN,7.543921,00000000000000000000000000000000000000000010000000000000010000100000000000010000101001110011000100101000000101010010001011100000110011110110001011011011010111101111110,MLRRGDIUHNBBLF-WMZOPIPTSA-N
C1NCC=C(C1)C3=CC2=C(N=CC=C2)N3CC4(CN(C)C)CCCCC4,BF2D44335F8F0D5F_F8C23BD2C865EB57_6034_UN,7.6436563,00000000000000000000000000000000000000100000000000100000000000100110000000111100101101100001010010111100110010011001001011100100110000000110001011011111010110101111010,KTSWEKOERYHXGX-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CCCC(CC)CC)C3=CCNCC3)F,04DD2DB3B095D883_98B912370E9B55E3_6034_UN,8.682491,00000000000000000000000000000000000000000010000000100000000000100100000000011000001101110001000010111100110110010010101011100100110000100110001011011111010110101111010,OMBITVBLSNYYNG-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC4CC(C3=CC=N[N]3C)OCC4,C3AC3DE8D2262442_AD91481F1827591C_6041_UN,7.9961042,00000000000000000000000000000000000000100010000000001000010000100100000000010100100100010010011111100100110111010000001011101100110011110100011011011111110011101111110,UNPZRPDOFVAWMB-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C(C)(C)C3=C(C=CC=C3)F)=O,AB34C32C00773A82_6A99EAF575AB1BBD_6038_UN,8.150304,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010001100010001000110110111000011000000000110010100100000011010111111111111111110,SEOXYOAWVKINHS-UHFFFAOYSA-N
NC1=CN(C2=C1C=C(C=C2)Br)C[C@H]3[C@@H](CNC3)C4CC4,4F388DF2B6BC5EAD_731E65DF76601401_6034_UN,8.876609,00000000000000000000001000000000000000000000001000000000000000100100000000010001101111110011000010001100010100000000000011100100110101110110001000011011010110100111010,MKPFMPCUWHHAOC-FZMZJTMJSA-N
CC1=C(C(=CC=C1)CC#N)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F,7AA784B1194E8A94_D57F5BCBFEE94B72_6041_DP,7.4080606,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100110010000001001000100110101110110001011010011010110101111010,KRYPCBDRKVJVPP-VQIMIIECSA-N
C(CC1NCCC1)=CC4=CC2=C([N](N=C2C)C3=CC=CC=C3)N=C4Cl,64E3034ACBA40F01_1EB969CB9AEEAB50_7019_UN,7.905433,00000000000000000000000000000000000000100000000000001000000000100100000000010101101100010011001010111101110100010000001011101100110001110100001011011011010110101111010,MSIZYDSBDDLNSE-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)OCC2)C(C4=CC3=C(C=C[N]3C)C=C4)=O,50F8CA24BFE43737_E1093B61590DA7EC_6038_UN,8.516538,00000000000000000000000000000000000000000000000000000000010000000100000000010000001101000000110010001100010001100100011011100100100010000110001011011001111111111111110,RWBOUNKHLCOWBL-UHFFFAOYSA-N
CC6(C)CCC1=C(C5=C(N1CC3CN(CC2=CC=CC=C2)CC34CCC4)C(=CC(=C5)F)F)C6,3332F9D36090F815_908991E06F835D2B_6034_UN,7.9011097,00000000000100000000000000000000000000000010000000000000000000000110000000110000100101110000000010001100010100011001101011100100110000100110001011011100010110101111010,ALOYKNPUVCPRSU-UHFFFAOYSA-N
CC(C)CC1=CC(=C(C=C1)NC2CN(C)C3(C2)CCOCC3)F,933903D92428D6EA_A4E04EC2F00E52A5_6041_UN,7.1396546,00000000000000000000000000000000000000000010000000000000010000000010000000110001100101110001010011101000110111011001101011100000110011110110011011011111010111101111110,ISISXRGGGLFPOZ-UHFFFAOYSA-N
[NH]1C=CC2=C1C=CC(=C2)NC3CCCC4=C3C=N[N]4C(C)(C)C,02874ACE77F5B03B_535C95B239FBDC1B_6041_DP,6.937107,00000000000000000000000000000000000000000000000000001000000000000110000000110000100100000011001010000100110010011000001011101100100101010100011011011101000010101111010,DQRZGEPQVCOOJA-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC4CCCN(CC3=CC=CS3)C4,A7DF07C32A2AAF41_C8FAE8D20498FA33_6041_UN,8.089228,00000000000000000000000000000000000010000010000000000000000000000100000000010001111101111011000010101100010110010000001011100100110001110110001011011011010110101111010,XPBNAVGOCGAJPM-UHFFFAOYSA-N
N(CC12CC(C1)CO2)C(=O)C3(CCOCC3)C4=C(C=C(C=C4)F)F,088670937A873B41_0A4E243829226D42_6038_UN,7.7895308,00000000000100000000000000000000000000000010000000000000010000100010000000000000001100110011100110101000010101101000011010000000110010100110000011110011111111110111110,PLRRUFFPVKHBSW-UHFFFAOYSA-N
FC2=C1C=NC=CC1=CC=C2NCC3CCCCN(C)C3,C248BB4158B97A4F_A23B77E3316705A4_6041_UN,8.103816,00000000000000000001000000000000000000000010000000000000000000000100000000010000101001110011010000101100010110010001101011100100110001110110001011011011010110101111010,GEPDOOKEAKBUQA-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)N[C@@H]3CCN(CC)[C@H]3C4=CC(=C(C(=C4)F)F)F,25E3051D25FE6E3A_D9C671728CD32598_6041_UN,8.709705,00000000000000000000001000000000000000000010000000001000000000100100000000010001100101110011011010001000100110010010101011101100110001110110001010011111010110101111010,WBPVXMDXIKEKFR-BEFAXECRSA-N
C(C2CC1(CC1)C2)=CC3=C([N](N=C3C)CC4=C(C=CC=C4Cl)Cl)C,96D8EAF704F141D6_98177521B3A2369B_7019_UN,8.356276,00000000000100000000001000000000000000000000000000001000000000000110000000010000100100010000001010011001010110011000100011101100110000100100001010011110010110101111010,JCHPQHRXHJYLCY-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CN=C2)NCC(N3CC(C)OC(C3)C)C4=C(C=CC=C4F)F,1CC43385F5521523_430EDC5F2FFBD329_6041_UN,8.504749,00000000000000000000000000000000000000000010000000000000010000000100000000010001101101110001010110101100010110010001000011100100110011110110011011001111110111101111110,JUSAPIDPKIQTRL-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC2=C([N](N=C2C)C)C3CNC3)C4OCCO4,8B33A46B56E04DF9_48037B1A91283993_6041_DP,7.688723,00000000100100000000000000000000000000000010000000001000010000100100000010010001101100110011011010001000000111000000001011111100000111110110001010011111010011111111110,XSIYWGWRGPRIHL-UHFFFAOYSA-N
CN(CC1CCNC1)CC2=NC=C(N=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,12482D8BF49BC2DF_B57D13DED0D26F9A_6041_DP,7.7630258,00000000000000000000000000000000000000100010000000000100000000100100000000000101101101110011010010101000100110010001001011100100110101110110001001011011010110101111010,KNTZLBJNPVJMGZ-BRPLTFKJSA-N
C2(=CC(=C1OCCC1=C2)CC#N)NC4=C3C=CC=NC3=C(C=C4)[N](=O)=O,274B99205197E7BD_C0C74D73BAD98F26_6041_UN,7.7305765,00000000000000000000000010000000000000000100000001000000110000010100001100000001100100000001001011100110010001010100001111101100101011010100001011111001110111110111110,GVAAWWZJFJINRH-UHFFFAOYSA-N
FC2=C(C(=C1N=CC(=C(C1=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C#N)F)F,623FE77916DBEDBF_EB488040F6FEB8FE_6041_DP,7.741098,00000000000000000000000000000000000000000110000000000100000000100100000000000000101000110011000000101100110100010000001011000100110101110110001011010011010110100111010,JUHGJULUIIUCEU-GOEBONIOSA-N
CN(CC1CCNCC1)C2=NC(=NC=C2)N[C@H]3[C@@H](C3)C4=C(C=C(C=C4)F)F,73C4230515539706_1A9946F7243BC625_6041_DP,8.272437,00000000000000000000001001000000000000100010000000000000000000100100000000000100101001110011010000101000101110010001001011100100110101110110001011011011010110101111010,YDKDWQQHAJCLRJ-FUHWJXTLSA-N
CC1=C(C=C(C(=C1)NC3CC(C2=CC=N[N]2C)OCC3)Cl)C4CC4,5FFF375911506FFB_2C2A7010A9CA977D_7022_UN,8.140333,00000000000000000000001000000000000000000000000000001000010000100100000000010000100100010010011111100001100111010000001011101100110011110100001011011111110011101111110,IQPYCECUTJXRRZ-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NC3C4CCC(CC3)CO4,F0A374A80702F4B9_FBA6A9CE54C6D747_6041_UN,8.058071,00000000000000000001000001000000000000000010000000000000010000000100000000010101000101010011010110100100111101010000001011100100110011110100001011011011110011101111110,QGFRPHMKFCHSBR-UHFFFAOYSA-N
FC1=C(C=CC=C1)CC2=NN=C(S2)NC[C@@H]3CNCC(O3)(C)C,1BBF37E409390D7A_9AB578E2A6FA7977_6041_DP,8.237196,00000000000000000000000000000000000010000010000100001100010000000110000000100101111100111011001110101000001110011001000011001100100111110110001011000111110111101111110,OGBOMRDEORRJND-LBPRGKRZSA-N
FC1=C(C=CC(=C1)NCC(N(C)C)C2=CC=C(C=C2)F)OC3CCOCC3,A1442834FFCA04B6_A8515C62881E929A_6041_UN,7.7443895,00000000000000000000000000000000000000000010000000000000010000000000000000100001001001110100010000101000000101010100101000100111110011110110001111011111110111111111110,PURGXKZXBJAWBJ-UHFFFAOYSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)CC5[C@@H]4C[C@@H](C4(C)C)CC5,CD9F4CB81768C94A_6CA5DCE764980C2D_6034_UN,7.4469633,00000000000100000000000000000000000000000000000000000000010000000110000000110000001101100001000110101100110011011000101011100100110010000110001001011101010111101111110,GRWYSORLGZOKRU-SFSSAEOISA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@H]3[C@@]4(C3)C5=C(OCC4)C=CC=C5,C00334832570050C_FB768FB7348A39A8_6041_UN,7.683271,00000000000000000000001000000000000000100010000000000000010000000110000000000100001000010011000000101100010111001100001011000100110011110110001011010111110111101111110,ZEDYIKHAJVTPIS-QMHKHESXSA-N
O[C@H](CCl)C1=CC(=CC=C1)NCCC3CCN(C2CCN(C)CC2)CC3,6316658F44B7373D_DC7CA090F8DEACDB_6041_UN,7.9074097,00000000000000000000000000000000000000000000000000000000000000100000000000010000101001100001010000101001100000010001101011100000110111110111001001011001110111101111110,ZFUQHYWDZAPGEF-OAQYLSRUSA-N
O[C@H](CF)C1=CC(=CC=C1)NCCC3CCN(C2CCN(C)CC2)CC3,C9CDFD68505F7998_78A1F4661152334C_6041_UN,7.9074097,00000000000000000000000000000000000000000010000000000000000000100000000000010000101001100001010000101000100000010001101011100000110111110111001001011001110111101111110,IEIBXRGLWTYOPP-OAQYLSRUSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CNCCN2C)F)CC3,3C7EBE8DA7D27A6F_23FC6EE878EB8B1A_6041_DP,7.325106,00000000000000000001000000000000000000000010000000000100000000000000000000010001101001110011010000101000100110010001101011100000110101110110001011011111010110101111010,ZOSKRWVFHFCNIQ-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C(=C2)C#N)CC3(F)CNCC34COC4,EA932E9E5834FBA0_D9AB3500A1228F15_6034_UN,8.061391,00000000100100000000000000000000000000000110001000000000010000000110000000010001101101110011000011001100010101001000000011100100110000100110001010001011010111100111110,VEIVJNYUJYVFQC-UHFFFAOYSA-N
ClC1=CC2=C(C=C1)N(C(=C2)C#N)CC3(F)CNCC34COC4,55E4B3480D927466_C11174F2F45D9096_6034_UN,8.061372,00000000100100000000000000000000000000000110000000000000010000000110000000010001101101110011000011001101010101001000000011100100110000100110001010001011010111100111110,WZLMROMWLGDARA-UHFFFAOYSA-N
O(CC2CCN(CC1=CC=CO1)CC2)CC3CNC(CO3)(C)C,7C1813DD247E94C4_9B95A80F734CFF0C_6039_DP,7.9004064,00000000000000000000000000000000000000000000000000000000010000000010000010110000001101100011000111101000100001011001101011100010110010000110001001111101110111111111110,VAPHSIOYLDZQEP-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CCCC23CCNCC3)F,FD6EE07A36DC0692_D33329979C87E560_6041_DP,7.3653994,00000000000000000000000000000000000000000010000000000000000000000010000000100000001001110011010010101000110100011001001001100000110101110110001011011111010110101111010,IVEZBYIOXVPUAV-UHFFFAOYSA-N
CCN3CCC1=C(C(=CC(=C1)NCC(OC)C2CCCOC2)F)C3,904C16C069CA6D1C_E34A7018439951F3_6041_UN,7.230288,00000000000000000000000000000000000000000010000000000000010000000000000000010000001001110101010100101100010111010010101011100010110011110110001011011101110111111111110,LBNJQWIAESURFE-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OCC2=CC(=NC=C2)F)C3,BDEA0B95ACBAC911_D22C381EFD2C229A_6039_UN,7.8054132,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010011101000010101000001001001100011110000100110001101011110110111101111110,HXNDFGKCBJYFJV-KNCOVGOOSA-N
CC1=C(C(=CC(=C1)F)F)NCC23COC(C)(C2)CCC3,04DF57EE4A1D9718_F6FBD746B1B4F43E_6041_UN,7.6067157,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100010011000011001000010111001001101000000000110011110110000011010111110111101111110,JVMOPLHEKSINTM-UHFFFAOYSA-N
N(C1=C2C(=CC=C1)COCC2)[S](C3=CC=CC4=C3[N](C)C=C4)(=O)=O,9FC94394DC69CF49_6EF00E11FF05C47E_6028_UN,8.377599,00000000000000000000000000000000110000000000000000010001011111001101010001010000110101101011011011100110011001001000011011101100111011011110001011111001010011111111110,DSFYWGUCZWJOMN-UHFFFAOYSA-N
CCC5CCC1=C(C4=C(N1CC2(CCNC2)C3=CC(=CC=C3)F)C=CC(=C4)C)C5,CBCAD8FC22EC783A_5E0C85B0C5A3971C_6034_UN,8.131947,00000000000000000000000000000000000000000010000000000000000000100110000000010000101101110011000010001100110110011010101011100100110000100110001011011101010110101111010,QENNJJRWYULZAW-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N=CC(=C2)NC3CN(C)C4(C3)CCOCC4,E3082A20214105EB_2F801E9B63902DB8_6041_UN,8.177863,00000000000000000000000000000000000000000010000000000000010000000110000000010001100101110001010011101100110111011001101011100100110011110110001001011001010011101111110,VEXKFWVQNPPSSP-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NC2=CC3=C(N=C2)CCCC3,E2CF31D1BDA0EB8C_6D4E2FDF029194A1_6041_UN,7.994629,00000000000000000100100000000010000000000000000000000000000000000100000000100001000000100001010000100100010000011000001011000100110001010100011011011111000010101111010,DZSKJWQJGAHXQE-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3(F)CNCC34CCC4)Cl,7C28F5B2AE7D0FC2_BC400CA4F2FF7701_6034_UN,7.653249,00000000000100000000000000000000000010000010000100000000000000000110000000010110111101111011000010001001011100001000001111100100110101110110001010011011010110101111010,HHVOAANQKPPKOI-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CCCC(C)(C)C3)Cl,4FC96E8CE2D78BB0_975AB7F184A96668_6034_UN,8.322,00000000000000000000000000000000000010000000000100000000000000000110000000110110010101011011000010001001001110001001101111100100110001110100011011011111010110101111010,BRNCQLNJIPUOHY-UHFFFAOYSA-N
C[N]1C=CC2=C1C(=CC=C2)NC35CC(OC34CCNCC4)(C)C5,F18BB069A47B611C_1B1EC2823C01A27F_7022_DP,7.328094,00000000000100000000000000000000000000000000000000000000010000000110000000010001001101100011010111101100110010011001001011100100110111010110001001011101110011101111110,NKTFWPWSGABLKL-UHFFFAOYSA-N
N3CCC(C)(COCC1CC2(CO1)CCOCC2)CC3,87FA15682308A4D1_A2B67D09DDF884F3_6039_DP,7.7545567,00000000000000000000000000000000000000000000000000000000010000000010000010000000001100100001000010101000110011011001101011000010110010000110000001110001110101111101110,UTSARTDHGVNXQN-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NCC3(CCSC3)N4CCOCC4,6B59F937A4C8B76C_46006F74D9455753_6041_UN,8.103789,00000000000000000000000001000000000010000010000000000000010000100110000000010101001101111011010110101100011111011000001011100100110011110110001011011011010111101111110,QTCXHNCDADYORG-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(C5=C(C)N=C4C=C(C=CC4=C5)F)=O,0A0070DDBBD3BC01_BCB195AB8252F21D_6038_UN,8.49861,00000000000000000001001000000000000000000010000000000000000000000100000000000000101000010011100011101100010100100000010001000100110000100100001011000011011110101111110,DBYPKFDBNIEHKN-UHFFFAOYSA-N
CCN1C(CC2=C1C=C(C=C2)F)C3=NC=C[N]3CCC4CNC(C4)(C)C,47165932586726A4_682AF6490BCF70AF_6034_DP,8.692303,00000000000000000000000000000000000000100010000000000000000000100110000000110101001101010011000010001100110110011011101011100100110000110110011010011111010110101111010,OTUIAHDJFDFGFW-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=C1)NC2=CC=CC3=C2CNCC3,9A372BA49FF72563_816C0862B13070FC_6041_DP,7.414867,00000000000000000000100000000010000000000000000000000100000000000000000000100000101000100011010000101100110000011000001001000100110101010110011011011111010010101111010,GJSXPMJVLUTNQP-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCN(CC2)C3COC3)F)CC4,D926BF7056A8B054_A08588AB9B15BD83_6041_UN,7.4929624,00000000100100000001000000000000000000000010000000000000010000100000000000010001100001110010010100101000100111010001101011100000110001110110001011011011010111101111110,WHOYMRYWUIRKLW-UHFFFAOYSA-N
CC1=NC5=C(C(=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)C=CC=C5F,957D320BABB7C5C0_824D74C5F1634A6E_6041_UN,7.802726,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011111010110101111010,TYFHWLCVVKJUKQ-MWTRTKDXSA-N
CC1=C(N(C(=N1)C2CCNCC2)C[C@H]3C[C@H](F)CN3CC4=CC=CC=C4)C,1ED10EC3E724E053_853DC4C93BB80C84_6034_UN,8.418275,00000000000000000000000000000000000000100010000000000000000000100100000000010101001101110001000010101000100110010000101011100100110000100110001011011111010110101111010,AETOXJTUDLRJRE-LEWJYISDSA-N
O[C@@H](CF)C1=CC(=CC=C1)NC23CC(C)(C2)OC34CCC4,4DA7162C0DA22F00_AE8CEB1D3D91004F_6041_UN,8.16177,00000000000100000000000000000000000000000010000000000000010000000010000000000000000100000011000111000000110010011001001000000000110111110101000000010001110111111111110,UEHVBOZQLNAEDO-FHERZECASA-N
CN5CCCN(CC1=C(C=C(C=C1)NC3CCCC24OCCC2CC34)F)CC5,1661928F389E18B6_A74E21DAF7CF0D12_6041_UN,7.370201,00000000000100000001000000000000000000000010000000000000010000000010000000010001100101110011010011001100110111011001101011100000110011110110001011011011110111101111110,YLTMRPCFVHGMFX-UHFFFAOYSA-N
N(C1C2CCC(CC1)CO2)C(C3=C(CC)[N](N=C3)C4=CC=C(C=C4)F)=O,446A5FE9DD7A43CF_3FCBCC3AC72EB7AF_6038_UN,8.057038,00000000000000000001000000000000000000000010000000001000010000100100000000010000100100010011101111100000110101110010011011101100110011110100001011011011111111111111110,PGKRBGMUULXUPO-UHFFFAOYSA-N
BrC1=CC(=CC=C1)N2C=CN(C2=O)C[C@H]4[C@H]3CNC[C@H]3OC4,17E2592C96D9665F_2D13A1A580182959_6034_UN,8.455947,00000000000000000000000000000000000001000000001000000000010000100100000000010101001101110001000111001100011101100100010011100101110011110110001110001011111111110111110,PVWCBLSCSRXQIJ-KCPJHIHWSA-N
ClC1=CC(=CC=C1)N2C=CN(C2=O)C[C@H]4[C@H]3CNC[C@H]3OC4,6C8A5DFD8FD8096D_7A89B363DAE15946_6034_UN,8.455922,00000000000000000000000000000000000001000000000000000000010000100100000000010101001101110001000111001101011101100100010011100101110011110110001110001011111111110111110,WCDPLVHHHZROFH-KCPJHIHWSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2C[C@@H]3[C@H](C)CCCN3,F16408216D767876_0F3E1585008D440A_6034_UN,8.7241,00000000000000000000000000000000000000000000001000000000000000000100000000010001001101010011000010101100110110010001101011100100110000100110011011011111010110101111010,SVOIGKPSOPCXQF-BDJLRTHQSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCCCC3)C4=C(C(=CC=C4)F)F,94368BB8E80DA50E_754F26D60AF8DCBC_6041_UN,8.000944,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100110001110100001011011011000010101111010,JBKCUVCZUDNKGV-UHFFFAOYSA-N
C(C1CCNCC1)C2=CN(C=N2)CC4(CC3=CC(=CC=C3)Br)CC4,1240D5F82875547B_CE4B8DA5892DE60C_6034_UN,8.025426,00000000000000000000001000000000000000000000001000000000000000000110000000010101001101110001000010101000100100011000001011100100110000100110001001011001010110100111010,RXHQAFDYKAFIMQ-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC3CC2(CCCC2)OC4=C3C=CC=C4,E278329D03BD0F78_12BD7AAF83EC4AF4_6041_UN,7.591066,00000000000000000000100000000010000000000000000000000000010000000110000000100001000000100001010011100100110000011100001011000100110011010100011011011111100011101111110,YSTPLNVXFLQWIV-UHFFFAOYSA-N
N(CCC1C3CC2CC(CC1C2)C3)C(C4=C[N](C)C5=C4C=C(C=C5)F)=O,5F6035D536431B48_425B9396E63AF764_6038_UN,7.760209,00000000000000000000000000000000000000000010000000000000000000000100000000010000101101010000110011001100110100110000011001100100110000100100001001011001011110101111110,CGCRFJRAEFWMLJ-UHFFFAOYSA-N
C2(=C1OCCCC(C1=CC=C2)=O)NC3=C(CSC)C=CC=C3,E04B662F2C21D220_970A8DCC7ECC142C_6041_UN,8.859296,00000000000000000001000000000000000000000000000000000000010000000000000000000000000000101111010100000100010001000101001000000101000011010110000111010011111111111111110,DSSDXLWVHBZLJD-UHFFFAOYSA-N
C1CC(CCN1)C2=CN(C3=C2C=CC=N3)CC(C)(N)CC4=C(C=CC=C4)F,1F786D1AC9D1D11B_4C93D1804BEC206D_6034_UN,7.3346643,00000000000000000000000000000000000000100010000000000000000000100110000000010101001111110001000010101100110100011001001011100100110100100110001011011011010110101111010,NROCKLYUSXLFOL-UHFFFAOYSA-N
N(CC1CN2CCC1CC2)C(=O)[C@@H]3C[C@H]3C4=CC(=C(C=C4)Cl)Cl,2E213EEEBB42A534_2443E579F96C1617_6038_UN,6.976414,00000000000000000000001000000000000000000000000000000000000000100000000000000000101001110011100000101001010100110000011001100000110000100110001011011011011110100111110,WQGBPBKQNUQKRU-NOYMGPGASA-N
N(CC1CN2CCC1CC2)C(=O)[C@@H]3C[C@H]3C4=CC(=C(C=C4)F)F,C1C6AE0B505439D3_85DF953960FAC25A_6038_UN,6.976412,00000000000000000000001000000000000000000010000000000000000000100000000000000000101001110011100000101000010100110000011001100000110000100110001011011011011110100111110,FVGXTBLQAUWEHX-NOYMGPGASA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@@H]2CC[C@H](CC2)N3CCOCC3)F)CC4,4458178251A3859B_0C7A598F8B68D2D0_6041_UN,7.19118,00000000000000000001000000000000000000000010000000000000010000100000000000010001100001110010010100101000100111010001101011100000110011110110001011011011010111101111110,PXDGPISDVGOANI-AQYVVDRMSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)C4(CC4)C5=CC(=C(C=C5)F)Cl,0B17D58B397D80A5_5DC3BCE52A9CF85D_6038_UN,7.1513624,00000000000100000000001000000000000000000010000000000000000000100010000000000000001000010011100010001001010100101000011000000000110000100000000011010011011110100111110,LIYASMGGNMVJGR-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)C4(CC4)C5=CC(=C(C=C5)Br)Cl,DDB5DCD00F7344FF_D9F448D21577E5BE_6038_UN,7.1513543,00000000000100000000001000000000000000000000001000000000000000100010000000000000001000010011100010001001010100101000011000000000110000100000000011010011011110100111110,SOHUJNQMNAPWCG-UHFFFAOYSA-N
CCOC(OCC)C2=NC1=C(N=CC(=C1)Br)N2C[C@H]3[C@@H](CCNC3)C4=CC=C(C=C4)F,282708426333D88F_CD4954B660B935AA_6034_UN,8.275175,00000000000000000000000000000000000000100010001000000000000000100100000000010101101101110011000110101100110101010010001011110110110000100110001011011111010111111111110,GTNSHMWXHBDMOH-LPHOPBHVSA-N
CC1=C(C=C(C(=C1)NC(CC2CCCC2)CC3CCCC3)F)[N]4C=CC=C4,AC32B9EC1A4F4052_6DFAEFAEE99229B3_6041_UN,7.5474806,00000000000000000000000000000000000000000010000000000000000000100100000000010000000101010001000010000000100100010000001001100100110001110100001010011011000110101111010,LROGQLIFGSQOGX-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)CCOC2)[S](C4=CC3=C(C=C[N]3C)C=C4)(=O)=O,53B84851B780049D_EE064785D96F7918_6029_UN,8.605607,00000000000000000000000000000000110000000000000000010001011111001101010001010000011101101000011010101110011001001000011011101100111010001110001011111001010111111111110,OGPUTCXUIXHYBR-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=C([N]2C[C@@H]3NC(OC3)(C)C)C4CCNCC4)F,E4A2B321EA0B27D2_DE2AE8AAF7BA45AD_6034_DP,8.516331,00000000000000000000000000000000000000100010000000000000010000100100000000110101001101110011100111101000100111111000111011100100110100100110001011011111110111101111110,ZLCVSKMOBVJAJV-HNNXBMFYSA-N
N(CCC1=C[NH]C2=C1C=C(C=C2)F)C(C34CCC(C)(C3)CO4)=O,5B1B0E56CBC27A6B_937359D6E1C4A9EC_6038_UN,8.3197,00000000000000000000000000000000000000000010000000000000010000000110000010000000001100010011100110101100110111111001111011000100110110100110001001010001111111111111110,XQXDYJWEDGHRRX-UHFFFAOYSA-N
C1(=CC2=C(N=C1)C(=CC=C2)F)NCC3N(C)CC(CC3)(C)C,E9706FC8E9C047D0_33A8189B90B97497_7022_UN,7.9708147,00000000000000000000000000000000000000000010000000000000000000000110000000110001001001110011010000101100010110011001101011100100110001110110011001011111010110101111010,UAVURQUANAPVQX-UHFFFAOYSA-N
N3C[C@@H](OC1=C(C(=CC=C1C#N)F)F)[C@H](CC2=CC=CC=C2)C3,4819B28CE41D9C85_2B6209A879A141CB_6003_DP,7.7792497,00000000000000000000000000000000000000000110000000000000000000000000000000000000001100110011000111001000000100000100000001000111110010100110001111000011110101100111110,KDBJYMQBGRTDOE-GDBMZVCRSA-N
C[N]1N=C(N=C1NCC2(CCCC2)C3=CC=C(C=C3)F)C4CCOCC4,466DD818AFC0F778_3AA9F34D1BBA3F76_6041_UN,7.952245,00000000000000000000000001000000000000100010000000001000010000100110000000010101101100110011011010101000001111001000001011101100110011110110001011011011010111101111110,ZGGVZFBMABWRIR-UHFFFAOYSA-N
CN4CCC1=C(C3=C([N]1C[C@@H]2CNCC(O2)(C)C)C=CC(=C3)Cl)C4,A1673B820FA2B2AD_0EEEF30000FF1FCE_6034_DP,7.731151,00000000000000000000000000000000000000000000000000000000010000000110000000110000101101110010010110101101010110011001101011100100110010100110011011011101110111101111110,GGRCIQAQUHFJPM-AWEZNQCLSA-N
CC1=CC(=C(C=C1)F)N[C@H]2[C@@H](OCC2)C3=C[N](N=C3)CC4CC4,18FFAC0317E34E35_8D24EE15BB4671D3_7022_UN,8.74124,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011001111001000100101010000001011101100010011110110001010011011110111101111110,FTOWLYSWURVROE-AEFFLSMTSA-N
FC1=CC(=C(C=C1)NC[C@@H]2CCCN(C)[C@H]2C3=C[N](N=C3)C)C4CC4,AF5254F936326924_8E2220143F8D00CD_6041_UN,8.495397,00000000000000000000001000000000000000000010000000001000000000100100000000010000101101110011011010101000000110010001101011101100110001110110001011011111010110101111010,WKPRWWFUTCKOLP-MGPUTAFESA-N
CN(C)C4CCN(CC1=CC=C(C=C1)NCC2CCN(C2)C3=CC(=C(C=C3)F)F)C4,C354A5AE2240CF6B_002A30B8789B4A8B_6041_UN,8.015543,00000000000000000000000000000000000000000010000000000000000000100000000000110001101101110011010010001000000110010000101011100100110001110110001011011111010110101111010,UOGKDAFDRJUMCY-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2=NC3=C(C=C2)CCCC3,91C746B7728040DF_9CE4C6E3AFE50F9A_6041_UN,7.6171184,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100000010000101100010000011000001011000100110001010100011011011111010110101111010,MUBPALBPROCETI-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NCC3(C)CCOC2(CCC2)C3)C4CC4,D772254534DDBFCB_B32595F9B2728611_6041_UN,7.692991,00000000000100000000001000000000000000000010000000000000010000100010000000000000001000010011000000101000010111001001101000000000110011110110000011010011110111101111110,XJBYOBCZILURPK-UHFFFAOYSA-N
FC2=C(C=C1C=C(N=CC1=C2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4)F,71D2D0EE82DE5BBD_44CD230733C116B1_6041_UN,8.382442,00000000000000000000000000000000000000100010000000000000010000100100000000010100101001110001010100101100010111010001101011100100110011110110001011011011110111101111110,PUIIDPFABUSQDK-FPOVZHCZSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4=CC(=C(C(=C4)F)N5CCCCC5)F,804044588B50DEB7_494FFFFC16EEB494_6041_DP,8.07836,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101110001010010101000010110010000001011100100110101110110001011011011010010101111010,JXIDNQDPBIQOEN-DBIVSCPCSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC34CC(CC)(C3)CO4,7FA22606A77E439E_4D041DADCF628084_6041_UN,7.9287634,00000000000100000000000000000000000000100000000000001000010000100110000000010101101100000011011110001000010011001010100011101100110011010110011010001111110111101111110,RQURWHMSNTUMJS-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C2CC2)NC4CC(C3=NC=C[N]3C)OCC4,9301B5245AEBA03B_AED0097ECE35F812_6041_UN,8.001053,00000000000000000000001000000000000000100010000000000000010000100100000000010101000101010011010111100000100111010000001011100100110011110100001011011011110011101111110,QMRRDRXYDWILQH-UHFFFAOYSA-N
C1(=CC3=C(C=C1)C2CC(C2)C3=O)N[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)F)F,2FBFB427B9328CE5_DD3D25F3504698F1_6041_UN,7.6902947,00000000000100000000000000000000000000000010000000000000010000100000000000000000000100010011000111000100110101010000001000000101000011110100000111010011111011110111110,DSDZFZRZDTUEEO-SYFATEFMSA-N
C1(=CC(=C(Cl)S1)Cl)NCC3=C(CN(C)C2CCCCC2)C=CC=C3,865CB44AF0B13B10_94F8E8843B5304C9_7022_UN,7.943885,00000000000000000000000000000000000010000000000100000000000000000000000000000000011101111001010010001001000110010001101000100100110001110110001011011011010110101111010,BMEMRIPSOCEDTL-UHFFFAOYSA-N
C2(=C1OC=CC1=CC(=C2)F)NCC3CCC(CN3)(C)C,BFB17EFDA01EC332_2259D0B256BE0908_7022_DP,7.799917,00000000000000000000000000000000000000000010000000000010010000000010000000100001001100010011000110101100110100011001101011000100110101110110001001010101110110101111110,TVKVXDAINGAFJO-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC4CC3(CNC3)C4,9E9E2F8B41D89346_69127507DE53D669_6041_DP,7.4856687,00000000100100000000000000000000000000100000000000001000000000100110000000010101101100100010011010001000010010001000000011101100100101010110001010001111010110101111010,UCSBAFUOEQNRJO-UHFFFAOYSA-N
CC4=CC1=C(C=CC(=C1)NC2CCN(C)C23CCCNC3)[NH]4,1B3D84AD6ADE2661_5C4A4ABAF323175E_6041_DP,7.7561674,00000000000000000000000000000000000000000000000000000100000000000110000000010001101101100011010010101100110010011001101011100100110101010110001001011101010010101111010,LNXXWHLUPZDSST-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(=O)CC3=C[NH]C4=C3C=CC(=C4)F,0BF05789386E2026_18EE9F3E35DE1DE3_6038_UN,7.878772,00000000000000000000000000000000000000000010000000000000000000000100000000000000001100010011100010001100110100110000011001000100110110100100001001010001011110100111110,UYQSKUXBHJNHSL-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)[N](=O)=O)NC2=CC4=C(C=C2)OC3(CCC3)C=C4)F,3DCBF416881D01A4_8251D22E3721FA20_6041_UN,7.970106,00000000000100000000000010000000000000000010000001000000110000010010001100000001000000010000001001110110010100001100001100101100001011110100001011111011100011111111110,LYJXHMJBPNPKBI-UHFFFAOYSA-N
CC[C@H](OCC3CC1(CC2(C1)OCCO2)CO3)C4=CC(=C(C=C4)C)F,A409FFBCD6AF9B9A_2A4B67207775E9C4_6039_UN,7.6141295,00000000000100000000000000000000000000000010000000000000010000000010000010000000000100010000000010000000010111001010001010010010110010100110100010110110110101011011110,HGPYMCLMWFMROR-DAFXYXGESA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NC4CCOC(C3=CN=C[N]3C)C4,47A78607155139E0_F38B249AF4EB79FA_6041_UN,7.7847443,00000000000000000000000000000000000000000010000000000000010000100100000000010101100101010010010111100100110111010000001011100100110011110100001011011111110011101111110,FJKMIEKVDNJPIW-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NC3=CC(=C(C(=C3)F)N4CCOCC4)F,27A56C28F35619E4_A17226AA599A569F_6041_UN,7.896213,00000000000000000000000000000000000000100010000000000000010000100100000000010100100101110001010110101000000111010001101011100100110011110110001011011011010011101111110,SJXZIFBMCPYSQQ-SFHVURJKSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=N3)NC4C(C)OC5=C4C=CC(=C5)F,596DFBBB2D3D5D18_5958907293D52F88_6041_DP,8.065181,00000000000000000001000001000000000000000010000000000000010000000100000000000100100101010011010111100100111100010100101011100100110101110100001011011111100011101111110,XVFBHFZWTYLIBF-PFUKXCGUSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC4CCCN(CC3CC3)C4,7CF008798A4BCC81_F0CFD2605EDA1FF7_6041_UN,7.6252427,00000000000000000000001000000000000000100000000000000000000000000100000000010100101001100011000000101100010010010000001011100100110001010110011011011111010110101111010,FHXSIWRPNCANSU-UHFFFAOYSA-N
N4CCC1=C(C=CC=C1NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)C4,7515E799AB72F9A5_31D3F598E2BDA2E0_6041_DP,7.5271683,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101100011011110101100110011010001101011101100110111010110001011011111110111101111110,XWQOQGAZJIFOBQ-OALUTQOASA-N
N(C1CC2CCC(C1)S2)C(=O)CC3=C[NH]C4=C3C=C(C=C4)F,3EAC3250A46311C1_8F6B68EC12419BB7_6038_UN,7.623784,00000000000000000001000000000000000010000010000000000000000000000100000000000000010100011011100010100100110100110000011011000100110111100100001001010001001110100111110,FPKWXVWLICYJGY-UHFFFAOYSA-N
N(C1C3C2CC(CC(C1)C2)C3)C(=O)CC4=C[NH]C5=C4C=C(C=C5)F,458210000D7024A9_788CA632AE0E9BAA_6038_UN,7.8756967,00000000000000000001000000000000000000000010000000000000000000000100000000000000000100010011100010000100110100110000010001000100110111100100001001000001001110100111110,IBLMTIHCWAVVNU-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NC(CC)C3CCOCC3,3C07B0298442373A_7D3D06655E8528CE_6041_UN,7.494483,00000000000000000000000000000000000000000010000000000000010000000000000000000000000000110011000010100100110111010010001000000000110011110110000011010001010111101111110,AXCVVZPJPPWBSK-UHFFFAOYSA-N
CC1=CC(=C(C=C1)NCC2N(C)CC3(CC2)CCC3)Cl,3F9DC491BC004F31_5023015DF1F12737_7022_UN,7.642993,00000000000100000000000000000000000000000000000000000000000000000010000000010001001001110011010000101001010110011001101001100000110001110110001011011111010110101111010,UZAJKMIZDCNLPH-UHFFFAOYSA-N
CC1=CC(=C(C=C1)NCC2N(C)CC3(CC2)CCC3)F,55F30B43CAC73A3A_238AF94BEA907FB5_7022_UN,7.6429935,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011111010110101111010,MMGUUUUJAPKWPY-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC(CC)C3CCCCO3,9720AD8F8B205A71_7DD6A85DDE673868_6041_UN,7.661989,00000000000000000000000000000000000000100010000000000000010000000100000000000100000000010011000100100100110111010010001011000100110011110100011011010111110111101111110,VRZOQGKHHBNWAC-UHFFFAOYSA-N
CC1=C(C(=NO1)C2=CC=C(C=C2)F)NC[C@@H]3CNC[C@H]3C4=CN=C[N]4C,9CFA952E79524B46_1C5B0200810C939D_6041_DP,8.035938,00000000000000000000000000000000000000000010000000000100010000100100000100010101101101110011011111001010000110000000000011101100110101110110001010001111110110101111110,AZISSLWQABFQRW-GOEBONIOSA-N
CC1=C(C(=C(C=C1)NCC2(CCCC(C)(C)C2)C)F)F,4B3AEDECB6B28390_3B8ACAFF8BBE0F63_7022_UN,8.454362,00000000000000000000000000000000000000000010000000000000000000000010000000100000001000010011000000001000000110001001101000000000110001110000010011010111010110101111010,OIIRJTLBDWYLPX-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC3C(CCC3)C4CC4,61BBBD9EF5D8AE38_358FBF4E4BDC32D9_6041_UN,8.397793,00000000000000000000001000000000000000000010000000000000000000100100000000000000101000010011000010101100010100000000001001000100110001110100001011010011010110101111010,QKXAQPOCUIBOGC-UHFFFAOYSA-N
C(C2=NC1=C(C=CC=C1)[N]2C35CC4CC(CC(C3)C4)C5)=CC6=C[N](C)N=C6C7=C(C=C(C=C7)F)F,B37922611225EA22_49058C6041217027_7019_UN,7.9597855,00000000000000000000000000000000000000100010000000001000000000100110000000010101100101010000011010010100010100011000000011101100100001100100001011001010000010101111010,LIQQHKDPSNTAOR-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)NC2C(C)(C2)C3=C(C=CC(=C3)F)F)C4[C@@H]5CNC[C@H]45,D2630D7E1D5D8E82_82BAD98F895B1061_6041_DP,7.987918,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011001100011100100110101110110001011001111010110101111010,LEGNMMFLNSESCQ-QYCBYKEFSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(C)C(OCC3)C4CC4,A342BF27451F4C01_D114871702E4D008_6041_UN,8.02519,00000000000000000000001000000000000000000010000000001000010000100110000000010000101100010011011011001100010111001001101011101100110011110110001000011111110111101111110,DRZWWPKJKAGURI-UHFFFAOYSA-N
CC1=CN(C2=C1C=CC(=C2)F)C[C@@H]3CNC[C@H]3C4=C[N](C(C)C)N=C4,A2B6087FE64CD9D2_6B2D47B7163EFC31_6034_UN,8.412213,00000000000000000000000000000000000000000010000000001000000000100100000000110000101101110011001010001100010110000000000011101100110000100110011000001111010110101111010,URKUDNNHIJSDAO-HNAYVOBHSA-N
CC1=CN(C2=C1C=CC(=C2)Cl)C[C@@H]3CNC[C@H]3C4=C[N](C(C)C)N=C4,80CA16EF8785939A_E76F180D53587762_6034_UN,8.4122095,00000000000000000000000000000000000000000000000000001000000000100100000000110000101101110011001010001101010110000000000011101100110000100110011000001111010110101111010,HNBIQSWKSSIFLS-HNAYVOBHSA-N
CC1=C(N(C(=N1)C2NCCC2)C[C@@H]4CN(CC3=CC=CC=C3)C[C@H]4F)C,D72C22B26BBED7C0_4F7C94E0005EFF33_6034_UN,8.345284,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010001000100110010000101011100100110000100110001010011111010110101111010,BYGILCAFQMULEU-ABZYKWASSA-N
CN(C)CC1=CN=C(C=C1)NCC2(CCNCC2)C3=C(C=NC=C3)F,60467528B44E3C56_DE38BF9FABA23398_6041_DP,7.907029,00000000000000000000000000000000000000100010000000000000000000100110000000100100101001110011010000101000100100011001001011100100110101110110001011011111010110101111010,KLDAEYFYIILSAL-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=N1)Br)N2CC3CCCN3CC4CCCN4,051DDCBDB270E28B_3421C0821DE831CC_6034_UN,8.28642,00000000000000000000000000000000000000000000001000000000000000000100000000010001101101110011000010101100110100010000101011100100110000100110001010011011010110101111010,BBMAOGDPMCYIAO-UHFFFAOYSA-N
CCC1=C(C(=CC=C1)F)N[C@H]2[C@@H](OCC2)C3=CC=N[N]3CC4CC4,97D39F98627322BF_621308CFE911D053_6041_UN,7.8347993,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011001111001000100101010010001011101100010011110110001010011011110111101111110,UUGFUXGSXAFGGR-VQIMIIECSA-N
FC1=C(C=C(C(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N)F,340858D1A0C9E845_A0DF4C4BF614BF6F_6041_DP,7.7093616,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110100111010,CJBHCCXZAULNJF-GOEBONIOSA-N
CN1[C@H]4CC[C@@H]1C[C@H](OC2=C(C=CC=C2)CNC3=CC(=C(C=C3)F)Cl)C4,1AB2BC613AF7B23E_27E327698C2EAAB9_6035_UN,7.779295,00000000000000000001000000000000000000000010000000000000000000000000000000010000001101010000010011101001010110010100101001100111110011110100001111011011110111101111110,GQDACNHWFUSNBC-PIIMJCKOSA-N
CCC1=NC(=C[N]1CC2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,D7E4ACA77FD1CD41_A4DE22E1C5D78829_6041_UN,8.280582,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101110011010010001000100110010011101011100100010001110110001010011111010110101111010,DAXUBLAKOCUHLD-XLIONFOSSA-N
C1(=CC2=C(C=C1)[NH]C3=C2CCCCCC3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,916E1D9C062F529F_3C1F946DF32CEA37_6041_UN,7.99621,00000000000000000000000000000000000000000010000000000000000000100100000000010001100101110011010010001100110110010001101011100100110101110100001011011011010010101111010,KALSKNFBHZSPMM-RPBOFIJWSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC4=CC=C(CN3CC(C)OC(C3)C)C=C4,B629DA0CF17E1555_DCE9D7AC2CBB32B9_6041_UN,8.3508,00000000000000000000000000000000000000000010000000000000010000000100000000010001001001110000000100101100010110000001000011100100100011110110011011001111110111101111110,DEMKFPNOCCMYOU-UHFFFAOYSA-N
BrC1=CC2=C(N=C1)N(C=C2CC3=CC=CC=C3)C[C@]45CNC[C@H]4CN(C)CC5,44AE99303BC6DD98_01E36FF875E748C4_6034_UN,7.741871,00000000000000000000000000000000000000100000001000000000000000000110000000010100101101110011010010101100010110011001101011100100110000100110001001011001010110101111010,BQEZYGYYFXTEJM-CVDCTZTESA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[CH]4C[C]3(C[C](C)(C3)C)C4,97725F3C0BA61D3D_EFF584F0247327A2_6041_UN,7.7973986,00000000000100000000000000000000000000000010000000000000000000000110000000100001001000010010000000101100010110001001000001000100100001110100011011000111010110101111010,JVUGWAWDJVOOCJ-UHFFFAOYSA-N
CC1=C[N](N=C1)CC2=C(C=C(C=C2)NCC3C[Si](C)(CC3)C)F,82A3327EECBFC18C_79D3774C3AD3FEBB_6041_UN,8.189174,00000000000000000000100000000010000000000010000000001000000000000100000000110000101100110011011010001000000110011001101011101100110001110110011010011111010110101111010,IXPCCCJIAGZRBU-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=NC=C2)NC4CC(C3=NC=C[N]3C)OCC4,D8101C97D261A464_2BD6DB6426581814_6041_UN,8.327362,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010010010111100100110111010000001011100100110011110100001011011011110011101111110,WQULKGOVXQAKPR-UHFFFAOYSA-N
CC1=C(C=N[N]1C)C2=C4C(=CC(=C2)C=CC3(F)CC3)OCO4,ABC9B849D766C30B_1001127DA2FE32A8_7019_UN,8.561842,00000000000000000000001000001000000000000010000000001000010000100110000010010000100100010000011010010100010101001100000011111100000000100100001010011110110011111111110,QGLICQKNWXWJTF-UHFFFAOYSA-N
CCNCC1=CN(C2=C1C=CC=C2)CC(N3CCNCC3)C4=CC=C(C=C4)Cl,E31087BDE8172475_0157730F7D95BABC_6034_UN,8.354716,00000000000000000000000000000000000000000000000000000000000000000100000000010001101101110001000010101101110100010010101011100100110100100110001001011001010110101111010,IZCZFCNCHSGHKU-UHFFFAOYSA-N
CCNCC1=CN(C2=C1C=CC=C2)CC(N3CCNCC3)C4=CC=C(C=C4)F,D1AA18BC35C970E2_70CB4DA0CC539A8E_6034_UN,8.354696,00000000000000000000000000000000000000000010000000000000000000000100000000010001101101110001000010101100110100010010101011100100110100100110001001011001010110101111010,LUQBKEIEBITVKA-UHFFFAOYSA-N
C2(=CC1=C(C(=CC=C1)F)O2)NCCC4CCN(C3CCN(C)CC3)CC4,200C786B389DB24D_5241F595382BBD37_7022_UN,7.4124947,00000000000000000000000000000000000000000010000000000000010000100000000000010000101101110001110010101100110100110001111011100100110001110110001001011001110110101111110,GXWSCBHHYANFCS-UHFFFAOYSA-N
CC2=C1[NH]C=CC1=CC(=C2)NC3CCN(C)C34CCCNC4,AEBD948568F5DF3C_FF9C5D441BF4A75C_6041_DP,8.045652,00000000000000000000000000000000000000000000000000000100000000000110000000010001101101100011010010101100110010011001101011100100110101010110001001011101010010101111010,VMZAZAMHUATJOK-UHFFFAOYSA-N
C1(=C(C=CC=C1)C(C#N)N2CCOCC2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,B224ACF1B4917089_08E1356A83C4C3DD_6041_UN,7.78819,00000000000000000000001000000000000000000110000000000000010000100000000000010001101001110011000100101000000101010000001011100100110011110110001011011011010111100111110,SDKQOTBVOPLQJA-ONDKPXHOSA-N
N3CCC(C=CC1=C[NH]C2=CC(=C(C(=C12)F)F)F)(CC3)C#N,27ACE4C54FEEE6CE_F7A3B49DA6524686_7019_DP,7.969779,00000000000000000000000000000000000000000110000000000000000000000110000000000000001100110001000010111100110100011000001011000100110100100110001011010011010010100111010,SPKNNFLOYSRJQJ-UHFFFAOYSA-N
N4CCC1(CC1C=CC2=C(Cl)[N](C(=N2)N(C)C)C3=CC=C(C=C3)C)CC4,D5F9FADE982F9D58_B9ECC0CF8B85B109_7019_DP,7.405062,00000000000000000000001001000000000000000000000000000000000000100110000000110101001101110001010010111001111100011000001011100100110001110110011011011111010010101111010,SYQBZQMTAKFFDC-UHFFFAOYSA-N
C(C1CCNCC1)C2=NC=CN2CC(CC)NCC3=C(C=C(C=C3)Cl)Cl,F7F45C02DA337426_27C2455007D329AD_6034_UN,8.532216,00000000000000000000000000000000000000100000000000000000000000000100000000010101001101110001000010101001100110010010101011100100110100100110001011011011010110101111010,ALHGAZSMNMAWEK-UHFFFAOYSA-N
CC1=CC=C(C#N)N1CC(N2CCNCC2)C3=CC(=CC=C3)Cl,ECC32A7825BC8290_9F3A02CFE654CA63_6034_UN,7.789861,00000000000000000000000000000000000000000100000000000000000000000100000000010001001101110001000010101001100100010000101011100100110000100110001011011011010110101111010,QFMSEBDMYJJUSF-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC2CCCC2CC)C3OCCO3,DBCD12519DABF5DE_2BEA1DBDE0459882_6041_UN,7.808229,00000000000000000000000000000000000000000010000000000000010000100000000010000000000100010011000010000000100111010010101010010000110011110110000010010011010111111111110,QWIILZLLJBCEKK-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)NCC2(CCCNC2)C)F)CC#N,E4E6854E312687F6_4576C5F9FEE00353_6041_DP,8.363239,00000000000000000000000000000000000000000110000000000100000000000010000000000000101000110011000000101000100110011001101001000000110101110110001011010011010110101111010,HEPJDOUKLMBJHR-UHFFFAOYSA-N
N(C1=CC(=CC=C1)CF)C(=O)CC2CC3CC2C4CC34,9FFCDA36834CC5DF_86189E39E019B480_6038_UN,8.462621,00000000000000000001001000000000000000000010000000000000000000000000000000000000000000000001100010000000110000110000010000000000110011110000000001000001011110100111110,RPARMTLUGJDZIR-UHFFFAOYSA-N
C1(=CC(=C(C(=C1)F)F)F)NCCN(C)CC2COCCC2,E8C0898BBD883A4D_237C4EE3BB339FB7_7022_UN,7.612496,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001011011011010111101111110,HFDONUMLJQCTOO-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NC3=C(C=C2OCCCC2=C3)[N](=O)=O)[NH]C=C4,9850108921B71EBD_2F179C9C4389C74D_6041_UN,8.806265,00000000000000000000000010000000000000000010000001000010110000010100001100000001000100010001001011100110010101000100001111101100101111110100001011111011110011110111110,MGMOUPAIIDKEQW-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC3CCCC2(CNC2)O3,60E69E61832AC192_1C9ADE91FD8519B0_6041_DP,7.471323,00000000100100000000100000000010000000000000000000000000010000000110000000100001001000100011010100101000010000001000001011000000110111010110011011011111110111101111110,BLTZFCUCAZAYQX-UHFFFAOYSA-N
C[N]1C=C(Br)C2=C1C=C(C=C2)[S](=O)(=O)NCCC3CC4CCC3O4,3AC844621744C8CD_7D140A15F839A2A0_6026_UN,7.832482,00000000000000000000000000000000110000000000001000010001011111001101010001010000011101011001011010001110111100011000011011101100111010101100001001111001110111111111110,BIOWDDXQBJSIHD-UHFFFAOYSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)CC4CCCCN4C,F9D9E019ACD3D759_346268BD396A2799_6034_UN,6.9509764,00000000000000000000000000000000000000000000000000000000010000000100000000010001001101100001010110101100110011010001101011100100110010000110001001011011010111101111110,ILHGKPXLZKQXDY-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)N[C@H]4[C@@H](CCC4)C5=CC=C(C=C5)F,63ECBA19E9649C18_C13FB76837920A6C_6041_DP,7.900583,00000000000000000001000000000000000000100010000000000000000000100100000000000101100101010011010010100000110100010000101011100100110101110100001001011011000010101111010,CLXXLLLTUWRAAL-HGJUEJDCSA-N
BrC2=C1N(C=CC1=CC=N2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,12E9E1F92F99E0F7_2BF7B680C878F6AE_6034_UN,8.602639,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,BSERMVBUNOFSAW-QAPCUYQASA-N
ClC2=C1N(C=CC1=CC=N2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,CB1DD472E8FDCD49_A2775443B530BD74_6034_UN,8.602616,00000000000000000000001000000000000000000000000000000000000000100100000000010101100101010000010010101101010100010000001011100100110001100110001011011010010110101111010,LKVKSWDTEKFNCO-QAPCUYQASA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)C[C@H]3NCC[C@@H](CC)C3,D57B0AAE5B6F00EE_861E957B07724E20_6034_UN,8.873546,00000000000000000000000000000000000010000000000100000000000000100100000000010111011101011001000010101001101110010011101111100100110001110110011011011111010110101111010,VNROIMDHGJLYKI-KSBCIKQNSA-N
C1(=CC3=C(C=C1)C2CC(C2)C3=O)NC4(CCCCC4)C5=C(C=C(C=C5)F)F,548CF914CD03665A_17D4A1C88161E09B_6041_UN,7.7725997,00000000000100000000000000000000000000000010000000000000000000100010000000000000000000010011000000000100110100011000001000000101110001110000000111010011101010100111110,YNVMUMLSBNBPJO-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)CC=C,8BA0E52AE4B69D5B_C58B42639D4D0A83_6041_DP,8.267274,00000000000000000000000000000000001000000010000000000100000000100000000000000000101000110011000000111000100100010000101001000100110101110110001011010011010110101111010,AUAGTBCLFFMENR-SIKLNZKXSA-N
CCN4CCC1=C(C(=CC(=C1)NCC3(C2=CC=CC(=C2)C)CCCCC3)F)C4,5FD4677320DAE89C_39B73696CC0047AA_6041_UN,7.534998,00000000000000000000000000000000000000000010000000000000000000100010000000010000001001110011000000101100010110011010101001100100110001110110001011011101010110101111010,MEXVPMQIBMZBJP-UHFFFAOYSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)NC4=CN=C([Si](C)(C)C)C=C4)F,A01F7C93E9A7D899_5C6C3556E6D0DA1E_6041_UN,7.1507206,00000000000000000000100000000010000000000010000000000000000000000100000000100001100000110011010000100100010100011000001011000100110001110100011011011111000010101111010,ITYYHOATEWFNGP-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CCNCC2)C3=C(C=NC=C3)F)F)CC4,093628E08F8D0FBF_15500F09FE7B1AF6_6041_DP,8.609788,00000000000000000001000000000000000000000010000000000000000000100110000000010001101001110011010000101000100110011001101011100100110101110110001011011011010110101111010,HOISNJNPEKZLLP-UHFFFAOYSA-N
C(C1CCCC12CCOCC2)=CC3=C[N](C)N=C3C4=CC=C(C=C4)F,90AC769C84483A6F_B4030E1CC143CE70_7019_UN,7.539422,00000000000000000000000000000000000000000010000000001000010000100110000000010000100100110000011010110000010101001000001011101100110010100110001011011010010011101111110,BBJFMOWVTIXMJR-UHFFFAOYSA-N
CC1=NC(=C(C=N1)N[C@@H]2CCN(C)[C@H]2C3=CC=C(C=C3)F)C4CC4,C198B2526F25CA02_360DA7D637B16630_6041_UN,8.298506,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101110011010010101000100110010001101011100100000001110100001011011111010010101111010,POWZGAQHHPOBTL-APWZRJJASA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC34C(OCC3)CCCCC4,479F2D1258FE4E54_AD6F0D336E85A7F6_6041_UN,8.53029,00000000000000000001000000000000000000000010000000000000010000000110000000000000100100010011000111100100110101011000001011000100110011110100001011010011110011101111110,BIQCBZQOQZQGIB-UHFFFAOYSA-N
N(CC12CC(C1)C2)C(=O)C3(CCCC3)C4=C(C=C(C=C4)F)F,B9C9A73546042F40_668E4AC97B20A3AA_6038_UN,7.313467,00000000000100000000000000000000000000000010000000000000000000100010000000000000001000010011100010001000010100101000011000000000110000100000000010010011011110100111110,MPIARFPAWAQPEF-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5)F,A46D35D4DDC3CA8D_7F537ABBB6E4C29E_6041_DP,7.8205123,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100110100010000001011101100110101110110001011011011010110101111010,VZDKYYYKAHRGLU-ZHRRBRCNSA-N
CC2=C1N(C3=C(C(C1=CC(=C2)Br)=O)CCC3)C[C@H]4[C@@H](CNC4)C5=CC=CC=C5,620C872B86C27D9A_3BC946F54969E5F3_6034_UN,8.290073,00000000000000000000000000000000000000000000001000000000000000100100000000010000101101110011000011101100010110010100001011100101110000100110001111011011111110101111110,RUYJKRHLMPKCNB-UWJYYQICSA-N
FC1=C(C=C(C=N1)N[C@@H]2CNC[C@@H]2CC3=CC=CC=C3)C#N,0DB13B143F653BD3_AD41E8486B268600_6041_DP,7.3663106,00000000000000000000000000000000000000000110000000000110000000000100000000000001101100110011000010101000100100010000000011000100110101110110001011000011010110100111010,GWXLJYABTDGWGG-GOEBONIOSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=C(C=C(C=C3)F)F,13AD442A55129E58_5A9F991D0A3F31D9_6038_UN,7.281211,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,LWZTYSOZPNPSEJ-UHFFFAOYSA-N
FC1=CC(=C(C(=C1)F)N[C@H]2[C@@H](OCC2)C3=CN=CC=C3)C#N,01A0509AE447E9FD_FC1CBAB1D7F3794C_6041_UN,7.7271924,00000000000000000000000000000000000000000110000000000000010000100100000000000000100100010011000111100000100101010000001011000100000011110100001011010011110011100111110,SMSJYSTYWQUMCE-ZBFHGGJFSA-N
CC1=CC2=C(C=C1)C(=CN2CC3CC(C)NC3)C4=CCNCC4,0F03251A07C84FFB_349FAE90D976BDC5_6034_UN,8.357573,00000000000000000000000000000000000000000000000000100000000000100100000000011000101101100011000010111100110010010001101011100100110100000110001001011101010110101111010,LARHEAQHQCTKJE-UHFFFAOYSA-N
O=[N](=O)C2=C1[NH]N=CC1=CC(=C2)NC4=CC3=C(N(C)CCO3)C=C4,BDFA0212042D7D8E_64F119670F03A1C7_6041_UN,8.201395,00000000000000000000000010000000000000000000000001001000110000010100011100010001100101100000011111101110010001010101101111101100001111010110001011111001110011111111110,FQGFUWDFBKYZMI-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,34093EB38303BAF8_B39D5C5FA4558329_6041_UN,8.581774,00000000000000000000000000000000000000100010000000001000000000100100000000010101100101110011011010101000100110010001101011101100000001110100001011011111010010101111010,LMLCVQBKIXMHIB-XLIONFOSSA-N
N(CC1C2CCC(C1)C2)C(CC3=C(C)[NH]C4=C3C=C(C=C4)F)=O,FAC297EBDABC7BBA_0F89EDDECAA5E31E_6038_UN,7.961772,00000000000000000000000000000000000000000010000000000000000000000100000000000000001100010011100010001100110100110000111001000100110110100100001011010011011110101111110,SPNMJWOBBUSAFZ-UHFFFAOYSA-N
C[C@H](OCC(OC)C1CCOC1)C2=C(C=C(C=C2F)F)F,1404A20904EB91FC_86CC15B41288B549_6039_UN,8.0398445,00000000000000000000000000000000000000000010000000000000010000000000000010000000000100110100010010000000000111000000101000000010110010100110000010110110110101011011110,FSOAIIQPJMLCAE-IPWFMCSPSA-N
N2CCC(OC1=CC(=C(C(=C1)F)C#N)F)CC2C3=CC=CC=C3,E99BE8DA9AEC95C9_314E8890D4393145_6003_DP,8.062553,00000000000000000000000000000000000000000110000000000000000000100000000000000000001000010001000001101000100100010100001001000111110010100100001111010011110011100111110,YENPHNHUAGHLAA-UHFFFAOYSA-N
CC1=CC(=C(C=C1)F)NC2=C(C=C(C=C2)C35CC4CC(CC(C3)C4)C5)Cl,18C505AD4044F6FC_1FB97F3BA965A454_7022_UN,8.428292,00000000000000000000000000000000000000000010000000000000000000100010000000000000000000010000000000000101010100001000000000000100100001110000000011000011000010101111010,TVBHZTVVWZGZRJ-UHFFFAOYSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(C4=CC(=C(C=C4F)F)C)=O,FD6AB503DFED88C6_48485D3D006353FF_6038_UN,7.5609818,00000000000000000000000000000000000000000010000000000000010000000000000000000000000100010001100011000100010100100000011000000100000011110100000011010011101011111111110,BVDUWSWDLXVQBT-UHFFFAOYSA-N
N1CC4(C1)OC5(COC2=C(C=CC=C2)CNC3=CC=C(C=C3)F)CC4(N)C5,B70246AD9A420A8B_AEF5E55AE03CC82D_6035_DP,8.072734,00000000100100000000000000000000000000000010000000000100010000000010000010000000101110110011000111001000110101011100000011000111110111110110001111000011110111110111110,CPDVTGDBSZNGPS-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CC2(C)CNC2)C=CC(=C3)C)C4,6F5FD7691BC8073D_D090A2B8BCB87920_6034_UN,8.462355,00000000100100000000000000000000000000000000000000000000000000000110000000010000101101100010000010001100010010011011101011100100110000000110011011011101010110101111010,HRUMVCRZKSJAFL-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(=O)C[N]4C=CC5=C4C=C(C=C5)F,7988B686AB37F1C4_7CE1083B3277341B_6038_UN,8.115339,00000000000000000001001000000000000000000010000000000000000000000100000000010001001101010011100110001100110100110000010001100100110010100110001001001001011110100111110,AKGFCFXNUDXJNG-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC[C@H]3[C@@H](C3)C4CCC4,7026F9225036E067_A83DF16D559FE319_6041_UN,8.421409,00000000000100000000001000000000000000000010000000001000000000100100000000010000101100010011011010001100010100000000001011101100110001110100001000011011010110101111010,GLQGFQVEMQDHJK-FZMZJTMJSA-N
N(CC12CCC(CC1)C2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)F,FEAF8AC1762E92AC_8C818722476E2E64_6038_UN,7.180311,00000000000100000000000000000000000000000010000000000000000000100010000000000000001000010011100010001001010100101000011000000000110000100000000011010011011110100111110,FOMYJWHCOFKQCZ-UHFFFAOYSA-N
N(CC12CCC(CC1)C2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)Cl,3D422538D55F4839_4364DD2A9C585742_6038_UN,7.180305,00000000000100000000000000000000000000000000000000000000000000100010000000000000001000010011100010001001010100101000011000000000110000100000000011010011011110100111110,GVDYOJWLCVSNDL-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC2(CCC2)C3CCCCO3)C=CC(=C4)Cl)C5,74E84D03EF5FF1E6_2D0ECA47BF98CFA5_6034_UN,7.3011384,00000000000100000000000000000000000000000000000000000000010000100110000000010000100101110000010011101101010101011001101011100100110010100110001011011000110111101111110,MWSIVYMHGMTGRN-UHFFFAOYSA-N
O[C@@H](CF)C1=CC(=CC=C1)NCC2N(C)CC3(CC2)CC3,B16ABD1E5BD07B6D_CB0E10632E7725D6_6041_UN,8.290158,00000000000000000000001000000000000000000010000000000000000000000010000000010001001001100011010000101000110010011001101001100000110111110111001001011011110111101111110,INBZLWFAIAHPGZ-LYKKTTPLSA-N
O[C@@H](CCl)C1=CC(=CC=C1)NCC2N(C)CC3(CC2)CC3,F80C8ED92A6888A4_40E0A6F3A28D355B_6041_UN,8.290149,00000000000000000000001000000000000000000000000000000000000000000010000000010001001001100011010000101001110010011001101001100000110111110111001001011011110111101111110,RVKXRKRACMBIJC-LYKKTTPLSA-N
C[N]1N=CC=C1CC=CC3=C2OCCC2=CC4=C3CCO4,C3C9B7701B346763_F51D11EFEE7CCB06_7019_UN,7.2776756,00000000000000000000000000000000000000000000000000001000010000000100000000010000100100000000011010010100010001010100101011101100000010000110001010011010110111111111110,YDDKRZZTGLDWGN-UHFFFAOYSA-N
FC2=C(C=C1N=CC=NC1=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,25385FD1FF016957_89D36789CBF8347B_6041_UN,8.403582,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,FBFGGQVLHXDTRL-SZNDQCEHSA-N
N(CC2=CC1=C(C=CC(=C1)F)S2)C(C34CC(C)(OC3)CCC4)=O,15131553427EE01A_30AFAF338C9B70B6_6038_UN,7.82172,00000000000000000001000000000000000010000010000000000000010000000010000000000000011100011111100011001100010111101001111010000100110010100110000001010001111111111111110,ZDCTZDVCWGRMSX-UHFFFAOYSA-N
ClC1=CC2=C(C=C1)N(C(=CC2=O)C3CC3)C[C@H]5[C@H]4CNC[C@H]4OC5,10290E4E1AF6BD9D_617616F6DDF68628_6034_UN,9.022103,00000000000000000000001000000000000000000000000000000000010000100100000000010000001101110001000111101101010101000100000011100101110010100110001111011011111111110111110,YWJLSFINOMOVAB-KPAZRMRSSA-N
N(CC1CC2CCCC(C1)C2)C(C4=CC3=C(C(=CC(=C3)C)F)N=C4)=O,107CBEFA27D8FF07_2BF880FEB795F7DB_6038_UN,7.8014264,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010010100001101100010100100000011001000100110000100100001001010001011110101111110,ZPBVEYATWBUXLB-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2=CN(C(=N2)C3CCCN3)CC4CNCCC45CCN(C)CC5,F2BD60DEF9D038A1_8FD8315D511F778C_6034_UN,7.6968565,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101110011010010101000110100011001101011100100110100100110001011011011010110101111010,CMMCFYBOKIAMCI-UHFFFAOYSA-N
CC1=C(C(=CC=C1)NCCC3CCN(C2CCN(C)CC2)CC3)C,AAB918DF9F8E9A11_909A7D0ADE0B2B86_6041_UN,7.799396,00000000000000000000000000000000000000000000000000000000000000100000000000010000101001100001010000101000100010010001101011100000110001010110011011011111010110101111010,NFXOBVTVMOAKDE-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(N)CCC4=C3C=CC=C4)C5=CCNCC5,4AFD4887143BC05C_36C49B1F8A9344BB_6034_UN,8.302668,00000000000000000000000000000000000000000010000000100000000000100110000000011001001111110011000010111100110100011000001011100100110101100110001011011001010110100111010,NSLLULKOLDMWND-UHFFFAOYSA-N
CC1=C[N](N=C1)CC2=C(C=C(C=C2)NCC3N(C)CC4(CC3)CCC4)F,AB8C1CB561A9EDD3_926CB3E9D294CB1E_6041_UN,7.631794,00000000000100000000000000000000000000000010000000001000000000000110000000010001101101110011011010101000010110011001101011101100110001110110001011011111010110101111010,LLPNEMQJLAGTDC-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2CC2)NC3CCN(C)C34CCCNC4,5E99A851E937F418_4EE4AE15881ED30A_6041_DP,7.614649,00000000000000000000001000000000000000000010000000000100000000100010000000010001101101110011010010101000110110011001101011100000110101110110001011011011010010101111010,FCFUQAMHILPOHN-UHFFFAOYSA-N
FC1=C(C(=CC=C1)F)C4(C=CC2=C(C=N[N]2C)C3CC3)CCC4,59A786F3A0158B50_6C11E18F30178B5F_7019_UN,8.426861,00000000000100000000001000000000000000000010000000001000000000100110000000010000100100010000011010010000000100001000001011101100000000100100001010011010000010101111010,TZGUAOYEQKXGPJ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(CCNCC3)C4=C(C=NC=C4)F,9F32B20E84883CD2_65668A921D264800_6041_DP,7.961212,00000000000000000000000000000000000000100010000000000000000000100110000000000100001000110011000000101100110110011000001011000100110101110110011011010111010110101111010,HOBDILXPTZUVJM-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NCC2(CCCCC2)C3=CC=C(C=C3)F)F)C4,930D4A628AF284AC_2F01327581B51E6A_6041_UN,7.3527293,00000000000000000000000000000000000000000010000000000000000000100010000000010000001001110011000000101100010110011010101001100100110001110110001011011001010110101111010,JFQPITHKSJVQRA-UHFFFAOYSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC3=C4C(=CC=C3)OCCNC4,2A826FC429BD6269_38D25AF04564A7ED_6035_UN,8.0037365,00000000000000000001001000000000000000000010000000000000010000100010000000000000001010110111000101001100110101011100001011000111110110100110001111010011110101110111110,UMTFZQCCDOXJIM-UHFFFAOYSA-N
C[N]1N=C(C=C1N[C@@H]3CCN(C2CC2)[C@H]3C4=CC(=C(C=C4)F)F)C5CCCC5,9CD8014D748B8FB7_2D3E4219CAECE15C_6041_UN,8.753621,00000000000000000000001000000000000000100010000000001000000000100100000000010101100101010011011010001000100100010000001011101100110001110100001010011011010010101111010,AROGPBUBOZYXRX-KNQAVFIVSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=N3)NC4C5CC6CC4CC(C5)(F)C6,641D043D6344E465_0836D176A60D0B9E_6041_DP,7.7092557,00000000000000000001000001000000000000000010000000000000000000000110000000000100100101010011010010100100111100011000101011100000110101110100001001011001000010101111010,RTFRWLJOZYHERJ-LZSKQNSCSA-N
CC1=C(C=C(C(=C1)NC23CC(C)(C2)OC34CCOCC4)F)[N]5C=CC=C5,C1E45F1A15B9EF84_1D1A434292545F78_6041_UN,7.3530536,00000000000100000000000000000000000000000010000000000000010000100110000000010000000101110111000111100000110111011001001011100100110011110110001011011111110011111111110,GASCLYSXRRTAMN-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C=C)NC2CCN(C)C23CCCNC3,48BE1EBB190F9281_057A9AB296B14D7E_6041_DP,7.8788514,00000000000000000000000000000000001000000010000000000100000000000010000000010001101101110011010010111000110110011001101011100000110101110110001011011011010010101111010,NYCSKPPULRLMGS-UHFFFAOYSA-N
COC1=CC=C(C=C1)C4=CC2=C(C(=NC=N2)NCCC3OCCC3(C)C)S4,780D7B14C6CBBA98_43F6DF1F8FA85B9D_6041_UN,8.223951,00000000000000000000000000000000000010100000000000000000010000100110000000100100111100001000010011101100110011011101101011000111110011010110011101010111110111111111110,VGRATQHVORMBFO-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2CC[C@@H](O2)C3CC3)Cl)C4CC4,8FAB84DDAB58514B_E2CBD454C6C0FA88_7022_UN,7.697118,00000000000000000000001000000000000000000000000000000000010000100000000000000000001100010011000110001001000110000000001000000000110011110100000010010011110111101111110,QEGWALCBPQOROR-KBXCAEBGSA-N
N(CCC1=CC=NS1)C(C34CC2(CC(CC(C)(C2)C3)(C)C4)C)=O,B57B168998F14740_9FC1E98F992A3711_6038_UN,8.240477,00000000000000000000000000000000110010000000000000000000000000000111000000000000011100001010101010001100110010111001011011001000100000000100011001010101011110101111110,JAPOJWLKXQOWMM-UHFFFAOYSA-N
CN1C2CCC(C1)CC2COC(=O)[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)Cl)F,2F3C131983DBDFE6_22A2E4A3E21182E5_6038_UN,8.12685,00000000000000000000000000000000000000000010000000000000010000100000000000010000000101110100010011101001010111010001101011110010110010100110000011111010111111111111110,NKRGQPQKXCLHDF-VURVLWSRSA-N
CN1C2CCC(C1)CC2COC(=O)[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,DED4E293B65E6D3E_41370581E7F47B60_6038_UN,8.126848,00000000000000000000000000000000000000000010000000000000010000100000000000010000000101110100010011101000010111010001101011110010110010100110000011111010111111111111110,QTSOJFQUZVRIEK-VURVLWSRSA-N
BrC1=CC=C(C=C1)C2=NC=CN2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,855B8D245E56C23A_10EBBB4A594178E7_6034_UN,7.82903,00000000000100000000000000000000000000100000001000000000000000100110000000110101000101010000000010001000010110011000101011100100110000100100001011011110010110101111010,PHKISHNUNQDLFQ-YXJHDRRASA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3(CCNC3)C,F96CA1EB74614C7E_58F61954445E4072_6041_DP,7.9496284,00000000000000000000000000000000000000100010000000000100000000000110000000000100101100110011000010101100110110011001101011000100110101110110011011010111010110101111010,QZXFMHBGSLVOJI-UHFFFAOYSA-N
C1(=C(C2=C(C=C1)C=CC=C2)F)NC3CCN(C)C4CCCC34,1BEE15526A6F89BA_42561419743DD6A8_7022_UN,8.325412,00000000000000000000000000000000000000000010000000000000000000000000000000010000100001110011010010101100110110010001101001100100110001110100001011011011010010101111010,PSPBVPFAZLRUSO-UHFFFAOYSA-N
N(C1CC2(C1)C3CCC(C2)C3)C(C5=C(CC)N=C4C=C(C=CC4=C5)F)=O,DC617C1A8EDC8461_0B55F03B5C99EDE3_6038_UN,7.861449,00000000000100000000000000000000000000000010000000000000000000000110000000000000100000010001100011100100110100111010011001000100110001100100001011010011001110101111110,BANLSUDOOODSRT-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CO2)NC4CC(C3=NC=C[N]3C)OCC4,FFA6DB9925C87EA2_4775C94F8CF0C1EA_6041_UN,8.163337,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010010010111100100110111010000001011100100110011110100001011011011110011111111110,GSPGGKFXXRJLTH-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NCC3(C)CCCS3)C,F90F887CC014E24F_990509EAFC40D879_6041_UN,7.95468,00000000000000000000000000000000000010000010000000000000000000000110000000000000111100011011000010101100010110001001101011000100110001110110011011010111010110101111010,ZLFSKQJOVHXOEY-UHFFFAOYSA-N
CC1=C(N=C(N=C1)NC2CCN(C)C23CCCNC3)C4=C(C=CC=C4)F,2667BC7BB9B5D1F6_A36825A0AB5EDB14_6041_DP,7.751463,00000000000000000000000001000000000000000010000000000100000000100110000000010101101101110011010010101000111110011001101011100100110101110110001011011111010010101111010,HSEBXYJTEBOPFM-UHFFFAOYSA-N
CN(C)[C@@H]1CCCC[C@H]1OC2=CC(=C(C)C=C2C3CNCC3)Cl,BF7C85D8E53549C6_D9C5E8D0C95BC160_6035_UN,8.255094,00000000000000000000000000000000000000000000000000000000000000100000000000100000001101110011010110001001100110010100101001100011110011100110011111011111110011101111110,APYSHFDTGXFEJV-KNHHTTPFSA-N
FC2=C(C=C1C(=NC=CC1=C2)NCC3CCCN(C)C3C4=CC=CS4)F,B506AD28FC81FA32_D5CB40FD32F0072C_6041_UN,8.546499,00000000000000000000000000000000000010100010000000000000000000100100000000010100111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,XWEHHARQANQWSV-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC4CCCN(CC3CC3)C4,C2245D99031CD677_29EDAE9E0D3BB1A8_6041_UN,8.221744,00000000000000000000001000000000000000000010000000000000000000000100000000010000101001110011000000101100010100010000001011100100110001110110001011011011010110101111010,FMDREUYNLGQPJY-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NC2=CC=CC3=C2CNCC3,DB8D250D958E5AB2_0AA02AE01C195547_6041_DP,7.324144,00000000000000000100100000000010000000000000000000000100000000000100000000100001101000100011010000101100110000011000001011000100110101010110011011011111010010101111010,VMBSWQUUZLBRRW-UHFFFAOYSA-N
OC(CBr)C1=CC=C(C=C1)NCC2N(C)CC3(CC2)CC3,E86E1FDAF94F8FBB_71BD129D0B809FE7_6041_UN,8.185789,00000000000000000000001000000000000000000000001000000000000000000010000000010001001001100011010000101000110010011001101001100000110111110111001001011011110111101111110,SPRXWQVYIYBUOC-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCCC2CCCN2C)F)CC3,DC058C7E063F55CF_90C8EBB57FE79CD1_6041_UN,7.4666634,00000000000000000001000000000000000000000010000000000000000000000000000000010001101101110001010010001000100110010001101011100000110001110110001010011111010110101111010,NAJLOBKREOCSNK-UHFFFAOYSA-N
CC3=CC1=C(C=CC(=C1)NCC(C)(C)C2CCCCC2)[NH]3,7AD3E1DF588AD3E8_98CD4A8056F30EC9_6041_UN,7.8614483,00000000000000000000000000000000000000000000000000000000000000000110000000100000001100000001000010001100010010001001101001000100110101010100011001010101010110101111010,RJZQSGUSIJDTGN-UHFFFAOYSA-N
OC(CF)C1=CC=C(C=C1)NCC2N(C)CC3(CC2)CC3,8FF276FF83BE9423_0663711AA90B488C_6041_UN,8.185776,00000000000000000000001000000000000000000010000000000000000000000010000000010001001001100011010000101000110010011001101001100000110111110111001001011011110111101111110,SKZSYCYALNDHSB-UHFFFAOYSA-N
O(C(CN1CCNCC1)C2OCCC2)C3=C(C=C(C=C3Br)Br)C#N,D0B3CAA91E8F1195_A76EBF7821A9287F_6035_UN,8.467657,00000000000000000000000000000000000000000100001000000000010000000000000010010001001101110001000111101000100101010100001011100011110010100110001111011011110101110111110,KOKMXHLGBYXUNO-UHFFFAOYSA-N
O(C(CN1CCNCC1)C2OCCC2)C3=C(C=C(C=C3Cl)F)C#N,76784C26B170F3AD_2AF6465622E0F983_6035_UN,8.467651,00000000000000000000000000000000000000000110000000000000010000000000000010010001001101110001000111101001100101010100001011100011110010100110001111011011110101110111110,GWJZHNSBSQJZRI-UHFFFAOYSA-N
C(C1=CSC=C1)C2=CN(C=N2)CC34OC(C)(C)C(C3)C4,73D9C34633CA2DCC_AEA63609FD982B35_6034_UN,7.8372235,00000000000100000000000000000000000010000000000000000000010000000110000000110101000101001000000110001000010010011000100011100100100010000100001000001100110111101110110,OYMMWPJAYDNAAP-UHFFFAOYSA-N
O=[N](=O)C2=C1N=C(C=CC1=CC(=C2)F)NCC34CC(C3)CCO4,DE9D7FCBE810BDD7_22B37B6E356DB84B_6041_UN,7.985426,00000000000100000000000010000000000000100010000001000000110000010110001100000101001000010011001101101110010101001000001111101100111011110110001001111001110111110111110,HEQAAJLRLBKHJV-UHFFFAOYSA-N
CC(C)(C#N)C1=C(C(=CC=C1)NCC2CC3(CN2)CC3)F,F4AFFF0FB5A1CC86_FF9FF3A39D5CA906_6041_DP,7.7643914,00000000000000000000001000000000000000000110000000000010000000000010000000100001001100010011000010001000110100011000000001000000110101110110001010010111010110101111010,LRSDYBYFCJNCRI-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)NC[C@@H]3CC(CN3)(C)C,97D24614078B9154_1908A3C7822E0DE5_7022_DP,7.3963366,00000000000000000000001000000000000000000110000000000010000000100010000000100001001100010011000010001000100110011001000001000000110101110110001010010111010110101111010,MQAFTYBHDSUVLD-ZDUSSCGKSA-N
FC1=CC2=C(C=C1)N(C=C2C3=CCNCC3)CC=CCC(C)C,0522B4FFF81A7E15_0052910ECBBF0280_6034_UN,9.037557,00000000000000000000000000000000000000000010000000100000000000100100000000111000001101110001000010111100110100010001001011100100110000100110001001011101010110101111010,GVZPQGGQNSBSQV-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CCC3(CCC2)CC3)Cl)C4CC4,3E28C1F758901E5C_5D5ADC90335F2D1D_7022_UN,7.6694,00000000000000000001001000000000000000000000000000000000000000100010000000000000000000010011000000000001110110011000001000000000110001110000000010010011000010101111010,GRLDLJWSGMJTEN-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2C3(CCNC2)CCOC3,4D9A088499FED70E_8C423FC4F64F7B6E_6041_DP,7.6579304,00000000000000000000100000000010000000000000000000000100010000000110000000100001101100100011010010101000110001011000001011000000110111010110011011011111010111101111110,ATWJDMQWIKCXJD-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC34CCC(C)(CC3)CO4,7A484F646447F9C5_B14804E104321A5F_6041_UN,7.442416,00000000000000000000000001000000000000000010000000000000010000000110000000010101001101010011010110101100011111001001101011100100110011110110001011011111110111101111110,IWUCYHYBHHKUJS-UHFFFAOYSA-N
C1CC(CN1)C3=CC2=C(C=CC=C2)N3CC4(CC)COC(CI)C4,19E01809D63296AC_0DC6670DA66C29F6_6034_UN,8.138433,00000000000000000000000000010000000000000000000000000000010000100110000000010000101101100011000011001100110001011010101011100100110010100110001010011011110111101111110,RWPDSHRQPYNJMK-UHFFFAOYSA-N
CC1=CC(=C(C=C1)F)NCCN(C)CC2COCCC2,792FFB216FA4D7CF_DE65A06E1FD74250_7022_UN,7.0635495,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001011011111010111101111110,BCEPBOVSJFNFQC-UHFFFAOYSA-N
CC2=C1N(C(C=CC1=C(C=C2)Cl)=O)CC3(CC34CCNCC4)C#N,2296D531116D3FE9_B6352BD240D10097_6034_DP,8.318808,00000000000000000000001000000000000000000100000000000000000000000110000000010000101001110001100000101101110110111100011011100101110000100110001111011011011110101111110,HPRYWWBHVGUEDH-UHFFFAOYSA-N
NCC1(C(CCC1)OC3=CN=C(C2=C[N](C)N=C2)S3)CC4=CC=C(C=C4)F,977F2CDDDA54CA7B_1A90DD7DA95BABA5_6035_UN,7.858321,00000000000000000000000000000000000010000010000100001000000000100110000000010000111110011011011111001000000100001100001011101111110010100100001100011011110111101111110,ATGDBEOHQJMFJM-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)N[C@@H]2CCO[C@@H](C2)C3=CC=NC=C3,253ED594FA0924D6_FF6D2B331D31ED7E_6041_UN,7.931878,00000000000000000000100000000010000010000000000000000000010000100100000000100000010100101010010011100000100001011000001011000100110011010100011011011111110011101111110,UCXCGGGNZCOYJK-WBVHZDCISA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)N[C@H]4C6=C(OC5(C4)CCCC5)C=CC(=C6)F,BCFCD50C7C8F8B0B_7ACCB67452C91AF4_6041_DP,8.138917,00000000000000000001000000000000000000100010000000000000010000000110000000000101100101010011010011100100110100011100101011100100110111110100001011011001100011101111110,XGIMAPNAIBDJSW-RCLSDMTESA-N
FC1=CC=C(C=C1)C(CCC=CC3=C2CCCCC2=N[N]3C)C4=CC=C(C=C4)F,91F79E82B2CFF03B_06B49A682623D984_7019_UN,7.881358,00000000000000000000000000000000000000000010000000001000000000000100000000010000100100010000011010010100010110010000001011101100110000100100001011011010000110101111010,PVZAJMSHHLSIAL-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCCC2C3(C2)CCOCC3,2708451D3656E86B_A3EC93B6E5FB5135_6041_UN,7.28145,00000000000000000000101000000010000000000000000000000000010000000110000000100001001000100001010000101000110001011000001011000000110011010110011011011111010111101111110,VDGVQXPBFOWILN-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC(CC)NCC3=C(C=C(C=C3)Cl)Cl)C4=CCNCC4,09547C99D7108D3B_F35AD4C2ACA3B2A1_6034_UN,8.450407,00000000000000000000000000000000000000000010000000100000000000100100000000011001001101110001000010111101110110010010101011100100110100100110001011011011010110101111010,MKMZGSFNYIVHIL-UHFFFAOYSA-N
CC1=CC(=CC=C1)NC24CC3CC(C2)CC(C3(F)F)C4,126491732D672DBA_95303DF147361665_7022_UN,8.090509,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010001000000000100110100011000000000000000100001110000000001000001000010101111010,HEBRBIQUQXHZEP-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(CCCCC2)N3CCCCC3)Cl)C4CC4,468216FE505F4ABA_47A32EBA780831BA_7022_UN,7.5100994,00000000000000000000001000000000000000000000000000000000000000100010000000010001001001110011000000101001000110011000001001100000110001110110001011011011010110101111010,CLCRGMIYCODJBK-UHFFFAOYSA-N
C2(=C1C=CC=CC1=C(N=N2)N3CCCCCC3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,0A07E067CAA1356F_2DCD241560404507_6041_UN,8.29917,00000000000000000001000000000000000000100010000000001000000000100100000000010101100101110011011010101100110110010001101011101100110001110110001011011011010010101111010,WCPKYNYAJZBFDP-PKTZIBPZSA-N
CC1=C(C=C(C(=C1)NC2CC3(CC2)CCOCC3)Cl)C4CC4,7B896C26DED1DE1E_A012AB863D664B00_7022_UN,7.686068,00000000000000000000001000000000000000000000000000000000010000100010000000000000000000110011000010100001110111011000001000000000110011110110000011010011010011101111110,KUIRLLDBFMLMKQ-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC4=CC(=CC=C4)C5=C(C=CC=C5F)F,738E9A988078D279_468B48FFF5949397_6041_DP,8.122052,00000000000000000001000000000000000000100010000000000000000000100100000000000101100101010011010010100000110100010000101011100100110101110100001011011011000010101111010,JUSPMAYQSFUGSV-REPLKXPHSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3(CCNC3)C)Cl,8CAF94AFA3F05AC0_DCF60AF38E853B9C_6034_DP,7.7545857,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101111011000010001001101110011001101111100100110101110110001010011111010110101111010,DVROAIKGPKAARM-UHFFFAOYSA-N
CN(C)CC1CCCCC1OCCC3COC2(CCCC2)O3,1AB803C9B0987C81_4BA341796BB27F07_6039_UN,7.1246114,00000000000000000000000000000000000000000000000000000000010000000000000010100000000101100100010011001000010011001001001010110011110010000110000100111110110101111101110,BLUJNKAPZYXDTG-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)C[C@@H]3CNC[C@H]3C4=CN=C[N]4C)Cl,9996CCB67ACC6646_BD90E59F5D175253_6034_UN,8.115114,00000000000000000000000000000000000010000000000100000000000000100100000000010111111101111011010010001001001110000000000111100100110101110110001010001111010110101111010,FYNBPSUCDCFGAA-DOTOQJQBSA-N
C[N]1C=C(C(=N1)C2CC2)NCC3(CC3)C4=NC=C(C=C4)F,FD89D72987C00811_8016787B372629F6_6041_UN,7.887765,00000000000000000000001000000000000000000010000000001000000000100110000000010001101100010011011010101000000100001000001011101100010001110100001010011011010110101111010,WQTBCHPCSAYVLX-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@H]2[C@@H](C2)C3CCOCC3)F)CC4,87DDD04DF91A038C_53501634E04D87E6_6041_UN,7.2409134,00000000000000000001001000000000000000000010000000000000010000100000000000010001100001110011010000101000100111010001101011100000110011110110001011011011010111101111110,FXSXLDVJKYVWLL-PZJWPPBQSA-N
N3CC[C@@H]([C@H](NC(C12CC(CN1)OC2)=O)C3)C4=CC(=C(C=C4)F)F,722180E6DF55C576_73D091EB902575FB_6038_DP,7.781741,00000000000000000000000000000000000000000010000000000010010000100010000000000001001100110111100111101000110101111000011011000000110111100110001011010011111011110111110,CUPWLFJGXCADJX-WLBPZHLASA-N
C2(=CC1=C(C=C(C=C1)F)O2)NCC3N(C)CC4(CC3)CCC4,E5F2268C631A43FB_8C979B2813D29B18_7022_UN,7.441823,00000000000100000000000000000000000000000010000000000000010000000010000000010001001101110011110010101100010110111001111011100100110001110110001001011011110110101111110,CJQNUDBUIXKRPC-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)NC[C@@H]2CNCC(O2)(C)C)F)C#N,760B04B9FB5C3795_BDB2D717788A487F_6041_DP,7.9176817,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110011011000111110111101111110,OCYVGAFYBWCXGX-LBPRGKRZSA-N
C2(=CC1=C(C=C(C=C1)Cl)O2)NCC3N(C)CC4(CC3)CCC4,9F0640677CE36693_9F3BEAEAA1A4E579_7022_UN,7.4418206,00000000000100000000000000000000000000000000000000000000010000000010000000010001001101110011110010101101010110111001111011100100110001110110001001011011110110101111110,VEQYZVDJRUPONL-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2(CC)CCOCC2)Cl)C3CC3,EAB8936D141376BE_654B2B8F62636F46_7022_UN,7.0284476,00000000000000000000001000000000000000000000000000000000010000100010000000000000000000110010000001100001100111011010101000000000110011110110000011010111010111101111110,OJQDOAONUJZKHN-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC2CCNC23CCC3,68C1A04A49666A3A_8D1CA29D5F55C3B2_6041_DP,7.580431,00000000000100000000000000000000000000000110000000000100000000000010000000000000101100010011000010001000110110011000001001000000110101110110001010010011010110101111010,SINVMUNYEHBYLR-UHFFFAOYSA-N
FC2=C1C=NC=CC1=CC=C2NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4,E0CFCA38F7E609C5_935D7DD50B941375_6041_UN,8.526609,00000000000000000000000000000000000000000010000000000000000000100100000000010000101001110011010000101100010110010001101011100100110001110110001011011011010110101111010,MOUGOSUCDCXUBT-AVRDEDQJSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3(CCC3)C#C,DD590FEE07FAA335_6D23151507CBE6C8_6041_UN,7.627327,00000000000100000100000000000000000000100010000000000000000000000110000000000100001000010011000000101100010110001000001001000100110001110100001011010111010110101111010,GAFCZCMUYMWBRY-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2OC3(CC2)CCC3)F)CC4,A588CB8766194963_081BC1FE7F80AFAF_6041_UN,6.8886046,00000000000100000001000000000000000000000010000000000000010000000010000000010001101101110011010110001000010110011001101011100000110011110110001010011011110111101111110,IERZKYAKZTVNQY-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[N](N=C2)C3CCCCO3)NC4=CC=C(CC[Si](C)(C)C)C=C4,4F7621AF181AB2F4_62A04182A387E7B9_6041_UN,8.138513,00000000000000000000100000000010000000000000000000001000010000100100000000110000100100100000111110100100010001111001111011101100110011010110011001011101010111101111110,AXDJILFWGLAIGD-UHFFFAOYSA-N
CC1=C(N=C(N1CC2C3CCC(N2)C3)C4CCCN4)C5=CC=CC=C5,C4915036D85DFF27_60C7552BA4B132A6_6034_UN,8.097369,00000000000000000000000000000000000000100000000000000000000000100100000000010101001101000011000010101000110000010000101011100100110100000110001011011011010110101111010,NOQIISBXOCXBFK-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)COC2)[S](C3=CC4=C(C=C3)N=CC=C4)(=O)=O,EEFCF23AA70AED8B_2BAC9A2117CBBE7E_6029_UN,8.533919,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100101000001010101110011001001000010011001100111000001110001011101001010111110111110,JWWGWKGPILXZHY-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CC(OCCC)C2=C(C=C(C=C2)F)C)C=CC(=C3)Cl)C4,18E4C53423B4187C_BF8E4E469558847A_6034_UN,8.283903,00000000000000000000000000000000000000000010000000000000000000000100000000010000001101010010000110001101110111010011001001100110110011100110011011011111110111101111110,TYPBXHFTZUDIGF-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC3CN(CC2=CC=CC=C2)CC34CCOCC4)Cl)C5CC5,E47101C33634241D_6BEDAE51D443E4E5_7022_UN,8.185557,00000000000000000000001000000000000000000000000000000000010000100010000000010000101101110011000010101001010111001000001011100100110011110110001011011011010111101111110,YPPKXIISOAOUFS-UHFFFAOYSA-N
CN(C)[C@@H]1CCCC[C@H]1OC3=C2C(=CC=C(C2=NC=C3)F)F,D3EA1FBF8EFB86AD_D72AA3F91A102C6E_6035_UN,7.8839617,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010101100100010110010100101001100111110011100100001101011110100011101111110,OFJYVKOUXLWZPX-ZIAGYGMSSA-N
CC1=C(C=C(C(=C1)NCC2CC3(C2)C4CCC(C3)C4)F)[N]5C=CC=C5,A82ED7B17AB5AD6F_E4F216AC08E6804A_6041_UN,7.633912,00000000000100000000000000000000000000000010000000000000000000100110000000010000001101010010000010001000010100001000001001100100110001110100001011011011010110101111010,VJFBYFJVGDSLGY-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CC2(CCCN(C)C2)C)C=CC(=C3)Br)C4,95D31825C1D5FE3A_A8F8A0E9A9BE380D_6034_UN,7.543442,00000000000000000000000000000000000000000000001000000000000000000110000000110000100101110000010010101100010110011001101011100100110000100110011011011100010110101111010,SEHSTQGWAUNTCF-UHFFFAOYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC(C4=C[N](C)N=C4)C5=CC=C(C=C5)F,6A642927E1CE2324_A0A4FCD6112154F3_6041_DP,7.6057615,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011011010100000110100010000001011101100010101110100001001011001000010101111010,TYNGIUVKZXGTEQ-BZTJJXCDSA-N
CC2=C1N=CC(=C(C1=CC(=C2)F)NCC4NC3COCC3C4)C#N,32E42DA70421850D_645702493799888C_6041_DP,7.6253595,00000000000000000000000000000000000000000110000000000010010000000100000000000001101100110011000111101100110101010000000011000100110101110110001011000011010111101111110,FFNVYALBVPRAQI-UHFFFAOYSA-N
C2(=CC(=C1OCCC1=C2)CC#N)NC3=CC4=C(C=C3)[S](CCC4)(=O)=O,5C9930E3B7139815_E98291ED464512AB_6041_UN,7.8362455,00000000000000000000000000000000000010000100000000010001011111000001000001000000010100001001000010100110010001011100001010001101101011011110001111111001110111110111110,PVQLKHWERRIJCF-UHFFFAOYSA-N
N1CCC5(C1)CCN(CC2=NN=C(C=C2)NC3(CC[Si](C)(C)CC3)C4=CC=CC=C4)CC5,6E4623449A4D9801_A095B86D69DF4806_6041_DP,7.978711,00000000000000000000100000000010000000100000000000001000000000100110000000110101101101100011011010101000110000011001101011101100110101010110001001011101010110101111010,ZCHGTWOMYZNZDM-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC3CCC2(CCCC2)C3)F,FE64BC442B0A7F48_67540EF7D87E5DFC_7022_UN,7.6715794,00000000000000000000000000000000000000000010000000000000000000000010000000100000000001110011010010001000110100011001001000100000110001110000001010011111010110101111010,GHUFBBUQQZSLPA-UHFFFAOYSA-N
NCCC3(COC1=C(C(=CC=C1)C2CNCCC2)F)CCC3,013C35FB6597B0FE_BC5788043E580F6B_6035_UN,8.429014,00000000000100000000000000000000000000000010000000000000000000100010000000000000001010110011000000101000100101011100001001000011110100100110001111010011110101100111110,BSUJKLIOVOYWHF-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC(OC)C3CCCO3,7E9EE736B88D8C57_6AA0DDCB7E7285E2_6041_UN,7.6303244,00000000000000000000000000000000000000000010000000000000010000000100000010000001001100010001010111101100010111000000101011000110110011110110001011010111110111111111110,LPGXKKQIFUGYQL-UHFFFAOYSA-N
CN(CC1CCNCC1)C2=NC=C(N=C2)N[C@H]3[C@@H](C3)C4=C(C=C(C=C4)F)F,E9A8CD910817BFA9_C107EC74FFD7359B_6041_DP,8.232012,00000000000000000000001000000000000000100010000000000000000000100100000000000101001001110011010000101000100110010001001011100100110101110110001011011011010110101111010,TVYMJKFMCGBMSS-FUHWJXTLSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3(NCCNC3)C)Cl,B614ABBC9CACF421_A4ED66E72E924292_6034_DP,7.9988203,00000000000000000000000000000000000010000000000100000010000000000110000000010111111101111011000010101001101110011001101111100100110101110110001011011111010110101111010,GPNNWIBHQWHNLQ-UHFFFAOYSA-N
FC1=C(C=CC(=C1)NCC(N(C)C)C2=CC(=CC=C2)F)OC3CCOCC3,4978A8F3DFF44D81_6378C6D6EFF13067_6041_UN,7.728948,00000000000000000000000000000000000000000010000000000000010000000000000000100001001001110100010000101000000101010100101000100111110011110110001111011111110111111111110,WHRUMEPKWWGNQH-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC4C3CCOC3C45CCC5,659D57A3EF9559D9_476F1681942ECA55_6041_UN,7.654535,00000000000100000001000000000000000000100000000000000000010000000110000000000100000100000011000011100100010001001000001011000100100011010100011011010111110011101111110,SFBZWLOYAACBGY-UHFFFAOYSA-N
CC3=NC2=C([C@H]1CCCN[C@H]1CC2)N3CC5(CC4=CC(=CC=C4)Br)CC5,0EE908C4F8B7150E_FADE0D1D888B79D5_6034_UN,7.668866,00000000000000000000001000000000000000100000001000000000000000000110000000010101101101010011000010101100110110011000101011100100110000100110001011011011010110101111010,LUDFAGFZVOXYRY-OALUTQOASA-N
C1CNCC(C1)C3=CC2=C(C=CC=C2)N3CC4(CC)COC(CI)C4,04F21C53E108416A_5860C45A27AD818E_6034_UN,8.192992,00000000000000000000000000010000000000000000000000000000010000100110000000010000101101100011000011101100110001011010101011100100110010100110001011011011110111101111110,MQONTVOILCRRRK-UHFFFAOYSA-N
CC1=C(C=CN=C1F)NC2CCN(C)C23CCCNC3,F55EF7CCA24D23D1_50CC3A7FC0CE115F_7022_DP,7.5363584,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101000110110011001101011100000110101110110001011011111010010101111010,XDAPEARMZSXNSP-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCC(C(C)C)CC3,8A3C438F97F86ACD_ADB5F6E3A54895F9_6041_UN,8.213745,00000000000000000000000000000000000000100010000000000000000000000100000000100100001000010011000000101100010110000000101001000100110001110100011011010111010110101111010,NZHGEVCVOPZKSP-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC23C(OCC2)CCCCC3)F)CC4,127CB689CF9A5DCD_7DA7F363B3DFFA8F_6041_UN,7.1474147,00000000000000000001000000000000000000000010000000000000010000000010000000010001100101110011010111001100110111011001101011100000110011110110001010011011110111101111110,IALAJJDMRUHUCU-UHFFFAOYSA-N
NCCC(OC1=C2C(=CC=C1)CNC2)C3=CC=C(C=C3)Br,A65427A6C3CADF87_E70ED964614759D7_6035_UN,8.004543,00000000000000000000000000000000000000000000001000000000000000000000000000000000001110110001000011001100110100010100001001000111010110100110001111010001110101100111110,ZMRKWUCZKAEQGS-UHFFFAOYSA-N
CCNC5CCC1=C(C4=C(N1CC3(CC2CO2)CCCC3)C=CC(=C4)Cl)C5,82772C81ACCFD729_AD4E9CEDBBA236AC_6034_UN,7.5202737,00000000000000001000001000000000000000000000000000000000010000000110000000010000001101010010000010001101110111011010001011100100110011100110001011011001110111101111110,WYZAUFCXBCTEFG-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)F)F)C(C2C3CCCC2CN3)=O,9C67DB4651335392_360F1DBDBD92DC44_6038_DP,7.7200627,00000000000000000001000000000000000000000010000000000100000000000000000000000000101100010011100011001000110100110000011001000000110100100110001011010011011110100111110,XECKVKGXSSHNRN-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)Cl)Cl)C(C2C3CCCC2CN3)=O,B2AE418A26EDAF2F_1229E5DA213C45B6_6038_DP,7.7200594,00000000000000000001000000000000000000000000000000000100000000000000000000000000101100010011100011001001110100110000011001000000110100100110001011010011011110100111110,LXMBFVRUMVGWKQ-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)F)Cl)C(C2C3CCCC2CN3)=O,6B24F5E6D491D86C_6AD4D9B3F8C004F8_6038_DP,7.7200584,00000000000000000001000000000000000000000010000000000100000000000000000000000000101100010011100011001001110100110000011001000000110100100110001011010011011110100111110,VTKXDIIYYQAPAK-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)I)Cl)C(C2C3CCCC2CN3)=O,819F9BD1C1D61A89_822B725BAFE34017_6038_DP,7.7200584,00000000000000000001000000010000000000000000000000000100000000000000000000000000101100010011100011001001110100110000011001000000110100100110001011010011011110100111110,CLGJKFIKJYCUIT-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)Br)F)C(C2C3CCCC2CN3)=O,48FB1A7FACB95DE3_22B8762918684BAC_6038_DP,7.720058,00000000000000000001000000000000000000000010001000000100000000000000000000000000101100010011100011001000110100110000011001000000110100100110001011010011011110100111110,PWHSNRYIGRUOBS-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)Br)Br)C(C2C3CCCC2CN3)=O,7FCFD50BFE7DB081_BDB8136525A728B8_6038_DP,7.7200584,00000000000000000001000000000000000000000000001000000100000000000000000000000000101100010011100011001000110100110000011001000000110100100110001011010011011110100111110,GGOKSSCMEWWIRW-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)F)Br)C(C2C3CCCC2CN3)=O,0AD7522E958F144A_433CF4A4A947366D_6038_DP,7.720059,00000000000000000001000000000000000000000010001000000100000000000000000000000000101100010011100011001000110100110000011001000000110100100110001011010011011110100111110,QHCOGMBLNXFVJO-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)Cl)F)C(C2C3CCCC2CN3)=O,ED99BD4722A254FF_0517D8F5AD0E48A6_6038_DP,7.720044,00000000000000000001000000000000000000000010000000000100000000000000000000000000101100010011100011001001110100110000011001000000110100100110001011010011011110100111110,NBSLNCXJCALPJN-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C[N]2C=C(C=N2)NCC3N(C)CC4(CC3)CCC4)F,571D74B2700F063A_54B4F4150253870F_6041_UN,8.007117,00000000000100000000000000000000000000000010000000001000000000000110000000010001101101110011011010101000010110011001101011101100110001110110001011011011010110101111010,ALBGQRSZYXVUCN-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)N[C@H]4[C@H](C3=C(C)[N](N=C3)C)OCC4,22FAE923D00E4DF5_5BBE9712164E2F1E_6041_UN,7.99061,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111000100110101010000001011101100010011110100001010011111110011101111110,RAPFGRKSCGXGOX-MSOLQXFVSA-N
C1CC(CNC1)C2=CN(C=N2)CC(C)(N)C3=CC=C(C=C3)Br,EF9281837709B684_7AE79C47DE29EC6A_6034_UN,7.9558578,00000000000000000000000000000000000000000000001000000000000000100110000000010101101111110011000010101000100100011001001011100100110100100110001001011001010110101111010,XTNDYCQDPSEZKY-UHFFFAOYSA-N
NCCC(OC2=CC=C([C@@H]1[C@H](C)CCNC1)C=C2)C3=CC=C(C=C3)Br,71A7A83DB4A15827_DF341A96078E73FC_6035_UN,8.150646,00000000000000000000000000000000000000000000001000000000000000100000000000000000001010110001000001101000100100010101101001000111110110100110001101010011110101101111110,KAOWMKCGTXYRRH-GZOQVGHDSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCNC3(C2)CC3)F)CC4,CBA128958BE5FD6B_3C28C10ED7FE1593_6041_DP,7.520393,00000000000000000001001000000000000000000010000000000100000000000010000000010001101001110011010000101000110110011001101011100000110101110110001011011011010110101111010,BRPKQYGNOWZVAF-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC34CC(CC)(C3)CO4,6730D7A63E4C7CDB_E24E3D25A2F0E539_6041_UN,7.2831225,00000000000100000000000000000000000000100000000000000000010000000110000000000100001100000011000110101100010011001010100011000100110011010110011011000111110111101111110,SPRFNMJRSTXBGZ-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(CC3=C(C=CC(=C3)C)F)=O,F2272B1C38DA5AAE_05AFB1501543ABCA_6038_UN,8.077066,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011000110110110000011000000000110010100000000011010011011110101111110,BESVYTZEPYQBIY-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2CCC3(CC2)OCCOC3)F,45795AB5A010952F_98485101A22B66DA_7022_UN,7.6762443,00000000000000000000000000000000000000000010000000000000010000000010000010100000000001110010010000101000110101011001001010100000110011110110001011011111110111111111110,FSAWWPFCEXZENY-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2CC2)NC[C@@H]3[C@H](C(C)C)CCO3,B6FBA20EEAB0CA39_2870F2B2E635347C_6041_UN,7.9850283,00000000000000000000001000000000000000000010000000000000010000100000000000100000001100010001000110001000000111000000101000000000110011110110000010010111110111101111110,IJUSTKDDOIWUNG-WMLDXEAASA-N
C(C1=CC(=NO1)C2CC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,BB70347083E3C404_EAE75543DCEC0A4E_7019_UN,8.4201565,00000000000000000000001000000000000000000010000000000000010000100100000100000000000101010000011011010010000110010000101011101100010001110100001010011010100010101111110,XTZQQDABGSBORM-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC(=C2)NCCC3CCCN(C)C3,5570077F1AEBC361_27EDADA3118270A6_6041_UN,8.403796,00000000000000000000000000000000000000000010000000000000000000000100000000010000001101110001010010101100110110010001101011100100110101110110001001011001010110101111010,GHNNAWPQHCKGHX-UHFFFAOYSA-N
C(CN1C2CCC(C1)C2)=CC3=C(C)[NH]C4=C3C=C(C=C4)Cl,0B2D622D15164DC4_496E379D94D7A197_7019_UN,8.582995,00000000000000000000000000000000000000000000000000000000000000000100000000010000000101110000000010111101010100010000001011100100110000100110001011011011010110101111010,MKCCTKGEHLUZIY-UHFFFAOYSA-N
C(CN1C2CCC(C1)C2)=CC3=C(C)[NH]C4=C3C=C(C=C4)F,F50C1ACC941EE592_93B297EA1B15A6F1_7019_UN,8.582997,00000000000000000000000000000000000000000010000000000000000000000100000000010000000101110000000010111100010100010000001011100100110000100110001011011011010110101111010,URVSZULCRMHVAD-UHFFFAOYSA-N
CC1=CC=C(C#N)N1CC(N2CCNCC2)C3=CC=C(C=C3)F,4B5CEA2AC2721FC3_B010528EF4D0577C_6034_UN,7.786794,00000000000000000000000000000000000000000110000000000000000000000100000000010001001101110001000010101000100100010000101011100100110000100110001011011011010110101111010,FGUDDODEDMEVKW-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC4=CC2=C([N](C)C(=N2)C3CC3)C=C4)C5CC5,873E9E1E183B6BA4_1775F2AFE9C0897B_6041_UN,8.199608,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101010001010010000100010110000000001011100100000001110100001011011011000010101111010,BLLFMHQDOXWCNN-UHFFFAOYSA-N
CC1=CC=C(C#N)N1CC(N2CCNCC2)C3=CC=C(C=C3)Cl,613B3F7637169D17_C18C6C214516774E_6034_UN,7.786789,00000000000000000000000000000000000000000100000000000000000000000100000000010001001101110001000010101001100100010000101011100100110000100110001011011011010110101111010,GJMVEARNXDYHAY-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)NC[C@H]4[C@H](C3=NC=C[N]3C)OCCC4,8A2680FD24E9A5C6_277C34ED5C37BCF2_7022_UN,7.3377566,00000000000000000000001000000000000000100110000000000000010000100110000000010101001101010011010111101000000101001000001011100100110011110110001011011011110111101111110,HVVZIMDFTHIMCE-KBXCAEBGSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NC2=CC=C(C=C2)C3=NC=C4CCCC[N]34,7FF055A03DADF843_07E202017D6A91D1_6041_UN,8.10453,00000000000000000000100000000010000010100000000000000000000000100100000000100101010101101000010010101100010000011000001011100100110001010100011011011111010010101111010,MJMHWEPRBDUBRA-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC=C2NC(CC)C3CCCCCC3,EE0FD901291BE364_2A6955A3E51C1332_6041_UN,7.966151,00000000000000000001000000000000000000000010000000000100000000000100000000000000100100010011000010000100110110010010001001000100110101110100001010010011000110101111010,LWITZDAAKKPFHB-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CCC2CCCO2)C=CC(=C3)Br)C4,F6E1B4CF359374F9_B0EB6A2D6EE7176A_6034_UN,7.506232,00000000000000000000000000000000000000000000001000000000010000000110000000110000000101010000000011001100010101011001101011100100110010100110000011011100110111101111110,LVAFNLWJEBBPOK-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)C3=C[NH]C4=C3C=C(C(=C4)Br)Br,6536EBA59E8F670C_A0436D0849975C98_6038_UN,7.3405557,00000000000000000000000000000000000000000000001000000100000000000100000000000000101100010011100011001100010100100000011001000100110100100100001011010011011110100111110,ONRPRUWFFBSPAD-UHFFFAOYSA-N
N(CC12CCC(CC1)O2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)Cl,15337BA8283BAE13_8F7CA45322DC7ABE_6038_UN,7.675376,00000000000100000000000000000000000000000000000000000000010000100010000000000000001100010011100110001001010100101000011000000000110010100100000011010011111111110111110,MLUWGBOJIIXZNE-UHFFFAOYSA-N
N(CC12CCC(CC1)O2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)F,81A9D820A197508E_4099FE5BF9EA0398_6038_UN,7.6753616,00000000000100000000000000000000000000000010000000000000010000100010000000000000001100010011100110001001010100101000011000000000110010100100000011010011111111110111110,JHYCIHLLOVIFQL-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC3(CF)CCC3)C4=CCNCC4,DA855EB9B1192CB9_C3B14E5F5A72ACDA_6034_UN,8.141109,00000000000100000000000000000000000000000010000000100000000000100110000000011000001101100001000010111100110000011000001011100100110000100110001001011001010110101111010,NUOKTYFPTOXXAN-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3(COC3)C4=CC=C(C=C4)F,BDD1789AA1333F44_EA1B4AF9A244FEFD_6041_UN,7.695225,00000000100100000000000000000000000000100010000000000000010000100110000000010100100101110001010110101000100111011001101011100100010001110110001001011011010011101111110,ONKSUZPCHCZIFC-KRWDZBQOSA-N
FC2=C1C=CN=C(C1=CC=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,E10E2D1A188E3E67_B7E1153941BBA231_6041_UN,8.353876,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,LDRJLOSTBUNDBD-VFNWGFHPSA-N
FC1=CC(=CN=C1)C2=C4C(=CC(=C2)C=CC3=CC=N[N]3C(C)(C)C)OCO4,078BD597DA9C8331_CB63264CEFD96E46_7019_UN,8.16937,00000000000000000000000000001000000000000010000000001000010000100110000010110000100100010000001010110100010101001100000011111100000000100100011011001110110011111111110,AJHBRXAAEZJRQN-UHFFFAOYSA-N
NCC34CC(COC1=C(C(=CC=C1)C2CNCCC2)F)(C3)C4,CDC38D693C63237F_DB39B24292F1AF5A_6035_DP,8.252866,00000000000100000000000000000000000000000010000000000000000000100010000000000000001010110011000000101000110101011100001001000011110100100110001111010011110101100111110,MRZCZOSIMWHFNH-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CC=N2)NCC3CCCC(CC)C3,EF702795707ECD1D_40DE46725F41BD33_6041_UN,8.369902,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010011000000101100010110000010101001000100110001110100001001010001010110101111010,HAQSOLSZGLJIDU-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=NC=C2)NC4C[C@H]3CCC[C@H](N3C)C4,0F853E6748B08D26_D4DDD7D602B58077_6041_UN,8.03421,00000000000000000000000000000000000000100010000000000000000000000100000000010100100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,DPHKCTZPOAPRRJ-MQVJKMGUSA-N
CN3CCCN(CC1=C(C=C(C=C1)N[C@H](C)C2CCOCC2)F)CC3,BF28B5D5D07FB084_E3FF9AD764EBEEF5_6041_UN,7.402954,00000000000000000001000000000000000000000010000000000000010000000000000000010001100001110011010000101000000111010001101011100000110011110110001011011111010111101111110,BJBKIUQSZMXTQB-MRXNPFEDSA-N
N(CCCC1=C[NH]C2=C1C=C(C=C2)F)C(C34CCC(C)(C3)CO4)=O,96C040A87D8182F2_50CB9F191066D70B_6038_UN,8.535906,00000000000000000000000000000000000000000010000000000000010000000110000010000000001100010011100110101100110111111001111011000100110110100110001001010001111111111111110,FCVAPIDWDKEUJO-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NC4(CC3=C(C=C(C=C3)F)F)CCOCC4,85E604B334F174BF_915FB8FE37381B2C_6041_UN,8.182882,00000000000000000000000000000000000000100010000000000000010000100110000000010100100101110011010011101000100111011001101011100100110011110110001011011011010111101111110,QTRUKGKYZWMNNY-FQEVSTJZSA-N
C(C1=NC(=CS1)C2CCCCC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,BC035ACEDABC2734_3CA820A01E8D32D9_7019_UN,7.9970655,00000000000000000000000000000000000010000010000100000000000000100100000000000000010101011000010010010000000110010000101011100100110001110100001011011010000010101111010,XOEIVNHXPXLWNI-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(CC)CCOCC3)C4CCNCC4,0D5FF426BCB2A432_8907AE4179A708B8_6034_UN,8.524589,00000000000000000000000000000000000000000010000000000000010000100110000000010000001101110001000010101100110111011010101011100100110010100110001001011001010111101111110,AOBIIPYWFOQVPX-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2CCCCC2)NC4=C3OCCCC3=CC(=C4)F,70910118980B83CE_55C563D4BA40A3AD_6041_UN,8.361822,00000000000000000000000000000000000000000010000000000000010000100000000000000000000000010001000100100100010101000100001000000100110011110100000011010001110011100111110,WNYLSYTWRKXREX-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[C@@H]3NC(OC3)(C)C,01D7D74F2CC63262_C7960C4840164B68_6041_DP,8.399991,00000000000000000000000000000000000000000010000000000010010000000100000000100001001100010010100111101100110111111000110011000100000101110110011011000111110111101111110,LGZOVWPNZDJGLU-LBPRGKRZSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CC3(CN2)CCOCC3,CF7E587CED2C6044_EF79C9A398B9B191_6041_DP,7.2350907,00000000000000000000100000000010000000000000000000000010010000000110000000100001001100100011010010101000110001011000001011000000110111010110011011011111010111101111110,VCPFKWSMEVKFHT-UHFFFAOYSA-N
CC1=CC(=C(C=C1)F)NC2CC3CCCC(C2)N3C4CC4,D269E8BB50B90595_1AB6DBF1F6C30902_6041_UN,8.027434,00000000000000000000001000000000000000000010000000000000000000100000000000010000100001010001000000100100110100010000001001100000110001110100001011011011000010101111010,HLFUGQHCVPJOHV-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NCC3CCC2(CCNCC2)CC3,EBF2F2E427D00E58_FE83A961B9D5AE42_7022_DP,7.2264037,00000000000000000000100000000010000000000000000000000000000000000010000000100000001000100011010000101000110000011000001001000000110101010110011001011101010110101111010,OGAVKCZUMFYKTA-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3=CC5=C(C=C3)OC4(CCCCC4)O5,DE9BCA95DE756710_5992AC340BF9132B_6041_UN,7.6831217,00000000000000000000000000000000000000000010000000001000010000000100000010010000100100010000011011000100010100001100001011111100110011110100001011011001100011111111110,RLDRFDZJGHRDPH-UHFFFAOYSA-N
C[N]1N=C(N=C1NC2=CC(=C(C=C2)N3CCCCC3)F)C4CCOCC4,F705CC4D23310F0B_4E36A9947A585EB9_6041_UN,7.883481,00000000000000000000000001000000000000100010000000001000010000100100000000010101100101110000011010101000001101010000001011101100110011110110001011011011010011101111110,SNNREGJENZTPGH-UHFFFAOYSA-N
FC2=C(C=C1C(=NC=CC1=C2)NCC(N(C)C)C3CCCCC3)F,DD8E933B3CE50BEA_7F9766282A3DE3A6_6041_UN,7.8057714,00000000000000000000000000000000000000100010000000000000000000000100000000100101001001110001010000101100010110010000101001100100110001110100001011011111010110101111010,CEVZRXSNYOZSRA-UHFFFAOYSA-N
N([C@@H]1CCO[C@H]1C2=CC(=C(C=C2)F)F)C([C@@H]3CC(CN3)C45CC(C4)C5)=O,DEC2590C9D01FA7A_FBAE06CBB5E6A46F_6038_DP,7.680693,00000000000100000000000000000000000000000010000000000010010000100010000000000001001100010011100111001000110101111000011011000000010111100110001010010011111011110111110,BENPPWDCIKMDQK-ROPPLMCNSA-N
CN(C1CCNC1)C2=NC(=CN=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,B45C0C722A3D30B1_310770E4E885FA76_6041_DP,8.304989,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100010101110110001001011111010010101111010,NGQXYNQQDLPESA-HXCIKOOASA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC34CC(C)(CO3)CCC4,84B9BD19B4AB6D8C_D26BBD5D0B169C3B_6041_UN,7.0950084,00000000000000000001000001000000000000000010000000000000010000000110000000010101001101010011010110001100011111001001101011100100110011110110001011011111110111101111110,ZXAIHNDELHWWRI-UHFFFAOYSA-N
N([C@@H]1CCO[C@H]1C2=CC(=C(C=C2)Cl)F)C([C@@H]3CC(CN3)C45CC(C4)C5)=O,E7726DDDDD08C2A6_CC23747CA6B53F52_6038_DP,7.6806726,00000000000100000000000000000000000000000010000000000010010000100010000000000001001100010011100111001001110101111000011011000000010111100110001010010011111011110111110,OMEFKUGWFBSTOE-ROPPLMCNSA-N
O([C@@H]1CCCC[C@H]1C2=CC=C(C=C2)F)CCC3CC(C)(C)OC3,51EDD79975A71916_355D7F769AED8B5D_6039_UN,7.6249733,00000000000000000000000000000000000000000010000000000000010000100010000000100000000100010000000010000000000111001001101000000011110010100110000101010110110101011011110,CWDZYZPBWQZVRY-AOWWOYQVSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCC2=CC=CC3=C2CCCN3,32F5D6F5CFD6BAA0_E85C816FF27FC143_6041_DP,7.4682236,00000000000000000000100000000010000010000000000000000000000000000000000000100000011100101011010010101100110000011000001011000100110101010110011011011111010110101111010,NPIFUMOEHKCGBE-UHFFFAOYSA-N
COC1=C(C(=C(C=C1)Br)F)NC2C3CC4CC2CC(C3)(F)C4,9361419D48D86931_F741B6C9328C836D_7022_UN,7.6130495,00000000000000000000000000000000000000000010001000000000000000000010000000000000000000010010010100000100010100001100000000000011100001110000000111000011100011101111110,LFIOJLZKXUJKDE-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)N[C@H]3[C@H](C2=C([N](N=C2C)C)C)OCC3)C#N)F,94EB0ABDBC779C8B_D48DB7514B22469D_6041_UN,8.106698,00000000000000000000000000000000000000000110000000001000010000100100000000010000100100010011011111000000100101010000001011101100000011110100011010011111110011101111110,YUVCMHFRBVONBU-RHSMWYFYSA-N
CN(C)CC1=C(C=C(C=C1)NC2CC3(CC2)CCCCC3)F,7E3B8BC19076203C_A9085E48477EE3D0_7022_UN,7.704011,00000000000000000000000000000000000000000010000000000000000000000010000000100000000001110011010010001000110100011001001000100000110001110000001011011111010110101111010,WBPOODKYPKXRFP-UHFFFAOYSA-N
O(CC2CCOC1(CCC1)C2)CCCN3CCN(C)CC3,AF6BAFD4E7304BCC_0381CC4F432C19C0_6039_UN,7.138488,00000000000100000000000000000000000000000000000000000000010000000010000000010001000001100000010001101000010001011001101011100010110010000110001001011000110101111101110,KEHAKAIBMPTWPR-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3C4=C(CCO3)SC=C4,D506BD6D4074A455_0EF97B8CF2E467DD_6041_UN,7.4323583,00000000000000000000000000000000000010100000000000000000010000000100000000000100011100001001000110101100010011000000001011000100110011010110011011010111110111101111110,RMCYMUHMVJHGAN-UHFFFAOYSA-N
C1(=NC(=NO1)C2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,BCC06FF62588CD94_895167ADD330B61F_6041_UN,8.334648,00000000000000000000000000000000000001100010000000000000010000100100000100010101100101110011011111101010101111110001111011101100110011110110001011011011010011111111110,HEFHDEPGKHSCQA-CVEARBPZSA-N
C1(=C(C=CC(=C1)F)OCC2=CC=NC=C2)NC[C@H]3C4CCC([C@@H]3C(F)(F)F)CC4,88AA9C270A15B8EE_EED1958DBEB72D4D_7022_UN,7.8641477,00000000000000000000000000000000000000000010000000000000000000000100000000000000001000010001000100101000011101001100001001000111110001110110001111010011110111100111110,KPVCOIMNPCGQGA-ODLMNGIJSA-N
CC(C)C1=C(C=C(C=C1)NC2CCN(C)C23CCCNC3)F,D9C605423678E469_29E95C785913F926_6041_DP,7.7468176,00000000000000000000000000000000000000000010000000000100000000000010000000110001101101110011010010101000110110011001101011100000110101110110011011011111010010101111010,ZHDKNOSQFRYUDC-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=NC=C3)NC5(CC4=C(C=CC=C4F)F)CCCCC5,75D8BA097AEB527F_6132F65BBEB550AE_6041_DP,8.552103,00000000000000000000001001000000000000100010000000000000000000000110000000000100101101110011010010101000111110011000001011100100110101110110001011011011010110101111010,KXPVFPDKGVBUMU-QRTHJKPMSA-N
C[N]1C(=NC2=C1C=CC(=C2)N[C@H]3[C@@H](OCC3)C4=C[N](N=C4)CC5CC5)F,35FE0F06F9CF6426_1CFE7EB8ACB95FEA_6041_UN,8.032012,00000000000000000000001000000000000000000010000000001000010000100100000000010101100101010011011111001100111101010000001011101100010011110110001010011011110111101111110,VQFGKXFPWCADAN-QAPCUYQASA-N
ClC1=CC2=C(C=C1)C=C(C=C2)[S](=O)(=O)NCCC3CC4CCC3O4,4F3917E955051BCC_B8C58CA29F0AC979_6026_UN,7.764633,00000000000000000000000000000000110000000000000000010001011111001001010001000000011100011001001010001111111100011000011000001100111010101100000001111001110111110111110,ZLCXKFKADZUNAG-UHFFFAOYSA-N
C1(=CC2=C(N=C1)[NH]C=C2C3CCC3)NC5=CC(=C(N(C)C4CCCCC4)C=C5)F,39F6ED2161975E8B_3DB52D4AB4BE53BC_6041_UN,7.896447,00000000000100000000000000000000000000100010000000000000000000100100000000000101000101010001010010100100010110010000101011100100110101110100001011011011000010101111010,MFZKGTXSAXXTFQ-UHFFFAOYSA-N
C1(=CC2=C(N=C1)C(=CC=C2)F)N[C@@]45[C@@H]3OC(C)(O[C@@H]3[C@@H](CC4)C5)C,636F1F4C553D640D_0CC68E3CBF344636_7022_UN,7.375214,00000000000000000000000000000000000000000010000000000000010000000110000010100001000100010011000111100100110100011000001011010100010001110100001001010101100011111111110,UIMKQLHJHGGJLN-CLOTWAHHSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@H]3[C@@H](CCNC3)C4=CC=C(C=C4)F)Cl,04011F58ECD8C436_19F5FCCA005107F6_6034_UN,7.374282,00000000000000000000000000000000000010000010000100000000000000100100000000010110111101111011000010101001101100010000001111100100110101110110001011011011010110101111010,XLRXGNCZTILMKE-RXVVDRJESA-N
O(C(=O)C1C2CC1(CC2)C3=CC=CO3)C[C@@H]4CC=CC[C@H]4C(F)(F)F,48F1C1F699C4B34A_6FC6DB503D468732_6031_UN,8.148933,00000000000100000000000000000000000000000010000000000000010000100010000000000000000100000000000010010000011101001000001000010010110000100100000000110010111101010011110,NCVVVQOTIOGXLL-HTKPNPNBSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NC[C@H]3CCS[C@H](C)C3,F961C1C4D6912CD0_20C961C4E5E99803_6041_UN,8.478608,00000000000000000000000000000000000010000010000000000000000000000100000000000000111000011011000000101100010110000001101011000100110001110110001011010111010110101111010,JLNFJUVLWBYVTQ-YPMHNXCESA-N
C(C1CCCCC12CCC2)=CC3=C([N](N=C3C)C4=C(C=C(C=C4)C)C)Cl,D6CCE8122B0FF5E3_D1F66B922FF1ED54_7019_UN,8.056198,00000000000100000000000000000000000000000000000000001000000000100110000000010000100100010000001010010001010100001000001011101100110001110100011011011110000010101111010,LDJSVOQKPYDLCL-UHFFFAOYSA-N
CC(C)C2=C1N=C(C=C(C1=CC=C2)C)N[C@@H]3C5=C(OC4(C3)CCC4)C=CC(=C5)F,19D4ABE2BB1E9B23_4C48159F75A910C2_6041_UN,8.292607,00000000000100000000000000000000000000100010000000000000010000000110000000100100000000010001000001100100110100011100001011000100110011110100011011010101100011101111110,CSBRLLSAFMDDFH-NRFANRHFSA-N
N1CCC4(CC1)CCC2=C(C=CC(=C2)NCC3=CC(=C(N(C)C)C=C3)F)O4,3DEDC687F679A92B_048C2EF39C2A6D88_6041_DP,7.1149416,00000000000000000000000000000000000000000010000000000000010000000010000000100000001001110001010001101100110100011100001011100100110111110110001011011111110111101111110,ZOPKHOYIAAGICJ-UHFFFAOYSA-N
CC#CC1=CC(=CC=C1)NC[C@H]2C3CCC([C@@H]2C(F)(F)F)CC3,41D25FF2DC457328_916CFECF470743CB_7022_UN,7.612448,00000000000000000100000000000000000000000010000000000000000000000000000000000000001000000001000000001000011100001000001000000000110001110000000001010011010110101111010,CSDHFYCYKXWIOP-RLNQZENFSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3C4(COCC3)CCCC4,1D7C15829AFC92A2_A2BBF9C53D0DF0AF_6041_UN,7.3360977,00000000000000000000000000000000000000000010000000001000010000000110000000010000101100110011011010101100010101001000001011101100110011110110001001011001010111101111110,UHSFENHMEBAXII-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F)F)C#N,C0A6C2CA2EAE80ED_D943E0C4F6734FC0_6041_DP,7.7093635,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010101111010,OFMHGKKLFPZBFS-CRAIPNDOSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NCCC2CCCCN2,560FCDBCB64B6EB0_4782400ADE2C5056_6041_DP,8.151677,00000000000000000100100000000010000000000000000000000100000000000100000000100001101000100011010000101000100000011000001011000000110101010110011001011101010110101111010,XFQNRCVXYNJAKF-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(CCC)CCCN3C)C4=CCNCC4,24F5EA119FE3F1C0_3F3997AF8FF8D921_6034_UN,8.304002,00000000000000000000000000000000000000000010000000100000000000100110000000011001001101110001010010111100110110011011101011100100110000100110001001011111010110101111010,PWZHNDGWGFLFNP-UHFFFAOYSA-N
CN1CCC2=C1C=CC(=C2)NC3=CC4=C(C(=C3)Cl)OCCCO4,42E61210C6DDFF7F_69B8D182E1F5CD99_7022_UN,7.0713067,00000000000000000001000000000000000000000000000000000000010000000000000010010000000101110101010011001101010111010101101011100100000011110110001011011001110011111111110,MDPDDZZGRMDJFH-UHFFFAOYSA-N
CN1CCNCC1C2=NC=CN2C[C@H]3[C@@H](CNC3)C4=CC(=CC=C4)F,6033D3AB97C0AF20_90FD80406BF928FE_6034_UN,7.5051155,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100100010001101011100100110100100110001011011011010110101111010,YOQSMDLQKTWIRE-LUIZSJORSA-N
FC2=C1C=CC=C(C1=CC=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,5DE0C82EEF3D5A5D_D0461B099A1FFBDD_6041_UN,8.16102,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,YAUVATDLSATFMF-MWTRTKDXSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NC3CN(C)C4(C3)CCOCC4,C642E93ABB2D50D7_588FC1BE4E9A94B5_6041_UN,7.634979,00000000000000000000000000000000000000000010000000000000010000000110000000010001100101110001010011101100110111011001101011100100110011110110001011011111010011101111110,WOZFIDHRIFAKJF-UHFFFAOYSA-N
C2(=C1OCCC1=CC(=C2)CC#N)NC3=CC=[N](C=C3)=O,2C696F1856CFAF35_D4F85716BBB94C7E_6041_UN,8.116998,00000000000001000000000010000000000000000100000001000000010000000100000100010000100100000001001110100110010001010100001011101101100011010100001111011001110111110111110,PGRWUAPUIUAYBL-UHFFFAOYSA-N
CC1=N[N](C(=C1)NC2C3CC4CC2CC(C3)(F)C4)C5=CC=C(C=C5)C,DB2AAC7B4AFE0137_BD60A7FDCC81BB20_6041_UN,7.935743,00000000000000000000000000000000000000100010000000001000000000100110000000010101100100010010001010000100010100001000000011101100100001110100001011001111000010101111010,DUFHBHTZRZUWOC-UHFFFAOYSA-N
NCC23CCCC(CN(CC1=CC=CC=C1)C2)C3OC5=C(C=C4C=CC=CC4=C5)Br,7E645C216E4002B0_E9A2854B0A5D8251_6035_UN,8.235105,00000000000000000000000000000000000000000000001000000000000000000010000000010000101011110011000001101100010100001100001001100111110000100110001111011011110101100111110,VQAQUUYACNMTFI-UHFFFAOYSA-N
FC2=C1C=CC=NC1=C(C=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,34C718E875999490_6BE51B17FB385FF8_6041_UN,8.027117,00000000000000000000000000000000000000000010000000000000000000000100000000000001100001110010010000101100010110010001101001100100110001110100001011011011010110101111010,ZMQKOSALTPGLHS-UHFFFAOYSA-N
CC1=C(N=C(N=C1)NC[C@H]2CNCC(O2)(C)C)C3=C(C=CC=C3)F,77FFE8A1279AE6A0_D7CC96F7FEDD0CC5_6041_DP,7.913021,00000000000000000000000001000000000000000010000000000100010000100110000000100100101000110010000100101000001110001001000011000100100111110110011011000111110111101111110,ISPYCVOQDMGTTB-CYBMUJFWSA-N
O(CC2CCOC1(CCOCC1)C2)CCN3CCN(C)CC3,FA1709AEF45A3F56_B3970F9F12D52E5F_6039_UN,7.043757,00000000000000000000000000000000000000000000000000000000010000000010000000010001000001100100010100101000010001011001101011100010110010000110001001111000110101111101110,WXMJBSCPQAMYHC-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CN=C2)NCC3(CCOCC3)C4=CC=C(C=C4)F,508284130BBB4F32_63B3E071D5EFBF9E_6041_UN,7.4375973,00000000000000000000000000000000000000000010000000000000010000100110000000010001101101110011010010101100010101001000001011100100110011110110001001011001010111101111110,UJBKELFDOBZKME-UHFFFAOYSA-N
BrC1=C2C(=CC=C1)C6=C(N2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5)CCNC6,E73F1B5D1AAB5823_F0713E221623B26C_6034_UN,8.3341465,00000000000000000000001000000000000000000000001000000000000000100100000000010101101101110001010010101100110100010000001011100100110001100110001011011011010110101111010,BLNLJEJFZMKNDQ-MWTRTKDXSA-N
FC1=C2C(=CC=C1)C6=C(N2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5)CCNC6,B3284A016DA0369D_846846B25CBA096A_6034_UN,8.334141,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101110001010010101100110100010000001011100100110001100110001011011011010110101111010,PWXCRNLYVBRPKI-MWTRTKDXSA-N
CC(C)C1=N[N](C(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C,7D654CAE993B00D4_ACFE3B4FCEDB4CB3_6041_DP,8.45838,00000000000000000000000000000000000000100010000000001100000000100100000000110101101100110011011010101000100110010000001011101100110101110110011011011111010110101111010,JPUBEKHWORNEOU-DOTOQJQBSA-N
CCC1=CN(C2=C1C=CC(=C2)Br)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,5FC7518A408A14A3_015B34B97E590E84_6034_UN,7.987051,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010010001011100100110001100110001011011110010110101111010,DGALRCPEHWYXAV-HXOBKFHXSA-N
C[N]1N=C(N=C1N[C@@H]2C3=C(CC2)C=C(C=C3)F)C4CCOCC4,9CA4687CCC3F9E45_B391AA390E154F1C_6041_UN,7.8712473,00000000000000000000000001000000000000100010000000001000010000100100000000010101100100110011011010100100111101010000001011101100110011110110001011011011010011101111110,LBORAZPHFPBWII-HNNXBMFYSA-N
CC1=C(C3=C(C=C1)N=C2CCCCC2=C3NC(CC)C5CN(CC4=CC=CC=C4)CCO5)F,912DA7EE46984B52_8B3D7EB524DFF328_6041_UN,7.9305596,00000000000000000000000000000000000000000010000000000000010000000100000000010000100001110011000100101100110111010010001011100100110011110110001011011111110111101111110,SVFULZRPLHYKCW-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC[C@H]2[C@@H](C2)C3CCOCC3,280BC2D78ED6C722_998DF9135DD05E02_6041_UN,7.7012844,00000000000000000000101000000010000000000000000000000000010000100100000000100001001000100011010000101000000001001000001011000000110011010110011011011111010111101111110,XQMQYABXPTYKTM-GJZGRUSLSA-N
C([C@]12C[C@H]1COC23CCC3)=CC4=C[N](C)C5=C4C=CC(=C5)Cl,9CD4609208367D43_436E9D43254BA18D_7019_UN,8.08313,00000000000100000000001000000000000000000000000000000000010000000110000000010000000101010000010010110101010101001000001011100100110010100100000001011000110011101111110,RICAWMCKRMCDLB-KSSFIOAISA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NCC3(CCCO3)C4CC4,8EC7BD49575A6997_A92632BF047A48BF_6041_UN,8.152164,00000000000000000000001001000000000000000010000000000000010000100110000000010101001101010011010110001100011111001000001011100100110011110110001010011011110111101111110,UWLBZBAORUYQAW-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)C2OCCO2)NCC3N(C)CC4(CC3)CCC4)C#N,C43C6C9786CDF4F0_0112B59DFD106E05_6041_UN,7.3433676,00000000000100000000000000000000000000000110000000000000010000100010000010010001101101110011010011101000010111011001101011110000110011110110001011011011010111111111110,LOIHDILTNQQYLG-UHFFFAOYSA-N
NCCC1(C2=C(CC1)C=CC=C2)OC3=C(C=CC(=C3)C4CNCCC4)F,68196154DF9931BA_3B69C4D0E6745543_6035_UN,8.313472,00000000000000000000000000000000000000000010000000000000000000100010000000000000001010110011000011101100110100011100001001000111110110100110001111010011110101100111110,QDCJQSQNFGNKKV-UHFFFAOYSA-N
CN(C1CCNC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=C(C=C(C=C4)F)F,67601B63F2FC544E_6F42936E191C3A8D_6041_DP,8.450502,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000100110010000101011100100010101110110001011011011010010101111010,NIMHDCOMUAAOLC-OTZYVQGASA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC(CC)C3CCOC3,55F1911258546B8C_44FB1476D6580D68_6041_UN,7.8356853,00000000000000000000000000000000000000100010000000000000010000000100000000000100000100110011000011100100110111010010001011000100110011110110011011010111010111101111110,ZDBOMRVMISLACE-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2=CN(C(=N2)C3CCCN3)C[C@H]5N[C@H]4CCC[C@H]4C5,98241C699BECD10E_AAEF2E491145F48E_6034_UN,8.455135,00000000000000000000000000000000000000100010000000000000000000100100000000010101001101010011000010001100110100010000001011100100110100100110001010011011010110100111010,UYABMNYLJABZFU-PYUTUISCSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,CBFD0001ACD5C245_C8AEF92B216486D8_6041_UN,7.8967953,00000000000000000000001000000000000000100000000000001000000000100100000000010101101101000011011010101100010010010000001011101100110001010110011011011111010110101111010,DIWXUCWNQPREOH-DVECYGJZSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)N[C@H]4[C@@H](C4)C5=CC(=C(C=C5)F)F,D87C9BA49343CBB1_66BCCA57D4AE64BA_6041_DP,8.384976,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000110110010000000011100100110101110110001011001011010010101111010,SLYNUJCUNKLSBN-SHEPXDLSSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,4FB92F73747B046E_0AE902FA246251A5_7022_DP,7.8840218,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101001100100010000001001000100110101110110001011010011010010100111010,VKMYPUZFRAXPQN-CXAGYDPISA-N
CN(C1CCCNCC1)C2=NC=C(N=C2)N[C@H]3[C@@H](C3)C4=C(C(=CC=C4)F)F,9FD127D553C80F82_A2699AB38022991E_6041_DP,8.297904,00000000000000000001001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010000101011100100110101110110001011011011010010101111010,ITVXGTQSJUMWPT-BOBJKBKNSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)NCC3[C@@H]4CNC[C@H]34,980E597A1677D14E_16187AA5966D560C_7022_DP,7.889584,00000000000000000000001000000000000000000110000000000000000000100010000000000000001100110001000010101000010100001000000001000000110101110110001011010011010110100111010,DCYFLPFAKBRXSV-FUNVUKJBSA-N
FC1=CC4=C(C(=C1)C=C[C@@H]2CCO[C@H]2C3=NC=C[N]3C)OC(OC4)C5=CC=CC=C5,36FEC10B687D647F_3E86654054E02967_7019_UN,8.088157,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010100010110110100010101000100001011110100000010100110001011111010110011111111110,SEWADHYVIKWKTA-DNMZKOJWSA-N
N1CCC3(CC1)OC4(COC2=C(C=CC=C2)OC(F)F)CC3(N)C4,3134453EC1B322C2_5105C11E6323BF27_6035_DP,7.804628,00000000000100000000000000000000000000000010000000000000010000000010000010000000001110100011000111101000111101011100001011000011110111100110001111110011110111110111110,RFRFLXDLBPAMIV-UHFFFAOYSA-N
C1(=NC=C(C(=C1)C#N)OC2CC2)N[C@H]3[C@@H](C3)C4=CC(=C(C(=C4)F)F)F,CDA81E3E6BDA526F_E54211B939A6F851_6041_UN,7.883806,00000000000000000000001000000000000000100110000000000000000000100100000000000100000000010010000101100000100100010100000001000111000011110100001111010011100011100111110,RDJNITZWRSZQJF-SWLSCSKDSA-N
CC1=C[NH]C2=C1C(=CC=N2)NCC3CCCN(C)C3C4=CC=CS4,2E8B1D9F37B84BCE_9F504922290EFA6F_6041_UN,8.473102,00000000000000000000000000000000000010100000000000000100000000100100000000010100111101101011010010101100010010010001101011100100110101010110001001011111010110101111010,ZSZHODIWHZDMBE-UHFFFAOYSA-N
FC2=C(C=C1C=C[NH]C1=C2)NCC4CC3(CCN3C)C4,C352806417E1BB36_DFEC916BA7ACD565_6041_UN,8.104021,00000000100100000000000000000000000000000010000000000000000000000110000000010000001101110010010010001100010100011001101011100100110101110110001010011011010110101111010,ZNAPKQOBHRWDRK-UHFFFAOYSA-N
N(CC1=C2C(=CC=C1)CCCC2)[S](C4=CC3=C([NH]C=C3)C=C4)(=O)=O,11790E804E9E73A8_D63FDD009396807E_6029_DP,8.983151,00000000000000000000000000000000110000000000000000010001001111001101010001000000011100001001001010001110011000001000011001001100111100001100001011011001010110110111110,NPYYITFWJWMNLW-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NC2=N[N](C)C(=C2)C3CCOCC3,6EDD59A9505340E8_69C99DE93DDDE06B_7022_UN,8.466932,00000000000000000000000000000000000000100010010000001000010000100100000000010101100100110000011010110000000111000000001011101100110011110110001011011011010011101111110,VEKIWHYIOKUJRW-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(CCCCC2)C3=C(C=CC=C3)Cl)Cl)C4CC4,E8BDBB1CF28E3A43_E375F54428706ED7_7022_UN,7.9429307,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010011000000001001000110001000001000000100110001110000000011010011010110101111010,NXJDLYSIZCMNLB-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCCOC2(C)CCOCC2)Cl)C3CC3,88EED4B19921485E_608C5BD2CBD3CE7A_7022_UN,7.939304,00000000000000000000001000000000000000000000000000000000010000100010000000000000001000110100000100101001100111011001101000000011110011110110000111010111110111111111110,NPZZAMXEHWACKA-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(CCCCC2)C3=C(C=CC=C3)Br)Cl)C4CC4,6D09F3C8E9EEFDE9_16AAE551D3F6B10A_7022_UN,7.942916,00000000000000000000001000000000000000000000001000000000000000100010000000000000001000010011000000001001000110001000001000000100110001110000000011010011010110101111010,VQHZUFCVZBLOQO-UHFFFAOYSA-N
FC1=CC(=CC(=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)C[N]4C=CN=C4,C0F82C6566EEEBFE_CBB957378FC66DD0_6041_UN,8.533571,00000000000000000000000000000000000000000010000000001000010000100100000000010101101101110001011110101000000111010001101011101100110011110110001001011111110111101111110,LLRGJPFDMXNCNB-PMACEKPBSA-N
N(CC23CC1CC(CC(C1)O2)C3)[S](C5=CC4=C(N=C(Cl)C=C4)C=C5)(=O)=O,83454C4DDC076726_F8752C9BBB326841_6029_UN,7.617422,00000000000000000000000000000000110000000000000000010001011111001111010001000000011000011010001100101111011100001000010011001100101010101100001001101001110111110111110,RIUIUWNFSIKMNA-UHFFFAOYSA-N
O(CC2COC1(CCCCC1)O2)CCN3CCN(C)CC3,4960E15E425793BE_20C7942C9A088A8C_6039_UN,6.8606734,00000000000000000000000000000000000000000000000000000000010000000000000010010001000101100100010110101000010001011001101011110010110010000110001001111000110101111101110,ANHHXFJQKXELSR-UHFFFAOYSA-N
CCOC(OCC)C=C(C(F)(F)F)C2C(C1=CC=C(CC)C=C1)CCNC2,1B2C4D8F134C924B_66C57CDD39C4ED31_6009_UN,8.60091,00000000000000000000000000000000000000000010000000100000000000100000000000001000001000100001000000111000101101011010001001010010110000100110010001010111010101111111110,ZBRJZXKUZDIZRU-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCCC3)C4=C(C=CC=C4)F,7D0A6F4BAC2112F7_EB71247EABC6C81D_6041_UN,7.4608836,00000000000000000000000000000000000000000010000000001000000000100110000000010000101100010011011010001100010100001000001011101100110001110100001011011011010110101111010,FEOVHLGKFBKYMC-UHFFFAOYSA-N
CN4CCN(CC1=C(C=CC=C1)NCC2C(F)(F)C23CCCC3)CC4,FC476A0CC1E66476_AFCD7BA0523348AD_7022_UN,7.5562954,00000000000000000000001000000000000000000010000000000000000000000010000000010001101001110011010010101000010100011001101011100000110001110110001011011011010110101111010,TYPQEZLATGJWQT-UHFFFAOYSA-N
C[Si](C)(C)CCOC[N]1C=CC2=C1N=CC=C2NC(C3CNC3)C4=CC=C(C=C4)F,F0174226C19CF309_D99A3AEB294054AC_6041_DP,8.1432,00000000100100000000100000001010000000100010000000000100000000000100000000110100101101110010010011101100010101101001111011100110010111110110011001011101010111101111110,YOTSVNPQPKPPMX-UHFFFAOYSA-N
NOCC1=C(C=C(C=C1)F)NCC2(CCOCC2)C3=CC(=CC=C3)F,832DBE1B59F6E337_B6D20FFAEF5FD5B7_6041_UN,7.646852,00000000000000000000000010000000000000000010000000000000010000100010010100000000001010110011001001101010100101011000001000001110110111110110001011010011010111110111110,AGVZYMSPIDQHSL-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC(CC)C3CCCO3)F,FB4B9E08EFACCE27_448F55A6370B087A_6041_DP,7.832899,00000000000000000000000000000000000000000010000000000000010000000000000000000000001100010011000110101100110111010010001011000000110111110110001011010011110111101111110,NHVXDYKZMHLVCG-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)N[C@@H]4CCN(C3CC3)[C@H]4C5=CC(=C(C=C5)F)F,B6EF66C6188AEA35_7FA42E99D990A9FA_6041_UN,8.734918,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101010011000010101100110100010000001011100100110001110100011011011111010010101111010,JKVRPRHFRWXVQV-VWNXMTODSA-N
FC2=C1[NH]C=CC1=CC(=C2)NCC3CCN(C(CC)C)C3,6FF842C077EA1C92_AAB26A7EA8C84A09_6041_UN,8.408203,00000000000000000000000000000000000000000010000000000000000000000100000000010000101101110011000010001100010110010011101011100100110101110110001000011101010110101111010,YENVVSKRMIJACP-UHFFFAOYSA-N
FC2=C(C=C1C=CN=CC1=C2)NC3=CC=CC(=C3)CC4CCCN(C)C4,EC6ED2CAB564CDB8_352C504ADE5F8A22_6041_UN,8.047218,00000000000000000000000000000000000000000010000000000000000000000100000000010000000001110001010000101100010110010001101011100100110001110110001011011011010110101111010,NEZAPEKPXFZQAC-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@H]3CNCC(O3)(C)C)Cl,702E964372E31AEF_36C9EA1AD54B58BA_6034_DP,8.4074745,00000000000000000000000000000000000010000000000100000000010000000110000000110110111101111011000110101001001110001001000111100100100111110110011011001111110111101111110,JDFHANKHDGFBOC-CQSZACIVSA-N
O(CC2COC1(CCCC1)O2)CCCN3CCN(C)CC3,D2D2D4373A6E7B97_990C04537D4370F1_6039_UN,7.092037,00000000000000000000000000000000000000000000000000000000010000000000000010010001000101100100010011101000010001011001101011110010110010000110001000111000110101111101110,RLEDXUMKBYNJHQ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NCC2(C)CC=CCC2)C3OCCO3,80BDB5FD8B856F24_0B34C218711C9909_6041_UN,7.4833117,00000000000000000000000000000000000000000010000000000000010000100010000010000000001100010011000010011000000101001001101010010000110011110110000011010011010111111111110,MGCDDFXNXMXTKK-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3C4CCC(C3)CC4,B2DE61555B85CDAE_A141A3ABB51BF6CD_6041_UN,8.4958515,00000000000000000000000001000000000000000010000000000000000000000100000000010101000101010011010010000100111100010000001011100100110001110100001011011011000010101111010,BUHZTOPMLDPFIK-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CC(C2)N3CCOCC3)F)CC4,F9D3D00AC35233E2_A8DEF997A3F8BB01_6041_UN,7.496072,00000000000100000001000000000000000000000010000000000000010000100000000000010001100001110001010100101000100111010001101011100000110011110110001011011011010111101111110,CKZTXYPUCOHIJZ-UHFFFAOYSA-N
ClC1=CC2=C(N=C1)N(C(=O)C=C2)CC3(N)CCC4=C3C=CC=C4,2C2C80B4C254AD53_35C5CF4BD6FBBC2D_6034_UN,8.48531,00000000000000000000000000000000000000100000000000000000000000000110000000010101000011010011100011101101110100111100011011100101110001100100001111011011011110100111110,LVFBSBYIYUGHID-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC2=NC=CN2CCN3CC(C)(C)SCC3,517C69F76FF32012_525F8F4BBB6D9450_6034_UN,8.612582,00000000000000000000000000000000000010100000000000000000000000000110000000110101011101111001000010101001000110011001101011100100110001110110011011011111010110101111010,SCMKRRNPZXXKHG-UHFFFAOYSA-N
CC1=C(C2=C(S1)N=CC=C2)NCC(N3CCN(C)CC3)C4=CC=C(C=C4)F,1F393731EA4A0F36_1A1D380843730AD7_6041_UN,8.176079,00000000000000000000000000000000000010000010000100000000000000000100000000010001111101111001010010101100010110010001101011100100110001110110001011011111010110101111010,VVXVXNLQADOYJD-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3NCCC3)CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,09CA1A8ED79C3610_93884E63F9C5F543_6034_UN,8.015327,00000000000000000000000000000000000000100000000000000000000000100100000000010101001101010011000010001101110110010010101011100100110100100110001011011111010110101111010,FOOHAJSECGDMRS-UHFFFAOYSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC3=C([N](N=C3C)C4=C(C=C(C=C4)F)F)C,7C0DF1B688DB38DA_8521033790CF95E3_7019_UN,9.015163,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010000001010010000000100000000000011101100110001110100001010011110000110101111010,BNDTWOKFAUVCCM-QAPCUYQASA-N
CC1=C(C=C(C(=C1)N[C@H]2[C@H](OCCC(C)C)CCCC2)F)F,13361D9436A24E97_0B6BDBF7659744C3_7022_UN,8.04938,00000000000000000000000000000000000000000010000000000000000000000000000000100000000000010011000100000000100101010001101000000011110011110000010111010111110111101111110,YURHYOHCKFFNFX-SJLPKXTDSA-N
O(CC2CC1=C(C=CC=C1)C2)CC3=CC4=C(C=C3)NC(=O)O4,25D4C09209607D73_85072EDD2D61699D_6039_UN,8.680866,00000000000000000000000100000000000000000000000000000000010000000100000000000000000100100000000110000100011001100100010011010111110000000110000111100001111111010111110,IAFWRASQCRFSKE-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)CCCC3=CC4=C(C=C3)OCCCO4,E0325F23593906CA_936627F3E12DDC70_6038_UN,8.208328,00000000000000000001000000000000000000000000000000000000010000000000000010010000101001100111110000101100110011110101111011100000110010000110001011111001111111111111110,VOXMHRBTQXIQOU-UHFFFAOYSA-N
CC(C)(C#N)C1=C(C=CC(=C1)NCC3CC2(CCN2)C3)F,A707C09EF21657F1_63FFBFD0848CF00D_6041_DP,7.5347095,00000000100100000000000000000000000000000110000000000000000000000010000000100000001000010011000000001000110100011000001001000000110101110110001010010111010110101111010,GFYBHBUTEFGFRI-UHFFFAOYSA-N
N1CCC3(CC1)OC4(COC2=CC(=CC=C2)F)CC3(N)C4,4F5D7612F0F4918A_0E83A2533B50A718_6035_DP,7.514633,00000000000100000000000000000000000000000010000000000000010000000010000010000000001110110011000111101000110101011100001011000011110111100110001101010001110111110111110,UTNHDHLFZNWEFH-UHFFFAOYSA-N
N1CCC3(CC1)OC4(COC2=CC(=CC=C2)I)CC3(N)C4,F797C6A5439FDCCE_B27BBAACFEF61447_6035_DP,7.5146303,00000000000100000000000000010000000000000000000000000000010000000010000010000000001110110011000111101000110101011100001011000011110111100110001101010001110111110111110,GPRJWMAADWMMHO-UHFFFAOYSA-N
N1CCC3(CC1)OC4(COC2=CC(=CC=C2)Cl)CC3(N)C4,190C433F1348C5B3_164892F1FA4DF9A1_6035_DP,7.514624,00000000000100000000000000000000000000000000000000000000010000000010000010000000001110110011000111101001110101011100001011000011110111100110001101010001110111110111110,ZCFTUCZLWKJFLT-UHFFFAOYSA-N
N1CCC3(CC1)OC4(COC2=CC(=CC=C2)Br)CC3(N)C4,BA9C39F764B99192_E39C1A3AAC168A97_6035_DP,7.514617,00000000000100000000000000000000000000000000001000000000010000000010000010000000001110110011000111101000110101011100001011000011110111100110001101010001110111110111110,ATONGOUZGKTPGX-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)F)F,263D1707B22BE1B0_A4164E000781D0D6_7022_DP,8.921436,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001111010110101111010,ULJLBDLOMSMGHM-NWDGAFQWSA-N
FC2=C(C=C1C=COC1=C2)NC[CH]4C[C]3(C[C](C)(C3)C)C4,3EB38739C00E7FEE_0CC43768AA09FBC0_6041_UN,7.8486176,00000000000100000000000000000000000000000010000000000000010000000010000000100000001100010010000010001100010110001001000000000100100001110100000010000111110110101111110,MGKZMLCZPQJCPZ-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2=CC=C(C=C2)COC3CCOCC3,E2F19F96D6546CA1_71744A522E73AEB1_6041_UN,7.7944374,00000000000000000000100000000010000000000000000000000000010000000100000000100001001000100100010000101000000001001000001011000111110011010110011111011111110111111111110,ZWYASESIOFFYJE-UHFFFAOYSA-N
CC(NC(=O)CC1=C[NH]C2=C1C=CC(=C2)F)C3C4CCC(C3)C4,5327AB55BBB49853_F6B74AF00C2A0B7E_6038_UN,7.9068055,00000000000000000000000000000000000000000010000000000000000000000100000000000000000100010011100010000100110110110000111001000100110110100100001001010001001110101111110,SZUXMHBCLCEEOX-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2CC2)N[C@H]4[C@H](C3=C[N](C)N=C3)OCCC4,B3CD3EC9D9443F96_7CFCA78B31086AD4_6041_UN,8.20615,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011011111100000100101010000001011101100100011110100001011011011110011101111110,HKIOQAWXZLMELW-MSOLQXFVSA-N
FC1=C(C=C(C=C1)N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)CC#N,763D2BAAACB062C8_088B38E96C7024BB_6041_DP,7.580165,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,VKAHQRJLVXDCGR-IEBWSBKVSA-N
N(C2=C1[NH]C=CC1=CC=C2)C(C4=CC3=C(OCCN3C)C=C4)=O,0A73C2912369992E_6804266C07788EDD_6038_UN,8.980734,00000000000000000000000000000000000000000000000000000010010000000100000000010001000101100000110110101100010001110101111011100100000111010110001011011001111011111111110,VLEAEVCZZYLQEG-UHFFFAOYSA-N
C1(=CC2=C(C=C1)SCCCC2)NC3=CN=C([Si](C)(C)C)C=C3,83DC82745EF3A91A_D82A2F489E009474_6041_UN,7.240452,00000000000000000001100000000010000010000000000000000000000100000100000000100001010000101001010000100100010000001000001011000100110001010100011011011101010010101111010,CMBMZAUANMWFNJ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCC=CCC2)Cl)C3CC3,9ED4DEB523BB085E_7153EF1B5851757E_7022_UN,7.984473,00000000000000000001001000000000000000000000000000000000000000100000000000000000001000010011000000011001000110000000001000000000110001110000000010010011010110101111010,FWXOICVBNYNBAX-UHFFFAOYSA-N
CC1=C(C=CC(=C1)NC[C@H]2[C@@H](C2)C3=C(C=C(C=C3)Cl)Cl)OC4CCOC4,CA383208EEC6763F_A2CCD175BBB16F24_7022_UN,7.9263744,00000000000000000000001000000000000000000000000000000000010000100000000010000000001100110111000010001001000101000100001000000111010011110110000111010011110111111111110,BZQGUEPOJGSZOB-AHMQINRISA-N
O(CCCCN1CCOCC1)CC(OC)C2CCOC2,FB97FDC1F9852460_556D53C5235C96B5_6039_UN,7.3125267,00000000000000000000000000000000000000000000000000000000010000000000000010010000000101100100010110101000000011010000101011100010110010000110100000111000110101111101110,VMEHYFKNIUBJGH-UHFFFAOYSA-N
NCC(COC2=C1CNCCC1=C(C=C2)F)CC3CC3,60A3607A017B79F8_9E0C0DA287CCCE4B_6035_UN,8.252889,00000000000000000000001000000000000000000010000000000000000000000000000000000000001010110011000001101100110101010100001001000011110100100110001111010001110101100111110,QHJZCIANZDHJJX-UHFFFAOYSA-N
FC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCCC3)C[C@H]5[C@H]4CNC[C@H]4OC5,DEE49159162FC087_B70448576A23FA25_6034_UN,8.665217,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101110011000111101100110101010000001011100100110110100110001011011011110111100111110,VHXJHJRGITXAKN-XCUHIIHLSA-N
CCOC(OCC)C4=NC1=C(N=CC(=C1)NC[C@@H]2OCCN(C)[C@H]2C3=CC=CC=C3)[NH]4,F4C348028FB18C5C_9ACFF5EEFDF8B7AF_6041_UN,8.435482,00000000000000000000000000000000000000100000000000000000010000100100000000010101101101100001010110101100010011010011101011110110110111010110011001111111110111111111110,YELODQNARDLZLB-PMACEKPBSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC3CCCC(O3)C4CC4,66E76C372BAA56B0_23C15F825D00F829_6041_UN,7.866393,00000000000000000000001000000000000000100000000000001000010000100100000000010101101100000011011110101000000010000000001011101100110011010100001011011111110111101111110,SZEJAUKAVPOLQT-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)F)F)C(C2CC3CNCC2C3)=O,574C8BCA52407E42_1376C38DB80475C5_6038_DP,7.634398,00000000000000000001000000000000000000000010000000000000000000000000000000000000001000110011100010101000010100100000010001000000110100100110001011000011011110100111110,FISVNWPQZFQRQL-UHFFFAOYSA-N
C[N]2C=C1N=CC(=CC1=N2)NCC(N3CC(C)OC(C3)C)C4=C(C=CC=C4F)F,A15BBD0F3BD70716_7E79A79398E9CF04_6041_UN,8.534788,00000000000000000000000000000000000000000010000000001000010000000100000000010001101101110001011110101100010110010001000011101100110011110110011011001111110111101111110,XWDKMSSAVPFAJK-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)F)Br)C(C2CC3CNCC2C3)=O,9D17B379FA5992F6_66452A94ACD19FEC_6038_DP,7.634396,00000000000000000001000000000000000000000010001000000000000000000000000000000000001000110011100010101000010100100000010001000000110100100110001011000011011110100111110,YECGZJLXENNPIP-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)F)Cl)C(C2CC3CNCC2C3)=O,E4F9F9404B1DEF80_4FAD0783FD56AD79_6038_DP,7.6343937,00000000000000000001000000000000000000000010000000000000000000000000000000000000001000110011100010101001010100100000010001000000110100100110001011000011011110100111110,GZRPXSQZQODBLR-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)Cl)Cl)C(C2CC3CNCC2C3)=O,9EEFF93FD98B6244_37503BEA24AAEC37_6038_DP,7.6343904,00000000000000000001000000000000000000000000000000000000000000000000000000000000001000110011100010101001010100100000010001000000110100100110001011000011011110100111110,UJTKFAGVSJJASE-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)I)Cl)C(C2CC3CNCC2C3)=O,8766C576B7EBE917_A752AC6BAA75E996_6038_DP,7.634391,00000000000000000001000000010000000000000000000000000000000000000000000000000000001000110011100010101001010100100000010001000000110100100110001011000011011110100111110,RXWQNBXFTLRBOT-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)Br)Br)C(C2CC3CNCC2C3)=O,A1A7006D976FAA2C_98C1CD5520318139_6038_DP,7.634396,00000000000000000001000000000000000000000000001000000000000000000000000000000000001000110011100010101000010100100000010001000000110100100110001011000011011110100111110,MKWOJQASUZWILJ-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)Cl)F)C(C2CC3CNCC2C3)=O,D67D14AEFED88A11_206E06C5A898E127_6038_DP,7.634385,00000000000000000001000000000000000000000010000000000000000000000000000000000000001000110011100010101001010100100000010001000000110100100110001011000011011110100111110,DLKFNODVUSZEMU-UHFFFAOYSA-N
N(CC1=CC(=C(C=C1)Br)F)C(C2CC3CNCC2C3)=O,9BA5D428BBAE5448_07C1A8191DFEE22D_6038_DP,7.6343904,00000000000000000001000000000000000000000010001000000000000000000000000000000000001000110011100010101000010100100000010001000000110100100110001011000011011110100111110,YNRIHPGHXNICDX-UHFFFAOYSA-N
C[N]1C=C(C=N1)C2=C(C=CC=C2)N[C@@H]4CCN(C3CC3)[C@H]4C5=CC(=C(C=C5)F)F,65F210CCB4637692_7B92D9A762D220B6_6041_UN,8.334894,00000000000000000000001000000000000000000010000000001000000000100100000000010001100101010011011010001000100100010000001011101100110001110100001011011011010010101111010,VSHIIFNIJHXNJP-PKTZIBPZSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC=C2CCSCC2)F)CC3,C973AA39A95C16F7_0519113B3F47FE62_6041_UN,7.6284513,00000000000000000001000000000000000010000010000000100000000000000000000000011001101001111001010000111000000110010001101011100000110001110110001011011011010110101111010,BMDBUDAPEJEBIC-UHFFFAOYSA-N
C(C12CCC(CC1)C2)=CC3=NC4=C([N]3C)C=CC(=C4)Cl,BC631380B6E52A04_C4DFEC8268B71F19_7019_UN,7.9788237,00000000000000000000000000000000000000100000000000000000000000000110000000010101000101010000010010010101010100001000001011100100110000100100001011011010000010101111010,XQNRPLOFKLREDL-UHFFFAOYSA-N
CN(C)C1=C2C(=CC=N1)C(=CC=C2)N[C@@H]3C5=C(OC4(C3)CCCC4)C=CC(=C5)F,835F202A755D71BD_5C862F2734A030F1_6041_UN,7.877501,00000000000000000000000000000000000000100010000000000000010000000110000000100100000001110001010011100100110100011100001011100100110011110100001011011101100011101111110,DXRHFQXHTILDDE-NRFANRHFSA-N
CN(C)C1CCCC2=C(C3=C(N=C12)C=CC(=C3)Cl)C4=CC=C[NH]4,A52B69E634B24D6C_51A27103D2BC302C_2201_UN,8.127547,00000000000000000000000000000000000000000000000000000000000000100100000000100001000101110001010010100101010110010000101011100100100001100100001011011101000010101111010,UNNBUJQARUQHGK-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3CCCC34CCNCC4,45AD9B2DAAC529AF_6784251B8116D310_6041_DP,7.179329,00000000000000000000000000000000000000100000000000001000000000100110000000010101101101100011011010101000110010011000001011101100110101010110001011011111010110101111010,AHXCXRIHJGPWBX-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=CC(=N2)NC4=C3CCOC3=CC=C4)[N](=O)=O,17A746DABDABB75B_B1F57852F1A8CC26_6041_UN,8.457893,00000000000000000000000010000000000000100000000001000000110000010100001100000101000100000011001011100110010001000100001111101100001011010100001011111011110011111111110,AFMNEXIPWPVVKC-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC3(CCSC3)N4CCOCC4,A51EF1CACFB3CDA2_3FB7C290B1776B07_6041_UN,8.549253,00000000000000000000000000000000000010000010000000000000010000100110000000010001101101111011000110101100010101011000001011100100110011110110001011011011010111101111110,NRDSYTBDKSEADA-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC[C@H]4[C@@H](C4)C5=C(C=CC=C5F)F,359708A3B388CE30_1957A3FAE8537BEC_6041_DP,7.866817,00000000000000000001001000000000000000100010000000000000000000100100000000000101101101010011010010101000110100010000101011100100110101110100001011011011010110101111010,GFEDLGPSPGTCSQ-ZOFXXKQRSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=NC=N3)NC5(CC4=C(C=CC=C4F)F)CCCCC5,B792019C36C6A54F_C366AB46AE7D103A_6041_DP,8.5033,00000000000000000000001001000000000000000010000000000000000000000110000000000100101101110011010010101000111110011000001011100100110101110110001011011011010110101111010,JPEOAGCJCXFVDJ-MCPYQZEQSA-N
CCC4CCC1=C(C3=C(N1CC2(C)CCC2)C=CC(=C3)C)C4,BEEAFAC1C9BFC8D5_44078B644F2CF3BB_6034_UN,8.086487,00000000000100000000000000000000000000000000000000000000000000000110000000010000000101000000000010001100010010011011101001100100110000000100010011011100010110101111010,XMXIVZPATGSTFC-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCCN2CC(CC)CCC2)Cl)C3CC3,8CBA5EFD95AA6B31_D6048F99F2569B64_7022_UN,8.016937,00000000000000000000001000000000000000000000000000000000000000100000000000010001001001110001000000101001100110010010101001100000110001110110001011011111010110101111010,VCGSOHGQBNJDHV-UHFFFAOYSA-N
CC2=C1C=CN=C(C1=CC=C2)NCC3(C(C)(C3)C)C4=C(C=C(C=C4)F)F,3A9C56B1B7F27C86_355664AB1C9C98EC_6041_UN,8.430414,00000000000000000000001000000000000000100010000000000000000000100110000000100100001000010011000000101100010110001001100001000100010001110100011011000111010110101111010,OUWIHCNQBZCNEL-UHFFFAOYSA-N
N1CC2CCC1CN2C3=CC=C(C=C3)NC[C@H]4[C@@H](OCC4)C5=CC=C(C=C5)F,DAF610D9FBA803F3_6BE1E3099C099B53_6041_DP,7.1795692,00000000000000000000000000000000000000000010000000000000010000100000000000010001001101010011000011101000110101010000001011100100110111110110001001011011110111100111110,NULXTBYTRTZXFI-SAOICFMMSA-N
O[C@H](CBr)C1=C(C=CC=C1)NCC23CCC(C)(CC2)OC3,01FE6F0EBE662AD9_7C9A6A03A77F1FB0_6041_UN,7.8849235,00000000000000000000000000000000000000000000001000000100010000000010000000000000001000000011000001101000110001001001101000000000110111110111000011010011110111111111110,WNFCHVUQLUNCRE-KLAILNCOSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CCC3NCCNC3)Cl,B1E1361D516D94DD_2DF6C13AD3074591_6034_UN,7.6622925,00000000000000000000000000000000000010000000000100000010000000000100000000010111111101111011000010101001101100010000001111100100110101110110001011011011010110101111010,WQGUGAQPJINJOK-UHFFFAOYSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3(C)CCCCCCC3)C4,6A30847A1031FB1F_C23E8231C26359EE_6041_UN,7.5792856,00000000000000000000000000000000000000000000000000000000000000000110000000010000101101100011010010101100110010011001101011100100110101010110001011011101010110101111010,PFEXGVDIBIQXKY-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NCC4CC3(CCN3C)C4,75CF75E0EF603E9E_4C0DCEEC547F7D7D_6041_UN,8.0819435,00000000100100000000000000000000000000100011000000000000000000000110000000010100001101110010010010001100010100011001101011100100110101110110001000011001010110101111010,SHPNSCQEZPSIDH-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CNCC3(O2)CCC3,772919EDC7E506B5_957A13981729142A_6041_DP,7.299191,00000000000100000000100000000010000000000000000000000100010000000110000000100001101000100011010100101000010000001000001011000000110111010110011011011111110111101111110,VFPXEIZSJICMLA-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2C4=C(OC3(C2)CCOCC3)C=CC=C4,F0F9FF1127A30186_BDC596628EA201DB_6041_UN,7.698217,00000000000000000000100000000010000000000000000000000000010000000110000000100001000000100101010001100100110001011100001011000100110011010110011011011111110011111111110,ROZSMXGAOCAQTN-UHFFFAOYSA-N
ClC2=C1C(=CN(C1=NC=C2)CCN3CC(C)(C)OCC3)CC4=CC=CC=C4,7EBA162EF0D9C013_E87837ACD45F86D8_6034_UN,8.234838,00000000000000000000000000000000000000100000000000000000010000000110000000110101000101110000000110101101010111011001101011100100110010100110001001011100110111101111110,DIMMIFGQYLPMEK-UHFFFAOYSA-N
O(CC2CCC1(CCOCC1)O2)CCC3CCN(C)CC3,E8C7D3F60B0CF041_63343B1780917E7D_6039_UN,7.221915,00000000000000000000000000000000000000000000000000000000010000000010000010010000000101100100010010101000010001011001101011100010110010000110000001111000110101111101110,WUIOWZUPXVLHGJ-UHFFFAOYSA-N
CC(OCC2CC1COCCC1O2)C3=C(C=CC(=C3)C)F,61C3123604F6CB4E_B185D6073FB49B7E_6039_UN,7.7892523,00000000000000000000000000000000000000000010000000000000010000000000000010000000000100110100000010100100010101000000101010000010110010100110000011110110110101011011110,XABPCRYSMJKWPA-UHFFFAOYSA-N
C1(=CC(=C(C=C1)Cl)Cl)NCCC2CC(C)CC(C2)(C)C,B4C5766DCEC2EF08_0BBBDEDDA126B7C6_7022_UN,8.331528,00000000000000000000000000000000000000000000000000000000000000000010000000100000001000010001000000001001100110011001001000000000110001110000010011010111010110101111010,LVFQDFWUMXXCCS-UHFFFAOYSA-N
C1(=CC(=C(C=C1)F)F)NCCC2CC(C)CC(C2)(C)C,8261E23A2EC94AAE_263FF2E15F76CA52_7022_UN,8.331532,00000000000000000000000000000000000000000010000000000000000000000010000000100000001000010001000000001000100110011001001000000000110001110000010011010111010110101111010,ZDFAYHUCHBQAPV-UHFFFAOYSA-N
C1(=CC(=C(C=C1)Cl)F)NCCC2CC(C)CC(C2)(C)C,56199DA83E66CE24_74DE14E2EF761EAC_7022_UN,8.331532,00000000000000000000000000000000000000000010000000000000000000000010000000100000001000010001000000001001100110011001001000000000110001110000010011010111010110101111010,WKACULHMXJVQQP-UHFFFAOYSA-N
C1(=CC(=C(C=C1)F)Cl)NCCC2CC(C)CC(C2)(C)C,AC98B462781DDC87_2395B5B551DF697F_7022_UN,8.331525,00000000000000000000000000000000000000000010000000000000000000000010000000100000001000010001000000001001100110011001001000000000110001110000010011010111010110101111010,AWGLLFXUPQHKEW-UHFFFAOYSA-N
CC1=C(C3=C(C=C1)N=C2CCCCC2=C3NC(CCC)C4=C(C=C(C=C4)F)F)F,026AC5B8B21D058F_3658FBEB43E90E52_6041_UN,7.7175255,00000000000000000000000000000000000000000010000000000000000000000100000000000000100000010011000000100100110100010011001001000100110001110100001011010111000110101111010,UPEPGVLZHXEGNK-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC3CC(OCC3)C4=CC=C(C=C4)F,20B6AEE095519D7B_2E7CC30E5A39F5E7_6041_DP,7.500704,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101010011010011101000100111010000001011100100110111110110001011011011110011101111110,UDSYIVSFKLBKGU-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NC3CC4CCC(C3C)N4,31400E05900EEA5C_60AA0416FD7FF0EA_7022_DP,7.8903785,00000000000000000001000000000000000000000010000000001100000000000100000000010000100100010011001010101000110110010000101011101100110101110100001011011011010110101111010,CFMFUGNEDGHJDA-UHFFFAOYSA-N
N1CCC4(CC1)OC5(COC2=C(C=CC=C2)C3CC3(F)F)CC4(N)C5,0264725F76741379_76CEB9749A18019B_6035_DP,8.155857,00000000000100000000001000000000000000000010000000000000010000100010000010000000001110110011000111101000110101011100001011000011110111100110001111010011110111110111110,GBTUAVUKLZBWGL-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NCCN2CCN(C)CC2C3=CC=CC=C3)C4OCCO4,14B434BE4FBD3AEA_0CDE1A593F7418F1_6041_UN,7.5621634,00000000000000000000000000000000000000000010000000000000010000100000000010010001001101110001010010101000100101010001101011110100110011110110001011011011010111111111110,DUKIPDAJZXCEIO-UHFFFAOYSA-N
NCCC(OC1=CC(=CC=C1)C2NCCCC2)C3=CC=C(C=C3)Br,0C91962EBD674DCE_73A31A0B4833620C_6035_UN,8.117501,00000000000000000000000000000000000000000000001000000000000000100000000000000000001010010011000001101000100100010100001001000111110110100110001101010001110111100111110,PNTLQVLACXIBPM-UHFFFAOYSA-N
COC1=C(C=CC(=C1)C(F)(F)F)NC2C4CC3C2C3C4,F5CED18678DDD955_2007AA6E416893F6_7022_UN,8.3344555,00000000000000000000001000000000000000000010000000000000000000000000000000000000000000000011010110000000011100001100000000000011110001110000000111000011100011101111110,IXMSVHYYWBNVSH-UHFFFAOYSA-N
C(C#CC1=C(C(=CC=C1)Cl)Cl)=CC(OC)C2CCOC2,4734A1F9508CD55E_2B6ABC805004A641_7019_UN,7.336272,00000000000000000100000000000000000000000000000000000000010000000000000000000000000100110100010010010001000111000000001000000010010010100110000010010010110001011011110,KOMXFKZDEBCLQI-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NCC3=CC=C(N2CCN(C)CC2)C=C3)C4OCCO4,1B6A2936E18239C0_6D6DFF37208E2AC4_6041_UN,7.5760336,00000000000000000000000000000000000000000010000000000000010000100000000010010001001101110000010010101000000101010001101011110100110011110110001011011011010111111111110,FVCCRHRPCSEWSA-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC4=CC=C(CN3CCN(C)CC3)C=C4)F,82EC7B707E159100_E94E5F5F477FEEAB_6041_DP,7.128464,00000000000000000000000000000000000000000010000000000000000000000000000000010001001001110011010000101100110100010001101011100100110101110110001011011011010110101111010,ZYUANWDVIRNJBX-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC(C3=NC=C[N]3CC)C4CCOCC4,E6EFCA614F652CBC_05C6B06BAC8E0262_6041_UN,7.954665,00000000000000000000000000000000000000100010000000000000010000000100000000010101100101110011000010101100010101000010001011100100110011110110001011011111010111101111110,ATJFTGRXYPKHJR-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)N[C@@H]5CCN(C4CC4)[C@H]5C6=CC(=C(C=C6)F)F,399ED7E8BBF35AA7_C0651271140A6F57_6041_DP,8.568454,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101110011010010101000110110010000001011100100110101110110001011011011010010101111010,LEEWVWWUCGLDSM-ZCPBXCHASA-N
FC1=CC4=C(C(=C1)NCCC3CCN(C2CCN(C)CC2)CC3)OC=C4,EAA81645D34BDE2E_4394BC35DE33F14B_6041_UN,7.6460805,00000000000000000000000000000000000000000010000000000000010000100000000000010000101101110001010110101100110100010001101011100100110001110110001001011001110110101111110,OWIYGIUETXGORQ-UHFFFAOYSA-N
FC1=C(C=CC=C1)C2=NC(=NC=C2)NCC[C@@H]3CC[C@H]4C[C@@H]3C4(C)C,85506F56E913F819_944AFE2A7EBEFA2F_6041_UN,8.004133,00000000000100000000000001000000000000000010000000000000000000100110000000100100101000010001000000101000111110011000101011000100110001110100001011010111010110101111010,FMULVPIXUMPGQG-ZOBUZTSGSA-N
CC2=C1N=CC(=C(C1=CC=C2)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F)C#N,54187BC53D0BAB05_A7976E6369F7E41B_6041_DP,7.419888,00000000000000000000000000000000000000000110000000000010000000100100000000000001101000110011000000101100110100010000001011000100110101110110001011010011010010101111010,PIWCIELCBJOCQG-OXQOHEQNSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4=CC(=CC=C4)C5=C(C=CC=C5F)F,D025C9E85E51C7D0_20878E720D718909_6041_DP,8.114262,00000000000000000001000000000000000000100010000000000000000000100100000000000101100101010011010010100000110100010000101011100100110101110100001011011011000010101111010,ZSOOJQVSDCFUDN-REPLKXPHSA-N
N(C1CC2CCC(C1)S2)C(=O)CC3=C[NH]C4=C3C=CC(=C4)F,7E98143444D90449_918894D5028498FF_6038_UN,7.544813,00000000000000000001000000000000000010000010000000000000000000000100000000000000010100011011100010100100110100110000011011000100110111100100001001010001001110100111110,RSBKVOCDYJTQPR-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NC[C@@]34[C@@H](CCC3)CCO4)C,B9A941BFA65127F7_EC44DED60334F2D7_6041_UN,7.7547836,00000000000000000000000000000000000000000010000000000000010000000110000000000000101100010011000110101100010111001000001011000100110011110110001011010111110111101111110,LGZFLUCNRIJWHU-IFXJQAMLSA-N
N4CC1=C(C=C(C=C1)NC[C@@H]2CCCN(C)[C@H]2C3=CC=N[N]3C)C4,C5CA999D5206F1CC_B9EB372BE03ED0FF_6041_DP,7.7357316,00000000000000000000000000000000000000000000000000001000000000100100000000010001101101100011011010101100010010010001101011101100110101010110001011011111010110101111010,NETMMJAFEBBBHJ-HNAYVOBHSA-N
CC5(C)CCC1=C(C4=C(N1CCC3CCN(CC2=CC=CC=C2)C3)C(=CC(=C4)F)F)C5,20A92FD711D8A0FE_06F337D82E6AD7E4_6034_UN,8.010262,00000000000000000000000000000000000000000010000000000000000000000110000000110000000101110000000010001100010100011001101011100100110000100110001011011100010110101111010,IAADXZZYLHRDLB-UHFFFAOYSA-N
CCC1=C(C(=CC=C1)F)NCC2N(C)CC3(CC2)CC3,53C05D027BABA7E0_DB0F5B98F2019E60_6041_UN,7.3239446,00000000000000000000001000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011011101001100000110001110110001011011111010110101111010,JZBDHYXZQCBINS-UHFFFAOYSA-N
ClC1=C(C=CC=C1)CNC3=NC2=C(C=CC=C2)N3CC4CNCCC45CN(C)C5,38BACE4D1A13BF0E_49A41D2CC6A6798F_6034_UN,7.96235,00000000100100000000000001000000000000000000000000000000000000000110000000010101101101110011010010101101111110011001001011100100110101110110001011011011010110101111010,LDJPOYXZLMVVEO-UHFFFAOYSA-N
C[N]1C=C(C=N1)C2=C(C=CC=C2)NCC3(CCOCC3)C4=CC=C(C=C4)F,BD6B03AEEF1060F7_0767282071F6E1E6_6041_UN,7.484419,00000000000000000000000000000000000000000010000000001000010000100110000000010000101100110011011010101000000101001000001011101100110011110110001011011011010111101111110,ZFACULODRQEVRE-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)OCCO2)C(C45CC(C3CNC3)(C4)C5)=O,8573A85ABB35F6EE_D061D7A9A3763348_6038_DP,8.105736,00000000100100000000000000000000000000000000000000000000010000100010000010000000001000100011100000101100010001101100011011000000110110000110001011110001111111110111110,KSQZVBBHYLUYRB-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C=C)NC2CN(C)C3(C2)CCOCC3,F82EA49A0BDD497E_7E51BB9612BF6B29_6041_UN,7.4199123,00000000000000000000000000000000001000000010000000000000010000000010000000010001100101110001010011111000110111011001101011100000110011110110001011011011010011101111110,GRRPVNXMRNSTDF-UHFFFAOYSA-N
FC2=C1N(C3=C(C1=CC=C2)CCCC3)CC5(C)CC4CC4C5,1B8051EDD771E004_A5249C8A8676712E_6034_UN,8.429765,00000000000000000000001000000000000000000010000000000000000000000110000000010000000101010000000010001100010110011001001001100100110000100100000011011000010110101111010,ZPDHGFCYDYQZNI-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CC2CCNC(C)(C2)C)C=CC(=C3)C)C4,EE7A125A6FA46714_C8531E046EE7F609_6034_UN,8.21549,00000000000000000000000000000000000000000000000000000000000000000110000000110000001101000001000010101100110010011011101011100100110000000110011011011101010110101111010,SYATUDUYFMYODP-UHFFFAOYSA-N
ClC1=C(C=CC=C1)C2=CN(C(=N2)C3NCCC3)CC5[C@@H]4C[C@@H](C4(C)C)CC5,C0ACE4B38A82FB6F_DB3080CB28F1F418_6034_UN,8.108851,00000000000100000000000000000000000000100000000000000000000000100110000000110101001101010011000010001001110110011000101011100100110000100110001011011111010110101111010,NODGBGGLKDZMOF-OUBFZGACSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2CC[C@@H](O2)C3CC3)F)[N]4C=CC=C4,75AF6F5404D8E336_22D18794C5789018_6041_UN,8.193599,00000000000000000000001000000000000000000010000000000000010000100100000000010000001101010011000110001000000100000000001011100100110011110100001010011011110111101111110,QZKSEZNMKISSAR-HNAYVOBHSA-N
CCNC5CCC1=C(C4=C(N1C[C@H]2[C@@H](CCNC2)C3=CC=C(C=C3)F)C=CC(=C4)Cl)C5,18CBB2108D971148_C432EFD25FD79CCD_6034_UN,8.094833,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010101101110110010010001011100100110101100110001011011011010110101111010,MZMNJRDSUGXINH-HURFNXGFSA-N
FC1=CC2=C(C=C1)C(=CN2CCN(C)C3CCC3)C4CCNCC4,3C60F626D7E90BD7_17960F256C586BC0_6034_UN,8.007518,00000000000100000000000000000000000000000010000000000000000000100100000000010001001101110001010010101100110110010001101011100100110001100110001001011001010110101111010,JKYYGLWQWZZIAR-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C3=C(C)N=C4C(=C3)C=CC=C4F)=O,C0DF7F91B8CDC1BA_01C348A303CD5EE1_6038_UN,7.6784053,00000000000000000000000000000000000000000010000000000000010000000100000000000000101100010001100011101100110100110000011011000100110010100100001011010011111111111111110,WEMIPTIEWAPUCB-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC23CCCNC2CCC3)F)CC4,12E6D4D70887A479_15A99F9A349F63E8_6041_DP,7.588947,00000000000000000001000000000000000000000010000000000010000000000010000000010001101001110011010010101100110110011001101011100000110101110110001011011011010110101111010,YSHGWQWCTVXZIT-UHFFFAOYSA-N
C(CC2COC1(CCCC1)O2)=CC4=CC(=C(N3CCN(C)CC3)C=C4)F,CC3A7D276D1929E3_84C68AE5D4142E3D_7019_UN,6.795493,00000000000000000000000000000000000000000010000000000000010000100000000010010001000101110000010010111000010101011001101011110000110011110110001011011010110111111111110,CMCHBSWPYUWXSC-UHFFFAOYSA-N
N(C(CF)C1=CC=C(C=C1)F)C(CC3CC2CCC(N2)C3)=O,B5C2C7061AFCAF58_07F532C00F4D661C_6038_DP,7.7719035,00000000000000000001000000000000000000000010000000000000000000000000000000000000000100010011100010100000110100110000011001000000110110100100001001010001011110100111110,JFMUASNTOOYTLN-UHFFFAOYSA-N
N1CC4(C1)OC5(COC2=C(C(=CC=C2)C3=CN=CC=C3)F)CC4(N)C5,3B5624C75EAEF554_A6F83569D3227CDA_6035_DP,8.38073,00000000100100000000000000000000000000000010000000000100010000100110000010000000101110110011000111101000110101011100000011000111110111100110001111000011110111110111110,QORTYIDCYYMWMQ-UHFFFAOYSA-N
CCC2=C1N(C=C(C1=CC=C2)C3=CCNCC3)C[C@H]4[C@@H](CNC4)C5=CC=C(C=C5)Cl,C0979539CF794BBE_2723EC590D45B3ED_6034_UN,8.210248,00000000000000000000000000000000000000000000000000100000000000100100000000011000101101110011000010111101110100010010001011100100110100100110001001011011010110101111010,YLEYZQHTJMEKBL-URXFXBBRSA-N
C1(=CC=C(C=C1)CC2CC2)NC3=C[N](C[Si](C)(C)C)N=C3,503197884E5B8C6E_7FA7B99E4C70F644_7022_UN,7.5557218,00000000000000000000101000001010000000000000000000001000000000000100000000110001100100100001011010001000000000011001000011101100010001010100011000011101010110101111010,MXULPQJVLBWONX-UHFFFAOYSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3(CCCCC3)C4=CC=C(C=C4)F)C5,89424ECFE8601EF7_862502F64ADF7EC3_6041_UN,7.581911,00000000000000000000000000000000000000000010000000000000000000100110000000010000101101110011010010101100110100011001101011100100110101110110001011011001010110101111010,CNJVDNXIZLTQDC-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NCC2N(C)CC3(CC2)CCC3)C4OCCO4,D475840F891C3174_74E77EF3BF1B0CEA_6041_UN,6.925507,00000000000100000000000000000000000000000010000000000000010000100010000010010001001101110011010010101000010111011001101011110000110011110110001011011011010111111111110,STGUKRNRRRAZEF-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)NCC2CNC3(CO2)CCC3)C#N,E37A4C6557450A10_EF0962286957B349_6041_DP,7.620903,00000000000100000000000000000000000000000110000000000100010000000010000000000000101000010011000100101000110101011000001011000000110111110110001011010011110111101111110,KEVACIFNORAQKT-UHFFFAOYSA-N
C1(=C(C=CC=C1)CN2CCCC2)NC3=C[N](C[Si](C)(C)C)N=C3,9CC06361C99F5C16_F8287B4A95BED539_7022_UN,7.4674935,00000000000000000000100000001010000000000000000000001000000000000100000000110001100101100011011010001000000000011001001011101100110001010110011010011111010110101111010,TVUODTIEXPBIFC-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OCC2=C(F)C=NC=C2)C3,7E4D96468005E92A_FCBDCDAE89941C75_6039_UN,8.036001,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010011101000010101000001001001100011110000100110001111011110110101101111110,CATLWDOCSXACMR-CQJJVWNLSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CNCC3=C2C=CC=C3,5387C5F4CAF0ABFA_7575BA01F249011B_6041_DP,7.3725348,00000000000000000000100000000010000000000000000000000100000000000100000000100001101000100010010000101100010000001000000011000100100101010110011011001111010110101111010,RCLSWKOSYAKHMK-UHFFFAOYSA-N
BrC1=CC2=C(N=C1)N(C=C2CC3=CC=CC=C3)C[C@@H]4OC(C)(CNC4)C,3F41D4D91C30CF97_8BE0E4B1081AFE61_6034_UN,7.899293,00000000000000000000000000000000000000100000001000000000010000000110000000110100101101110010000110101100010110001001000011100100100010100110001001001101110111101111110,CAISQFWNTOXOLE-GOSISDBHSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3C2CCCCC2OC3)F)CC4,CD6BC64629CAC363_DCDB058024D74F05_6041_UN,7.502024,00000000000000000001000000000000000000000010000000000000010000000000000000010001100101110011010111001100110111010001101011100000110011110110001011011011110111101111110,KFLSRHSFIXUZOA-UHFFFAOYSA-N
O=[N](=O)C1=C(N=C(C=C1)NC2=CC3=C(C=C2)COC3)C4=CC=C(C=C4)F,2BA2541F01FAF62D_CBE7D097A79B67F9_6041_UN,7.715723,00000000000000000000000010000000000000100010000001000000110000110100001100000101000100110001001011100110010101000000000111101100011001110110001011101011010011110111110,ROLRSQGMABVGOY-UHFFFAOYSA-N
CC1=CC(=CC(=C1)C)NC24CC3CC(C2)CC(C3(F)F)C4,5779FA10E1FEE167_D9E5A5B59337F7BE_7022_UN,7.8419647,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010001000000000100110100011000000000000000100001110000000001000101000010101111010,YZFYSGGTGOZASZ-UHFFFAOYSA-N
CC2=CC1=C(C(=CC=C1)Cl)N2CC3CCCN3CC4CCCN4,6D628E950140AE89_AE00E82E24162C20_6034_UN,8.155527,00000000000000000000000000000000000000000000000000000000000000000100000000010001001101110011000010001101110100010000101011100100110000100110001010011011010110101111010,QKRITERPIFKMIJ-UHFFFAOYSA-N
CC2=CC1=C(C(=CC=C1)F)N2CC3CCCN3CC4CCCN4,F050C2D03A6D0FB0_5977DA34E971D6F8_6034_UN,8.155514,00000000000000000000000000000000000000000010000000000000000000000100000000010001001101110011000010001100110100010000101011100100110000100110001010011011010110101111010,IKZGPVMSSDSNGY-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3CCC(C)(C)CN3)Cl,67E304CEC0555420_150F37F44601445B_6034_UN,8.776035,00000000000000000000000000000000000010000000000100000000000000000110000000110111011101011011000010101001101110011001101111100100110101110110011011011111010110101111010,BLSBQLZSAYMEHC-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC3=NC=C(CC2COCC2)S3,6210EB21F1FBFAEA_1445F8BB09588324_7022_UN,7.940309,00000000000000000000100000000010000010000000000100000000010000000100000000100100010100101001010010000000001001001000001011000100110011010110011000011101010111101111110,BPWZINUYFGTWHR-UHFFFAOYSA-N
CSCC2(C=CC1=C(C(=C(O)C=C1)F)F)CCOCC2,6475218B48C65F06_F21B567A5BD07DC7_7019_UN,8.309851,00000000000000000000000000000000000000000010000000000000010000000010000000000000000000111000010000110000000111001101001000000001110010100111000111010010110101011011110,BIGAKJVQKGUBNI-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CNCC34CCNCC4)Cl,031C31872B7EE6EC_51DA6D20D08BE5CD_6034_DP,7.337294,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101111011000010101001111100011000001111100100110101110110001011011011010110101111010,WXMMFIMFEOEYNR-UHFFFAOYSA-N
C(C12CCC(CC1)CC2)=CC3=C([N](C)N=C3C4=CC=CC=C4)Cl,FF96AD04364FACFD_82E80354DFCFC42D_7019_UN,8.035915,00000000000000000000000000000000000000000000000000001000000000100110000000010000100100010000011010010001010100001000001011101100110000100100001011011010000010101111010,WWOAEFLRLBGXQM-UHFFFAOYSA-N
CN1CCCC1COCC4CC2(CC3(C2)OCCO3)CO4,CA01CEFF48383FEE_333859F524DCC6FD_6039_UN,6.8033843,00000000000100000000000000000000000000000000000000000000010000000010000010010000000101100000010110001000010011011001101011110010110010000110100000111010110111111100110,CLTXZLNIGXJTTO-UHFFFAOYSA-N
CN(C)CC1=C(C4=C(N=C1C2=CC=C(C=C2)C3CCC3)SC5=C4CCC5)C6=NC=C(C=C6)Cl,41D4740D5AE3CE96_35220AB6A00704F2_2201_UN,8.077175,00000000000100000000000000000000000010000000000100000000000000100100000000100000110101111000010010101101010100000001001011100100010000100100001011011110010110101111010,CNOKUOIXTVZMDC-UHFFFAOYSA-N
N4CC3=C(C1=C(SC2=C1CCN(C)C2)N=C3C45CCCC5)C6=CC=C(C=C6)C,8BAFFE8AB6F8F658_CBB0FA57EC3FCD92_2201_DP,7.41916,00000000000000000000000000000000000010000000000100000000000000100110000000010001111101101011010010101100110000011001101011100100110000000110001011011101010010101111010,REOQFPKNGIQVLG-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NC3(COC3)C4=CC=C(C=C4)F,065D86EBDB063EFB_75DA2CCD4FBC2D50_6041_UN,7.720316,00000000100100000000000000000000000000100010000000000000010000100110000000010100100101110001010110101000100111011001101011100100010001110110001011011011010011101111110,UWDPDEZFUQCIJV-KRWDZBQOSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3=C(C=C(CC(C)C)C=C3)F,F080C5CA49C8A73C_94FA54FDFEF03E50_6041_UN,7.922447,00000000000000000000000000000000000000100010000000000000000000100100000000110100100101110000010010101000000110010001101011100100010001110100011011011111010110101111010,BSESGNLFYPATFI-IBGZPJMESA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=N3)N[C@@H]4C6=C(OC5(C4)CCCC5)C=CC(=C6)F,389738A8423B9E85_DB88F251FDA4E099_6041_DP,7.922469,00000000000000000001000001000000000000000010000000000000010000000110000000000100100101010011010011100100111100011100101011100100110111110100001011011001100011101111110,MEYWCJYPLHRWPE-DMUMMCEESA-N
N(CC1C2CC(C1)C3CC23)C(C4=C(C)[N](N=C4)C5=C(C=C(C=C5)F)F)=O,F18A45B836045BE0_F3CF727BBEE0BE4A_6038_UN,8.542056,00000000000000000001001000000000000000000010000000001000000000100100000000010000101100010011101011001000010100100000010011101100110001110100001011001011011110101111110,JMTYOCWBUDKCGD-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2(CC)CCCCCC2)Cl)C3CC3,4154BC51C7B72D0F_EB7F7E029569D6F1_7022_UN,7.187146,00000000000000000001001000000000000000000000000000000000000000100010000000000000000000010011000000000001100110011010101000000000110001110000000010010111000110101111010,ZHZXCSRVZFDBBV-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(=O)C(=O)C3=C[NH]C4=C3C=C(C=C4)F,5447B6AED5566EA9_A4390D5A9D64407A_6038_UN,7.931807,00000000000000000001000000000000000000000010000000000000010000000100000010000000001100010010100111101100010100100000011011000100110110101100001001110001111111110111110,RZEVLOOMVDPFKQ-UHFFFAOYSA-N
CC4=CC1=C(C=CC(=C1)NCC2(CCCO2)C3CC3)[NH]4,D0123412204A95D4_E80E9CC29C83C5FA_6041_UN,7.8259006,00000000000000000000001000000000000000000000000000000000010000100110000000000000001100000011000110001100010001001000001011000100110111010110001000010001110111101111110,UUMJRCHGURZSNB-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)Cl)Cl)Cl)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,4E2677578CB7516F_CBFD79DF6B1E756D_7022_UN,8.571799,00000000000000000000001000000000000000000000000000000000000000000010000000100000001000010011000000001101010100001001101000000100110001110000000011010111010110101111010,YAQYHYOVBAKPKM-UHFFFAOYSA-N
CN(CC1CNC1)C2=NC(=CN=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,023534905F3B2397_63EA8476D568C596_6041_DP,7.903263,00000000100100000000000000000000000000100010000000000100000000100100000000000101101001110011010000101000100110010001001011100100110101110110001001011011010110101111010,ALVKFYPQVINSNR-PKOBYXMFSA-N
C1(=C(C=C(C(=C1)F)F)Cl)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,1AB23FCAB2E57062_547AB813350C72A1_7022_UN,8.571791,00000000000000000000001000000000000000000010000000000000000000000010000000100000001000010011000000001101010100001001101000000100110001110000000011010111010110101111010,VXNMOJAWYFGRGS-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)F)F)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,72FB67D5EDB3DE5D_30CA03D08B7F4B51_7022_UN,8.571775,00000000000000000000001000000000000000000010000000000000000000000010000000100000001000010011000000001100010100001001101000000100110001110000000011010111010110101111010,VFPGJEPICURMRO-UHFFFAOYSA-N
C[N]2C=C1C=CC(=CC1=N2)NC(C3CCOCC3)C4=CC=C(C=C4)F,A240B10EC59B38B2_50D4C99DAE4BB010_6041_UN,7.5744076,00000000000000000000000000000000000000000010000000001000010000000100000000010000100100110011011010100100010101000000001011101100110011110110001001011001010011101111110,NWGRUPAXUJVMDC-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NCC3CCCN(C)C3C4=CC=CS4,02681F9DD44400AF_EF3E813253B9BA6E_6041_UN,8.080425,00000000000000000000001000000000000010000010000000000000000000100000000000010000111101111011010010101000000110010001101011100100110001110110001011011011010110101111010,AMIXFCRDEMUPNO-UHFFFAOYSA-N
CC1=CC(=CC(=C1)F)NCC2N(C)CC3(CC2)CCC3,E04CC3BA0955E79C_F3C8150F74486314_6041_UN,7.2720294,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001001011111010110101111010,MTIYNHZXHFWOOR-UHFFFAOYSA-N
CCN1C(CC2=C1C=C(C=C2)F)C3=NC=CN3CC(C)(N4CCNCC4)C5=CC=C(C=C5)Br,B34B7510E364BF3B_44A45C90DA4CE8C9_6034_UN,8.084746,00000000000000000000000000000000000000100010001000000000000000100110000000010101001101110001000010101100110110011011101011100100110000110110001011011111010110101111010,MDHGTBDCIVJQHA-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=CC=N2)NC(C3CCCN3)(C)C,B3906CF4A2D96C8A_F7C36E8A3BBA1885_6041_DP,8.465269,00000000000000000000000000000000000000000000000000000010000000000110000000100001001100000011000010101100110010011000101011000100010101010100011011010111010010101111010,FVSYVYSJROGRDF-UHFFFAOYSA-N
FC2=C1CCCC1=CC(=C2)NCCC3CCCN(C)C3,4FB20F1A3454CE5D_26F4B41D9747AA4E_6041_UN,7.2592087,00000000000000000000000000000000000000000010000000000000000000000000000000010000001001110001010010101100110110010001101001100000110001110110001011011001010110101111010,BWJVKIWFNZLIRG-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3CCC4(CC3)CCCC4,5D160967AD708832_76AE581B6FD3B64F_6041_UN,7.7867327,00000000000000000000000000000000000000000010000000001000000000000110000000010000100100010010011010000100110100011000001011101100110001110100001001011001000010101111010,AXTDNTNEHDKOQR-UHFFFAOYSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC3=C[N](C)N=C3C4=C(C=C(C=C4)F)F,C272FD8CC2DF5D66_92549723D357EC70_7019_UN,8.649805,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010000011010010000000100000000000011101100110000100100001010011010000110101111010,LVIQNBIETLCNNK-DYVFJYSZSA-N
FC2=C1CCCC1=CC(=C2)NCC(CC)N3CCCC3,B824A47450F205F1_609D4C6628F659F9_6041_UN,7.0366216,00000000000000000000000000000000000000000010000000000000000000000000000000010001001101110011000010001100010110010010101001100000110001110110001010011001010110101111010,LOFXHEVJFONYIG-UHFFFAOYSA-N
CN(C1CC1)C3=C2C=CC=CC2=NC(=N3)NC[C@H]4[C@H](CCNC4)C5=CC=C(C=C5)F,BEF39FB1C891DDD3_BF81128119FA41A8_6041_DP,7.854703,00000000000000000000001001000000000000100010000000000100000000100100000000000100101001110011010000101100111100010000101011100100110101110110001001011011010110101111010,AHNGIUQDYFWFAN-FXAWDEMLSA-N
FC1=C(C=CC=C1)C2=CN(C(=N2)C3CCCN3)C[C@H]5[C@H]4CNC[C@H]4OC5,F289AB0D5172D6B8_03BD66743E0870E5_6034_UN,8.710692,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101110011000111001100110101010000001011100100110110100110001010011011110111100111110,DTVQTUMYCXIHQC-QWRJVUJCSA-N
CCC5CCC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3=CC(=CC=C3)F)C=CC(=C4)C)C5,CBE582EB4F42B255_2B86017A78CAEEE6_6034_UN,8.2049465,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010001100010110010010101011100100110000100110001011011111010110101111010,MEYIQVXGEHTVQN-LNZZOJCLSA-N
CC1=C(C=C(C(=C1)NCC2=C(C=N[N]2C)C3CCC3)Cl)C4CC4,F9034C351E4FF896_08EC343C0584A728_7022_UN,8.097444,00000000000100000000001000000000000000000000000000001000000000100100000000010001101100010000011010001001000110010000101011101100100001110100001010011111010110101111010,SYEQMBNSJPISEP-UHFFFAOYSA-N
FC2=C1N=C(N(C1=CC=C2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5)C6CCNCC6,6F69847E1DD825E8_B984818222CBA49D_6034_UN,8.698815,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101110001010010101100110100010000001011100100110001100110001011011011010110101111010,ASKAOMKVCUWMJU-KOSHJBKYSA-N
FC1=C(C=CC=C1)C2=CC=C(C=C2)NCC3N(C)CC4(CC3)CCC4,069C3C4BBCBEB148_089D17026F91BB7E_6041_UN,7.9457626,00000000000100000000000000000000000000000010000000000000000000100010000000010001001001110011010000101000010110011001101001100100110001110110001011011011010110101111010,GQSXRYKNGGPSKY-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NCCC4CCN(C3CCN(C)CC3)CC4)C,740452921301DB92_BA0B5EEFE652FC1E_6041_UN,7.642806,00000000000000000000000000000000000000000000000000000100000000100100000000010000101101100001010010101100110000010001101011100100110101010110011011011111010110101111010,IPSIMCMMFLEXMR-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3=CC=C(C=C3)Cl)C=CC(=C4)Br)C5,1A6BBAA3EE08FE58_40CB971665F43824_6034_UN,8.057711,00000000000000000000000000000000000000000000001000000000000000100110000000110000101101110011000010001101010100011001101011100100110000100110001011011111010110101111010,LFCMRRDZYOCTGO-JTSKRJEESA-N
N5CC1=C(C=C(C=C1)N[C@@H]2CCN(C)[C@H]2C3=CC(=C(C=C3)F)F)C4(CC4)C5,ED514FB7D0B318E2_615778F4A95851CC_6041_DP,8.538562,00000000000000000000001000000000000000000010000000000000000000100010000000010001101101110011010010101100110110011001101011100100110101110110001011011011010010101111010,IWEDMTRWNWMRHD-RTWAWAEBSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NC3=CC=C(C=C3)C46CC5CC(CC(C4)C5)C6,5FDFB316527D5F89_8D68C265D2F1507E_6041_UN,7.856043,00000000000000000000000001000000000000000010000000000000000000100110000000010101000101010000010010000100011100001000000011100100100001110100001011001011000010101111010,WOYBTUYBKCJIHH-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)N[CH]3CC[C]4(CC3)CC[CH2]CC4,DA11672E78EF5783_DECAB19EFBDA9549_6041_UN,7.7056055,00000000000000000000000000000000000000100010000000001000000000100110000000010101100100010010011010100000110100011000001011101100110001110100001011011011000010101111010,MYCYBUHADICHGX-UHFFFAOYSA-N
C[N]1C=CC2=C1C(=NC=C2)NCC3(CCOCC3)C4=CC(=CC=C4)F,6E2E6F8DAF6FCE02_DDFA04F67FD21648_6041_UN,7.2790904,00000000000000000000000000000000000000100010000000000000010000100110000000010101001101110011010010101100010101001000001011100100110011110110001001011001010111101111110,SGPMCBPNSQHHHS-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C)F,4CC34110667A9690_758320A7FDF38BE4_6041_DP,7.6901336,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110011011110101100110111010001101011101100110111110110001011011111110111101111110,JVHZAMSYCLZKAQ-OALUTQOASA-N
FC1=C(C(=CC=C1)F)C4(C=CC2=C(C=N[N]2C)C3CCC3)CCC4,272C9CF5DBFDFD5D_8F7D18A22509FAFA_7019_UN,8.321688,00000000000100000000000000000000000000000010000000001000000000100110000000010000100100010000011010010000000100001000001011101100000000100100001010011010000010101111010,GLHGODQHTGOMQK-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[CH]2C[C]3(C2)CC[CH2]CC3)Cl)C4CC4,C36E6B6962B013F6_BF74E80714A66500_7022_UN,7.5052314,00000000000100000000001000000000000000000000000000000000000000100010000000000000000000010001000000000001110110011000001000000000110001110000000011010011000010101111010,CEFRHKNBWUKDRO-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4(CCCC4)C5=C(C=C(C=C5)F)F,62E0B1824E0C9F4E_A00C76772CBEF8C9_6041_DP,8.083777,00000000000000000001000001000000000000100010000000000000000000100110000000000100100101010011010010100000111100011000101011100100110101110100001011011011000010101111010,LAHXHRUYAGTCAP-BCDXTJNWSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2COCC2CC)F)CC3,15D5D1B94EE61102_F7A0D163AA5FD328_6041_UN,7.2037168,00000000000000000001000000000000000000000010000000000000010000000000000000010001100101110011010111001000100111010011101011100000110001110110001010011111010111101111110,GUTYHLPHBQRSNF-UHFFFAOYSA-N
C1(=NOC(=C1)C2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,65D9FF27FE397C56_E6F2C9A07DA8731E_6041_UN,8.787039,00000000000000000000001000000000000000100010000000000000010000100100000100010101100101110011011111001010100110010001101011101100000001110100001010011011110010101111110,WIVFATJWFQHECE-PBHICJAKSA-N
O=[N](=O)C1=CC2=C(C=C1)N=C(C=C2)NC4=C3OCCCC3=CC(=C4)F,5FC34D81B0EEF34A_D355DA382C067C65_6041_UN,8.33143,00000000000000000000000010000000000000100010000001000000110000010100001100000100000000010001001100100110010101000100001111101100101011110100001011111001110011110111110,ZLIWSEVDCATFBX-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC#CC2CCCCO2)F)CC3,5FAFE140CB99DBEA_DDB47F5970793F56_6041_UN,7.5163274,00000000000000000101000000000000000000000010000000000000010000000000000000010001101001110000010000101000000111010001101011100000110011110110001011011011110111101111110,JXCWDAIZFFSUFT-UHFFFAOYSA-N
C([CH]2C[C]1(C[CH2]C1)C2)=CC3=C[N](C)N=C3C4=C(C=CC(=C4)F)F,42D1C9B14ECC47C2_53AF14B79813896C_7019_UN,7.97083,00000000000100000000000000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001010011010000010101111010,BEGYIZNPFVQPAS-UHFFFAOYSA-N
BrC1=CN=C(N(C1=O)C[C@H]2[C@@H](CNC2)C3=CC=CC=C3)C4CC4,7AEE7B0C78A55AA3_0B241021FD7B7640_6034_UN,8.080299,00000000000000000000001000000000000000100000001000000000000000100100000000010100101101110011100011101000000100100100010011100101110000100110001111011011011110100111110,HADBYURCVVFIKC-GJZGRUSLSA-N
CCC2=C(C(=C1C=CC=C(C1=N2)F)NCC3(CCNCC3)C4=C(C=NC=C4)F)C,61418D05A357F009_FBECC10D7B7204CD_6041_DP,8.385342,00000000000000000000000000000000000000000010000000000000000000100110000000000000101000110011000000101100110110011010101011000100110101110110001011010111010110101111010,SKRGCFXIGFXPPU-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC3(C)CCC4(CC3)CC4,D49B79F0F4990340_00612099E519C0CB_6041_UN,7.748014,00000000000000000000001000000000000000000010000000000000000000000110000000000000101000010011000000101100010100001001101001000100110001110100001011010111010110101111010,HQLCZILFXODLTI-UHFFFAOYSA-N
O(C3CCN(CC1=CC=CC=C1)C2(CC2)C3)CCN4C(C)(COCC4)C,794C7A68F8C7D10E_BDB2E69D93E13607_6039_UN,8.195874,00000000000000000000001000000000000000000000000000000000010000000010000000110000000001100000000101101000010011011001101011100011110010000110001101011110110111111111110,RMSKDKNZEJESSF-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC3=C2CCOCC2=CC=C3,5E41524F0EBE5C93_99260EB0097A96BA_6041_UN,7.6619396,00000000000000000100100000000010000000000000000000000000010000000100000000100001001000100001010000101100010001001000001011000100110011010110011011011111010111101111110,VJVFTSCNVRAKMO-UHFFFAOYSA-N
CC1=CC(=C(C=C1)OC2CCCC2)NCC3C(F)(F)C34CCCC4,9E5832BCF737BC65_CBDE63F4C0E69712_7022_UN,7.785853,00000000000000000000001000000000000000000010000000000000000000000010000000000000001000010001000110001000010100001100001000000011110011110000000110010011110111101111110,SMEMJEZDKPLXQI-UHFFFAOYSA-N
O=[N](=O)C2=C1C=CN=CC1=CC=C2NC4=C3OCCCC3=CC(=C4)F,D81117DF0C986F67_4964359350B1A978_6041_UN,8.060661,00000000000000000000000010000000000000000010000001000000110000010100001100000001000000010001001101100110010101000100001111101100101011110100001011111011110011110111110,NPHHOKVGOHMPIT-UHFFFAOYSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(C[N]4C5=C(N=C4C)C=C(C(=C5)F)F)=O,B6F8E652300BB606_C30619290679DA2E_6038_UN,7.6351967,00000000000000000000000000000000000000100010000000000000010000000100000000010101000101010001100111001100110100110000111011100100000011110100001011011011111111111111110,AUSTXVHMRBKETG-UHFFFAOYSA-N
C[N]1N=CC=C1C2NCCC3=C2N=CN3CC4(CCNC4)C5=CC(=CC=C5)F,2DE3A71C440B28C4_65D273156EFEF017_6034_UN,7.641146,00000000000000000000000000000000000000000010000000001000000000100110000000010101101101110011011010101100110100011000001011101100110100100110001011011011010110101111010,RGYFDUYZUGJDTB-UHFFFAOYSA-N
CC1=C(N=C(N1CC2CCCN2CC3=C(C=CC=C3)Cl)C4CCCN4)C5=CC=CC=C5,3EBDBE5DA0B6D0C0_3A4F9A48E2E59C2D_6034_UN,8.623807,00000000000000000000000000000000000000100000000000000000000000100100000000010101001101110011000010001001100100010000101011100100110000100110001011011011010110101111010,GWTWGMXFCBBYOY-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NC[C@H]3CCS[C@H](C)C3)C,570A4853CD1FC521_EC6E0D3A422C5099_6041_UN,8.021623,00000000000000000000000000000000000010000010000000000000000000000100000000000000111000011011000000101100010110000001101011000100110001110110011011010111010110101111010,FWLGXHQOFPEUJA-RISCZKNCSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=N[N]4C,B12F8DE084546D0C_C7869E4EFBAADB79_6041_UN,7.5071187,00000000000000000000000000000000000000000010000000001000010000100100000010010001101101110011011010101000000111010001101011111100110011110110001011011111010111111111110,UIRYCNLXCWVJQE-HNAYVOBHSA-N
CC1=CC2=C(C(=C1)C)N=C(C=C2C)NC[C@@H]3CC[C@@H](O3)C4CC4,481599ABAF9BA0CF_464C06467A0A875A_6041_UN,7.360478,00000000000000000000001000000000000000100000000000000000010000100100000000000100001100000011000110101100010000000000001011000100110011010100011001010101110111101111110,NARLYOULGHSLHE-FUHWJXTLSA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NC34C(OCC3)CCCC4,6097DB93C8DDFE55_88B82EF86111D749_7022_UN,9.109573,00000000000000000000000000000000000000000000000000000000010000000010000000000000000100010011000111000101110101011000001000000100110011110100000011010011110011100111110,CRJDOQMZJZZYTJ-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC4=C(C=C(C=C4)C5CCOCC5)F,FF7B5F3B4324452A_3B450113ABF6BAA0_6041_DP,8.248984,00000000000000000000001000000000000000100010000000000000010000100100000000000101101101110001010010101000010111000000001011100100110111110110001011011011010011101111110,KNZYBUYCHNPWPD-GWTOYCKXSA-N
C[N]1N=C(C=C1NC(C2CCOCC2)C3=CC=C(C=C3)F)C4CCCC4,A630130B306E5E03_4E858DE1B5FEDEB1_6041_UN,8.013861,00000000000000000000000000000000000000100010000000001000010000100100000000010101100100110011011010100000000101000000001011101100110011110110001011011011010011101111110,FKVZSHJEANWLEQ-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)NCC2CCCN(C)C2C3=CC=CS3)C4CCNC4,1C45CE993338DF96_2B10188E5EA7C73E_6041_DP,8.056025,00000000000000000000000000000000000010100000000000000000000000100100000000010101111101101011010010101000100010010001101011100100110101010110001001011111010110101111010,SRYLWSAAKDPGJL-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)O[C@@H]6CC5=CC[C@@H]2[C@H](CC[C@@]3(C)[C@H]2CC=C3C4=CN=CC=C4)[C@]5(CC6)C,E621A52055FFD9A0_A2C0895CC5E66193_7022_UN,8.408906,00000000000000000000000000100000000000000010000000100000000000100110000000001000000000010000000010110100010110001101101001000111110010100100010111010110100001001111110,LWGGPIKGWGZMAT-WXFBTVQKSA-N
FC1=C(C=C(C=C1)NCC2(CCN(C)CC2)C3=CC=CC=C3)C4OCCO4,82FCAD8877FA3CBF_EB74775CBDE67BD0_6041_UN,7.687417,00000000000000000000000000000000000000000010000000000000010000100010000010010000001101110011010010101000000101011001101011110100110011110110001011011011010111111111110,STLJSOGYUAJBJU-UHFFFAOYSA-N
CC4(C)COC3(C[C@@H]2CC(OCC1=C(C=C(F)C=C1)F)C[C@@H]2C3)OC4,96E7FE071C1B78FC_F9CED0DBB62D5678_6039_UN,8.483076,00000000000000000000000000000000000000000010000000000000010000000010000000100000000000010100000010100100010101001001000010010011110010100110000111100110110101011011110,UMRJNIVBYNHIQY-FKEKPDDDSA-N
CN5CCC1=C(C4=C(N1CC2CC3(NCC2)CC3)C=CC(=C4)Cl)C5,8146CE354C493067_63F932E1E7708C08_6034_UN,7.1666102,00000000000000000000001000000000000000000000000000000000000000000110000000010000101101110011010010101101110100011001101011100100110000100110001011011001010110101111010,ZOMDYUPCNMTLRH-UHFFFAOYSA-N
C([C@]12C[C@H]1COC23CCC3)=CC4=C[N](C)N=C4C5=C(C=CC(=C5)F)F,6D202C3F2118E80C_B22E40DC5D11F625_7019_UN,7.4848995,00000000000100000000001000000000000000000010000000001000010000100110000000010000100100010000011010110000010101001000001011101100110010100100001011011010110011101111110,XUSKMQBXVBTPDJ-LIRRHRJNSA-N
C2(=C1CCCCC1=CC=C2)NC3=CN=C([Si](C)(C)C)C=C3,34251684EF50442E_34A3C89CF73B5154_6041_UN,7.094225,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100011010000100100010000001000001001000100110001010100011011011101000010101111010,KWBGRCZHTRHFEO-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)N[C@H]4[C@H](C3=C(C)[N](N=C3)C)OCC4,EEEE5503B574A650_8C25050B38E1242C_7022_UN,7.5104747,00000000000000000000001000000000000000000110000000001000010000100110000000010000100100010011011111000000100101011000001011101100000011110100001010011111110011101111110,UWEMBMDYOTYUGK-AEFFLSMTSA-N
BrC1=CC(=CC=C1)C2=CSC(=N2)C3=CC=CN3CC4CNCCC45CCN(C)CC5,A997FE280B702EAF_6F1D5840B4FCF28F_6034_UN,7.708381,00000000000000000000000000000000000010000000001100000000000000100110000000010001111101111011010010101000110100011001101011100100110000100110001011011011010110101111010,TWRDYBPDARBXQC-UHFFFAOYSA-N
FC1=CC(=CC=C1)C2=CSC(=N2)C3=CC=CN3CC4CNCCC45CCN(C)CC5,5E1A4CB17F3A062C_8B3C07818A3E5799_6034_UN,7.708382,00000000000000000000000000000000000010000010000100000000000000100110000000010001111101111011010010101000110100011001101011100100110000100110001011011011010110101111010,KDARZBRYKKENOS-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC(CC)NCC3=C(C=CC=C3)Br)C4CCNCC4,7A4C8F26DAE12F6B_479D8F0BDB4227CF_6034_UN,8.182575,00000000000000000000000000000000000000000000001000000000000000100100000000010001001101110001000010101100110110010010101011100100110100100110001011011111010110101111010,IOARGIOHEPVRMB-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2CCCC23CCNC3)F,24060E06B9BE2109_0A842082430B518C_7022_DP,7.499037,00000000000000000000000000000000000000000010000000000100000000000010000000100000101101110011010010001000110100011001001001100000110101110110001010011111010110101111010,FUPAKMPDOQELKU-UHFFFAOYSA-N
CCNC5CCC1=C(C4=C(N1CCC2NC3=C(OC2)C=CC(=C3)F)C=CC(=C4)Cl)C5,BCD6858718EF03CE_1A6DA21F96CF823E_6034_UN,8.111171,00000000000000000000000000000000000000000010000000000000010000000100000000010000101101010011000110101101110111010110001011100100110101110110001011011001110111101111110,IKNBDUCOZZPJAS-UHFFFAOYSA-N
CN(CC1CCNC1)C2=NC=C(N=C2)N[C@@H]3C5=C(OC4(C3)CCCC4)C=CC(=C5)F,D9312AC0D2813C8A_2A2B193006278C08_6041_DP,8.073077,00000000000000000000000000000000000000100010000000000000010000000110000000000101101101110011010011101100110110011101001011100100110111110110001011011001110111101111110,AIICSZOWZZWSAM-CVMIBEPCSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CCNC3(C2)CCC3,C79CF321FDD49FD9_3F079F74708AD69F_6041_DP,7.44473,00000000000100000000100000000010000000000000000000000000000000000110000000100001001000100011010000101000110000011000001011000000110101010110011011011111010110101111010,POTUTEBMZBRDKY-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC(OCC)C3CCOCC3,EDEFCEB81CEB7DB9_F5618462B9CEE4BD_6041_UN,8.134548,00000000000000000000000000000000000000100010000000000000010000000100000000000100001000110001000100101100010111000010001011000110110011110110011011010111110111111111110,KXBFMKZQFADFLB-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=NC=C2)NC4=C(C=C3OCCOC3=C4)[N](=O)=O,6F1A475B5E1B4D7B_93BAF80B93AEFB38_6041_UN,8.454035,00000000000000000000000010000000000000000010000001000000110000010100001110000001000000010000001001100110010101000100001111101100001011110110101011111011110011110111110,HTTHZSDNUBIKCJ-UHFFFAOYSA-N
FC1=CC3=C(C(=C1)NCC2CCOC(C)(C2)C)[NH]C=C3,9BB652F7C5A38365_537C32580B691FC8_6041_UN,8.207785,00000000000000000000000000000000000000000010000000000010010000000110000000100001001100010011000010101100010111001001101011000100110111110110001001010101110111101111110,FDXLQCTZICOFJC-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC34OC(C)(C)C(C3)C4,E7CE216CF2994070_B5E98150DC980C3A_6041_UN,7.484366,00000000000100000000000000000000000000100000000000001000010000100110000000110101101101000010011110001000010010001000100011101100100011010100011010001111110111101111110,UFCCDTJQXPXYEC-UHFFFAOYSA-N
O([C@H]1[C@@H](CNC1)CC2=CC=CC=C2)C3=C(C=C(C=C3Br)Br)C#N,49A4ADC7AEB6DB8B_C5433A71739FBA4A_6035_UN,7.766722,00000000000000000000000000000000000000000100001000000000000000000000000000000000001100110011000111001000000100000100000001000111110010100110001111000011110101100111110,JIUSYOASBVWNRJ-RHSMWYFYSA-N
O([C@H]1[C@@H](CNC1)CC2=CC=CC=C2)C3=C(C=C(C=C3Cl)F)C#N,458509C4D1BC667D_48DBC35F70D66BB6_6035_UN,7.7667084,00000000000000000000000000000000000000000110000000000000000000000000000000000000001100110011000111001001000100000100000001000111110010100110001111000011110101100111110,QTBHBUQGVYKEIY-RHSMWYFYSA-N
CC1=C(C=C(C=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C,7C91F85F6B8FB9E9_EF7F2FF7F0CD7972_6041_DP,8.328737,00000000000000000000000000000000000000000010000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010111010110101111010,OVTHZWFUASZSJV-FXAWDEMLSA-N
N1CCC3(CC1)OC4(COC2=C(C=C(C(C)C)C=C2)Br)CC3(N)C4,39A43223EFF71870_600E3DC3E57E6CE6_6035_DP,7.9977303,00000000000100000000000000000000000000000000001000000000010000000010000010100000001110110011000111101000110101011100001011000011110111100110001111010111110111111111110,RNSGWFDEGIQDHN-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NCC23CC(C)(CO2)CCC3)C4CC4,D0BDE510A6F9B44A_9A45279799FCCC77_6041_UN,6.855632,00000000000000000001001000000000000000000010000000000000010000100010000000000000001100010011000110001000010111001001101000000000110011110110000011010011110111101111110,WMUAEORKFQXTJG-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=NC=C3)NC5(CC4=C(C=CC=C4F)F)CCCC5,5B8C319BCC9B33E2_DBE54972310C412F_6041_DP,8.612299,00000000000000000000001001000000000000100010000000000000000000000110000000000100101101110011010010101000111110011000001011100100110101110110001011011011010110101111010,NDNDGQXTASFDGO-NYTJIUQPSA-N
CC1=C(C=C(C(=C1)NCCC2CCN(C)CC2)Cl)C3CC3,DCEAC412C03CCBE8_CE7D76A81003C625_7022_UN,7.93663,00000000000000000000001000000000000000000000000000000000000000100000000000010000001001110001010000101001100110010001101001100000110001110110001011011111010110101111010,BBCOCHKPVGOBAA-UHFFFAOYSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(C4=CC=CC(=N4)CC)=O,5D2BC2E530AFC145_68856098E0AB3F56_6038_UN,8.185483,00000000000000000000000000000000000000000000000000000000010000000100000000000001000100000001100111100100010000110010011011000100000011010100001011010001101111111111110,RHTNBCVLHXFVMJ-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2CC2)NC4CC(C3=NC=C[N]3C)OCC4,BB819A228192CB05_413CE5B97314A35C_6041_UN,7.888391,00000000000000000000001000000000000000100010000000000000010000100100000000010101000101010010010111100000100111010000001011100100110011110100001011011011110011101111110,XHMWRUUEGLMNFD-UHFFFAOYSA-N
N4C[C@@H]1COC[C@]1(C=CC2=C(C)[N](C(=C2)C)C3=C(C(=C(C=C3)F)F)F)C4,49924F1796012C18_4FB4C61144163364_7019_DP,8.638214,00000000000000000000000000000000000000000010000000000000010000100110000000010000001101110011000011011100010101001000000011100100110001110110001010001111010011101111110,KLCWKTRTXIBFOD-QRWLVFNGSA-N
CC1=NC(=C(C(=N1)NCC23OC(C)(C)C(C2)C3)C)[N]4C=CC=N4,1988E189F77A8EB3_3BD09B15A10C1270_6041_UN,7.2541933,00000000000100000000000000000000000000100000000000001000010000100110000000110101101100000010001110101000010010001000100011101100100011010100011010001111110111101111110,UYKPKJSNZCHJBQ-UHFFFAOYSA-N
N(CC1C2(CC1)OCCC2)C(=O)C3=CC=C(C=C3)C4=CC(=C(C(=C4)F)F)F,3925E76DA84AA651_F02A5B7F78154498_6038_UN,7.595389,00000000000100000000000000000000000000000010000000000000010000100010000000000000001100010011100011001000010101101000011000000100110010100110000011010011111111110111110,YXLQNJQEZMKIJT-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CCC3NCCCC3C)Cl,E938D96469B3453D_2706395ABB433891_6034_UN,7.6714344,00000000000000000000000000000000000010000000000100000000000000000100000000010110111101011011000010101001101110010001101111100100110101110110001011011111010110101111010,LQPQNOJTNYGBPS-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)C[N]3C=CC4=C3C=C(C=C4)F,BF17EE5BA49A77DA_AB133B6505AB1073_6038_UN,7.7192225,00000000000000000000000000000000000000000010000000000000000000000100000000010001001101010011100110011100110100110000011001100100110010100110001001011001011110100111110,IESGXTKNNIFEPE-UHFFFAOYSA-N
NCC(C1=CN(C2=C1C=CC=C2)C[C@H]3O[C@H](OC)CNC3)C4=C(C=C(C=C4)Cl)Cl,E520FF7E41E9D459_93BB566D4F75836A_6034_UN,7.8290944,00000000000000000000000000000000000000000000000000000000010000000100000000010000101111110010010110101101010100000000100011110111100110100110001111001011110111111111110,SQXLDBYQZJRUOC-YXHQUHRKSA-N
O(CCN3CC1=C(C=CC=C1)C2(CC2)C3)CC4=CC(=CC5=C4OC(OC5)C6=CSC=C6)F,C970D26D57365F1B_19964D86E7A584AC_6039_UN,8.298461,00000000000000000000001000000000000010000010000000000000010000100010000000010000000101111100000110101100010101011100001011110110110010100110000011111000110101110111110,HRPAPYRTECHRMV-UHFFFAOYSA-N
C(N1CCNCC1)C3=CC2=C(C=CC=C2)[N]3C[C@@H]4CNCC(O4)(C)C,DA3418703F1C118E_DA359699307DA5C0_6034_DP,8.061582,00000000000000000000000000000000000000000000000000000000010000000110000000110001101101100011000110101100110010011001001011100100110110000110001011011111110111101111110,WJEKYTDEKUMHFV-SFHVURJKSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2CCCCCC2C3=CC=CC=C3,9A0691C14192AEF8_4B8DBDFBB13FE5EA_6041_UN,7.7256737,00000000000000000001100000000010000000000000000000000000000000100100000000100001000000100011010000100000100000011000001001000100110001010100011011011111000010101111010,RVJLFVHLYNPSTL-UHFFFAOYSA-N
N(CC1CN2CCC1CC2)C(=O)C3(CCCC3)C4=CC(=CC(=C4)F)F,53D7C22C8EAF8D4C_D4CAD6B92FA5293E_6038_UN,7.2204823,00000000000000000000000000000000000000000010000000000000000000100010000000000000101001110011100010101000010100111000011001100000110000100110001001011001011110100111110,BIQQPSAMNYIXLZ-UHFFFAOYSA-N
CN(CC1CCNCC1)C2=NC=C(N=C2)N[C@H]3[C@@H](C3)C4=C(C(=CC=C4)F)F,27A8FE29D2A2C3E0_DC0115064AFF0E52_6041_DP,8.253429,00000000000000000000001000000000000000100010000000000000000000100100000000000101001001110011010000101000100110010001001011100100110101110110001011011011010110101111010,VXNRTDMRUBGELZ-DOTOQJQBSA-N
N1CC2CCC1CN2C3=NC(=NC=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,CDF69CF3958AEF1D_E125FD317F1496D0_6041_DP,7.8350625,00000000000000000000000001000000000000100010000000000000000000100100000000010101101101110011010010101000111110010001101011100100110101110110001001011011010010101111010,TXVWZWYBZRSVIR-ZZVGESKWSA-N
FC1=C(C=C(C=C1)NCCCN2CCN(C)CC2C3=CC=CC=C3)C4OCCO4,FC75EF77B0B08A3A_31D35F624DFCEA3E_6041_UN,7.902725,00000000000000000000000000000000000000000010000000000000010000100000000010010001101101110010010010101000100101010001101011110100110011110110001011011011010111111111110,LPHPMUAAHBWUBZ-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NCC2(CCCC2)C3=C(C=CC=C3)F)F)C4,618BE3DCC9F1E852_81F8424F0935ECB3_6041_UN,7.5675287,00000000000000000000000000000000000000000010000000000000000000100010000000010000001001110011000010101100010110011010101001100100110001110110001011011011010110101111010,ZFZTVPQYASIKNH-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NC[C@H]2[C@H](CCCC2)N3CCOCC3,FFA5743A148C0980_F4DA2EC150049516_7022_UN,8.545837,00000000000000000000000000000000000000000010010000000000010000100000000000010000101001110011000100111000000101010000001011100000110011100110001001011011010111100111110,NDOBYRVZDWXGLZ-LPHOPBHVSA-N
[NH]1C=CC2=C1C=CC(=C2)NC4=C(C=C3OCCCC3=C4)[N](=O)=O,BC6950DCC22B672F_5618EEFBB898EE8F_6041_DP,8.877208,00000000000000000000000010000000000000000000000001000000110000010100001100000001000100000001001011100110010001000100001111101100101111010100001011111011110011110111110,BYLXJXSPJGPFHA-UHFFFAOYSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)NC4=CC=CC(=C4)CC5CCCN(C)C5)F,4712E226BD477FEE_8D4C4013033ABCA6_6041_UN,6.840748,00000000000000000000000000000000000000000010000000000000000000000100000000010000100001110011010000101100010110010001101011100100110001110110001011011111010110101111010,ODABOTNNGPLFIQ-UHFFFAOYSA-N
CN(CC1CCNC1)C2=NC(=CN=C2)N[C@H]3[C@H](CC3)C4=C(C=C(C=C4)F)F,6D5660AAD6D8B1A8_8B4DC60AE7F45447_6041_DP,8.070433,00000000000100000000000000000000000000100010000000000000000000100100000000000101101101110011010010101000100110010001001011100100110101110110001011011011010110101111010,QNJFUANNMXJWCH-FMRBYIFOSA-N
O(C3CCC4C1CC(C2OC12)C34)CC5=NC(=CO5)C(C)(C)C,707FBF58ED5BFF82_8E752B687858C432_6039_UN,8.800028,00000000000000001001001000000000000000000000000000000000010000000110000010100000000100000000100110100100010001111000011011000011110010000100010101110100110111011111110,KQLAIFPGHMQESJ-UHFFFAOYSA-N
CC3CC(C)CC(C=CC1=C[N](C)N=C1C2=C(C=CC(=C2)F)F)C3,53C584CC258DFD8A_96D6D93D0FE237B7_7019_UN,8.342583,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010000000110000001000011101100100000100100011011001110000010101111010,FGYLAXOMLBFEJL-UHFFFAOYSA-N
N1CC2CC(C1C=C2)C(=O)OCC3=CC(=C(C=C3)F)CBr,2A4A5FF80BC0FD72_5E69699A9F7A0C3E_6031_DP,8.369568,00000000000000000000000000000000000000000010001000000000000000000000000000000000001000010010000001111000010101000000000001010010100000100110000011000011011111110111110,IZQXKGAZLNKTJG-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)C#N)NC(C2CNC2)C3=CC=C(C=C3)F)C,A087C961339FFADC_00A7C67E77D8B875_6041_DP,7.496697,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110010000000001000000100000000000001000100000101110110001011000111010010101111010,DIXJNSHLRNXIHQ-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC3CC4CCC(C3)O4,3A6D5FF11D25F16F_D2CC0F4B3D83F0CB_6041_UN,8.094807,00000000000000000001000001000000000000000010000000000000010000000100000000010101001101010010010010101100011110000000001011100100110011110100001011011011110111101111110,YVKUURNKNLXLNX-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC3=CC(=C(C=C3)C4CC4)F,A4B0502710B71E36_062055BDDACF63E0_6041_DP,8.028799,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101000100110010000001011100100110101110100001011011011010010101111010,BBPCXWFTNNQMFZ-UHFFFAOYSA-N
CC1C3CCC(CC1NC(=O)CC2=CC(=C(C=C2)Br)F)N3,F08E3EAF349C887A_B824FCFB617C8F83_6038_DP,7.7737885,00000000000000000001000000000000000000000010001000000100000000000000000000000000100100010011100010100000110110110000111001000000110111100100001011010011001110101111110,GVDIOURJJKZWDW-UHFFFAOYSA-N
CC1C3CCC(CC1NC(=O)CC2=CC(=C(C=C2)Br)Cl)N3,825510AB1A898391_6C0C2D511C9CBA46_6038_DP,7.773781,00000000000000000001000000000000000000000000001000000100000000000000000000000000100100010011100010100001110110110000111001000000110111100100001011010011001110101111110,WYLOORLOMRHXBD-UHFFFAOYSA-N
CC1C3CCC(CC1NC(=O)CC2=CC(=C(C=C2)F)Br)N3,75371924CE4F6AD5_B1D68F23A0424996_6038_DP,7.7737765,00000000000000000001000000000000000000000010001000000100000000000000000000000000100100010011100010100000110110110000111001000000110111100100001011010011001110101111110,OYVMULVAVDECDM-UHFFFAOYSA-N
CC1C3CCC(CC1NC(=O)CC2=CC(=C(C=C2)F)Cl)N3,F44BD4A5825387AC_B865368F7F952EBC_6038_DP,7.773772,00000000000000000001000000000000000000000010000000000100000000000000000000000000100100010011100010100001110110110000111001000000110111100100001011010011001110101111110,FNPFZRKRALIIEK-UHFFFAOYSA-N
CC1C3CCC(CC1NC(=O)CC2=CC(=C(C=C2)Cl)F)N3,5B456C5BDB680775_DD69E4F1CA5D4B83_6038_DP,7.7737694,00000000000000000001000000000000000000000010000000000100000000000000000000000000100100010011100010100001110110110000111001000000110111100100001011010011001110101111110,UGPZQJANWNAVAY-UHFFFAOYSA-N
CN(CC1CCNCC1)C2=NC(=NC=C2)N[C@H]3[C@@H](C3)C4=C(C(=CC=C4)F)F,A47663C9FFB57D9A_079FBF859113FDEC_6041_DP,8.239659,00000000000000000000001001000000000000100010000000000000000000100100000000000100101001110011010000101000101110010001001011100100110101110110001011011011010110101111010,XKVHPMDOYSPQER-DOTOQJQBSA-N
CC1C3CCC(CC1NC(=O)CC2=CC(=C(C=C2)Br)Br)N3,EF0BC091A2E62E99_2AA9474D562E4C79_6038_DP,7.7737646,00000000000000000001000000000000000000000000001000000100000000000000000000000000100100010011100010100000110110110000111001000000110111100100001011010011001110101111110,POFOIEZONWQDAC-UHFFFAOYSA-N
CC1C3CCC(CC1NC(=O)CC2=CC(=C(C=C2)Cl)Cl)N3,D5D771E0B5320997_7D8BA02F26AB1A0B_6038_DP,7.7737603,00000000000000000001000000000000000000000000000000000100000000000000000000000000100100010011100010100001110110110000111001000000110111100100001011010011001110101111110,QZYPAYNBXAGBRL-UHFFFAOYSA-N
CC1C3CCC(CC1NC(=O)CC2=CC(=C(C=C2)I)Br)N3,32B883E32C2E9421_AF1BFBB864810222_6038_DP,7.7737556,00000000000000000001000000010000000000000000001000000100000000000000000000000000100100010011100010100000110110110000111001000000110111100100001011010011001110101111110,HXMARPAZGUUMCM-UHFFFAOYSA-N
CC1C3CCC(CC1NC(=O)CC2=CC(=C(C=C2)F)F)N3,68979C221AB162EF_F5383877143CCDFF_6038_DP,7.773755,00000000000000000001000000000000000000000010000000000100000000000000000000000000100100010011100010100000110110110000111001000000110111100100001011010011001110101111110,XRVPTSAYRUEPRL-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CC2(CNCCC2)C3=CC=CC=C3)C(=CC(=C4)F)F)C5,FE2B0484BC190775_9CD908DE28A9F492_6034_UN,8.1007805,00000000000000000000000000000000000000000010000000000000000000100110000000110000101101110011000010101100110100011001101011100100110000100110001011011101010110101111010,MINKLZKHLVFMAE-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=CC=N2)NCC(N3CC(C)OC(C3)C)C4=C(C=CC=C4F)F,861E16B781B47DA5_EF6A2426AFA2958B_6041_UN,8.21135,00000000000000000000000000000000000000000010000000000000010000000100000000010001001001110001000100101100010110010001000011100100110011110110011011001111110111101111110,LJAVBGWMGZXXBE-UHFFFAOYSA-N
C1CC(CCN1)C2=CN(C3=C2C=CC=N3)CC4=CC(=C(C=C4)N5CCCCC5)F,43C27CD5271DD222_B8298935934EB933_6034_UN,8.7528,00000000000000000000000000000000000000100010000000000000000000100100000000010100001101110001000010101100110100010000001011100100110001110110001011011011010110100111010,GOJAJRIVMFMABI-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC3CC3C4CCCNC4,A6A9A3F179DC5072_92B8E0C424FF6A9B_6041_DP,8.378945,00000000000000000000001000000000000000000010000000000000000000100100000000100000101000110011000000101100110100010000001011000100110101110110011011010111010010101111010,IFPZMOXBBBGTTJ-UHFFFAOYSA-N
O(C1CCOC(C1)C2CCOCC2)CCC3N(C)CCC3,F2D24F196DF20AB6_CE01E9E21E1BB708_6039_UN,6.9999266,00000000000000000000000000000000000000000000000000000000010000100000000000010000000101100100010011101000000011010001101011100011110010000110000101111010110111111101110,LHSSZYOUKKOTTB-UHFFFAOYSA-N
CCN3CCC1=C(C(=CC(=C1)NC(CC)C2CCCCC2)F)C3,E33A3CF5FC425D2C_B327395FB550B1DC_6041_UN,7.5191927,00000000000000000000000000000000000000000010000000000000000000000000000000010000000001110011000000101100110110010010101001100000110001110110001011011101010110101111010,CNIVXKSTZJCLMF-UHFFFAOYSA-N
NCC(C1=CN(C2=C1C=CC=C2)C[C@H]3[C@@H](CNC3)C4CCOCC4)C5=C(C=C(C=C5)Cl)Cl,AB42C025A3C94CCB_F245DACA0C365907_6034_UN,7.9153066,00000000000000000000000000000000000000000000000000000000010000100100000000010000101111110011000010101101010101000000001011100100110110100110001011011011010111100111110,ODUCBCYZIQJFIM-DGCGVQPYSA-N
FC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]5N[C@H]4CCO[C@H]4C5,90F965863F1FC3E7_057BD311F3255789_6034_UN,8.502794,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101010011000111001100110101010000001011100100110110100110001010011011110111100111110,CVCQVTXYARBFPY-JYDALHQQSA-N
C1(=C(C=CC=C1)CN2CCCCC2)NCC3CCN(C)C3C4=CC(=C(C=C4)Cl)F,4868A47D78270890_E92BF632EC084D72_7022_UN,8.150441,00000000000000000000000000000000000000000010000000000000000000100000000000010000101101110011010010101001000110010001101011100100110001110110001011011011010110101111010,ILKJOXXZJKXXKJ-UHFFFAOYSA-N
FC1=CC(=CC=C1)NCC2=NC=CN2CC4[C@@H]3C[C@@H](C3(C)C)CC4,9F265C27EE73B985_4F22228DB0183F6D_6034_UN,8.087772,00000000000100000000000000000000000000100010000000000000000000000110000000110101001101010001000010001000010110011000101011100100110001110110001011011111010110101111010,MXWDADGRMCSILI-UFFKYAFASA-N
C(C1CCNCC1)C2=CN(C=N2)CC4(CC3=CC=C(C=C3)Cl)CC4,450243CB54DC4512_D265E14D1E366085_6034_UN,8.046463,00000000000000000000001000000000000000000000000000000000000000000110000000010101001101110001000010101001100100011000001011100100110000100110001001011001010110100111010,JERSMABPNONRSG-UHFFFAOYSA-N
C(C1CCNCC1)C2=CN(C=N2)CC4(CC3=CC=C(C=C3)F)CC4,915FB7DAC683DBD5_210B3D2C6FA6920E_6034_UN,8.046462,00000000000000000000001000000000000000000010000000000000000000000110000000010101001101110001000010101000100100011000001011100100110000100110001001011001010110100111010,NDSSDYWVBRPAME-UHFFFAOYSA-N
CC1=C[N](N=C1)CC2=C(C=C(C=C2)NCC3CC4CCC3N(C)C4)F,C55DF773829B06EB_971F2C35518AFA39_6041_UN,7.9655037,00000000000000000000000000000000000000000010000000001000000000000100000000010000101101110011011010101000010110010001101011101100110001110110001011011111010110101111010,QYUXPLYTCLKSMB-UHFFFAOYSA-N
ClC1=CC(=CC=C1)NCC2=NC=CN2CC4[C@@H]3C[C@@H](C3(C)C)CC4,7DB923864568DEE4_12FD957E100F9D6C_6034_UN,8.087749,00000000000100000000000000000000000000100000000000000000000000000110000000110101001101010001000010001001010110011000101011100100110001110110001011011111010110101111010,PFNSAOQVQIDDPF-UFFKYAFASA-N
FC1=CC2=C(C=C1)C(=CC=N2)NCC(N(C)C)C3CCCCC3,F6AB86C6921CC696_23DC093109B86368_6041_UN,7.700166,00000000000000000000000000000000000000000010000000000000000000000100000000100001101001110001010000101100010110010000101001100100110001110100001001011101010110101111010,HJUATNSOBKCCMN-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)CC#N,09323F6BF5FF9B67_6B0EB54BA4E70664_6041_DP,7.7494564,00000000000000000000000000000000000000000110000000000100000000100100000000010101101101110011010010001000000110010000000011100100110101110110001010001011010110101111010,AHXFBIQGYKXNQQ-DZGCQCFKSA-N
CN(C)[C@@H]1CCC[C@H]1OC2=CC(=C(C)C=C2C3CNCC3)Cl,A1750EE5115701EB_5C633DFE0FA9437E_6035_UN,8.347179,00000000000000000000000000000000000000000000000000000000000000100000000000100000001101110011010110001001100110010100101001100011010011100110011110011111110011101111110,MPGGWPALNKLLKB-SYFTWWQRSA-N
CN(C)C1=C2C(=CC=N1)C(=CC=C2)NC4CCC3=NC(=C[N]3C4)C5=C(C=C(C=C5)F)F,EE3A2D76838279C7_DE6983900775829A_6041_UN,7.8605375,00000000000000000000000000000000000000100010000000000000000000100100000000100101000101110010010010101100110100010000001011100100110001110100001011011111010010101111010,PJAUOFXEMBEGSX-UHFFFAOYSA-N
CCOC3CC(OCC1CC2(CO1)CCOCC2)C34CCCC4,0179928FDCA12752_71246BC37DD79F6D_6039_UN,7.443189,00000000000100000000000000000000000000000000000000000000010000000010000010000000000100100100000010100000010011001010001010000011110010000110100100110000110101011001110,KCFXJNYFOGMRBH-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C(N=C2)NC4C[C@H]3CCC[C@H](N3C)C4,79F2ABBD744CD5DE_7D5BBFC9E2D7DA1B_6041_UN,8.067508,00000000000000000000000000000000000000100010000000000000000000000100000000010100100001010001010000100100110110010000101011100100110001110100001001011001000010101111010,OANYIZJTYVNRJD-ALOPSCKCSA-N
O(CC1(CNCC1)C2CCOCC2)C3=C(C=C(C=C3Br)Br)C#N,BA02D50C5D5F7EEA_6907690BBA484F28_6035_UN,8.369112,00000000000000000000000000000000000000000100001000000000010000100010000000000000001100110011000011101000100101011100001011000011110010100110001111010011110101110111110,KFZPUOCVKJCFEX-UHFFFAOYSA-N
O(CC1(CNCC1)C2CCOCC2)C3=C(C=C(C=C3Cl)F)C#N,29EAA46B9E434DE8_E49F9025B9019ED4_6035_UN,8.369103,00000000000000000000000000000000000000000110000000000000010000100010000000000000001100110011000011101001100101011100001011000011110010100110001111010011110101110111110,YNTVOORNZZTUPQ-UHFFFAOYSA-N
FC2=C1C=NC=CC1=CC(=C2)NC3=CC=CC(=C3)CC4CCCN(C)C4,3086662C3F122CFE_AF0F15C6A48D9AC7_6041_UN,7.9605775,00000000000000000000000000000000000000000010000000000000000000000100000000010000000001110001010000101100010110010001101011100100110001110110001001011001010110101111010,YJYDINHTMDQAOM-UHFFFAOYSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC3=CC2=C(C=C(C)C=C2C)[NH]3)C4,39F2F8CA40CC7E08_18B8797C7F9862E2_7019_DP,8.554155,00000000000000000000000000000000000000000000000000000000000000000100000000000000000100000010000010010100110000010000001011000100110100000100001001010101000010101111010,YGRMZCRIWUJTSD-CPUCHLNUSA-N
CN(C)CC1=C(C=C(C=C1)NC2=CC4=C(C=C2)OC3(CCCC3)O4)F,62597EC04A5C052F_960DFD6B36A5BEBE_7022_UN,7.6300774,00000000000000000000000000000000000000000010000000000000010000000000000010100000000101110000010011001100010100001101001010110100010011110100001011011111110111111111110,IRAKPMYYUZGLDA-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC[C@@H]2CNC[C@H]2C)F)CC3,5F8C10BD2FBB7D03_0D12467CAA8C4151_6041_DP,7.8846526,00000000000000000001000000000000000000000010000000000000000000000000000000010001101101110011010010001000100110010001101011100000110101110110001010011111010110101111010,YRUWDSXJGHASNL-IAGOWNOFSA-N
O=[N](=O)C1=CC(=C(C=C1)F)NC2=CC4=C(C=C2)OC3(CCCCC3)O4,85B17E2F0CAB5E34_14082D7CBD32A891_6041_UN,8.278483,00000000000000000000000010000000000000000010000001000000110000010000001110000000100100010000001011000110010100001100001110111100111011110100101011111011100011110111110,SHHCYIZIAVKQBF-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C3CCC2O3)NC[C@@H]4CCCN(C)[C@H]4C5=C[N](N=C5)C,91BDB40EAA208236_A799472386B96288_6041_UN,7.2616625,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101100011011010101100010010010001101011101100110011010110001011011111110111101111110,DTPFSYDCVQLFJX-XJPVNGNMSA-N
FC1=CC(=C(C=C1)NCC2CCCN(C)C2C3=CC=CS3)C4CC4,48E010E18DDE9355_60F82A3582FE8CBD_6041_UN,7.9249187,00000000000000000000001000000000000010000010000000000000000000100000000000010000111101111011010010101000000110010001101011100100110001110110001011011011010110101111010,YPWUUXGTYCCKMU-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)N[C@@H]3C[C@H]3C4CCNCC4,5ACE45F9BDA9CFEC_9F17E6EC1B22863E_6041_DP,7.8845673,00000000000000000000001000000000000000100000000000001000000000100100000000010101101101100011011010101000100000010000001011101100110101010110001011011111010010101111010,GEVXLLPHDXNVGF-DOTOQJQBSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)N[C@H]4[C@@H](C4)C5=C(C(=CC=C5)F)F,54F21DB03D637493_9A0A591CBC4CA08D_6041_DP,8.260601,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000110110010000000011100100110101110110001011001011010010101111010,HRMCWQZUPZCYPC-KHPYRJPYSA-N
BrC1=CC=C(C=C1)N2C=CN(C2=O)C[C@H]4[C@H]3CNC[C@H]3OC4,2F3939793EBF64AE_AE0E06EE1C124FF9_6034_UN,8.442755,00000000000000000000000000000000000001000000001000000000010000100100000000010101001101110001000111001100011101100100010011100101110011110110001110001011111111110111110,UQKIIIJXDOZGDK-KCPJHIHWSA-N
ClC1=CC=C(C=C1)N2C=CN(C2=O)C[C@H]4[C@H]3CNC[C@H]3OC4,C9E7BD165957469D_D2AA0CDFF6AE517D_6034_UN,8.442747,00000000000000000000000000000000000001000000000000000000010000100100000000010101001101110001000111001101011101100100010011100101110011110110001110001011111111110111110,PLLOZPGBZQUDPT-KCPJHIHWSA-N
CN(C)CC1=C(C=C(C=C1)NCC4CN2CC3CC2(C3)CO4)F,8B1898AEC67E3207_D1D1EFAABB6BB293_7022_UN,7.5767393,00000000000100000000000000000000000000000010000000000000010000000010000000100000101101110011010110101100010101011001000011100000110011110110001011001111110111101111110,VTJRUEAMFRVCFR-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCCC2CCOCC2)Cl)C3CC3,A2887134B17C91A2_E0A3E3818F118E8E_7022_UN,7.5376573,00000000000000000000001000000000000000000000000000000000010000100000000000000000001000110001000000101001100111010000001000000000110011110110000011010011010111101111110,UNMJQVNIVHWKTH-UHFFFAOYSA-N
C[N]1N=NC(=C1NCC23OC(C)(C)C(C2)C3)C4=CC=CC=C4,21111D5B62FF7CF4_6D2A1165912EEF23_6041_UN,7.5007677,00000000000100000000000000000000000000100000000000001000010000100110001000110101101100000010011110001000010010001000100011101100101011010100011010001111110111101111110,QWLDSYABZAEWHL-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)COC2)[S](C3=CC=CC4=C3[N](C)C=C4)(=O)=O,6825F5AAC12D10F6_FCA80447B104A2F2_6028_UN,8.568051,00000000000000000000000000000000110000000000000000010001011111001101010001010000110101101001011011000110011001001000010011101100011001011110001011101001010011111111110,IOTHEIYZOCGHNA-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)N[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,50D4FC721BE8F686_27B189B6DD2BB9A2_6041_DP,8.198058,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101010011010111101000100111010000001011100100110111110110001011011011110011101111110,ONFBRGVBNPAGOJ-AGPBCMBSSA-N
N1CCCC2=C1C=C(C(=C2)N[C@H]4[C@H](C3=C(C)[N](N=C3)C)OCC4)F,89F8EDAE49A01153_F41BAC598E47B598_6041_DP,8.052204,00000000000000000000000000000000000000000010000000001000010000100100000000010000101100010011011111101100110101010000001011101100100111110110001011011111110011101111110,YRBMXTSRPXFOBM-QAPCUYQASA-N
N1CC4(C1)OC5(COC3=C2C=C(C=CC2=CC=C3)Br)CC4(N)C5,7815B24DBAA8B8CE_FA47B1158BB366D3_6035_DP,7.7681546,00000000100100000000000000000000000000000000001000000100010000000010000010000000101110110011000111001100110101011100000011000111110111100110001101000001110111110111110,VETGLGGGQKHGLP-UHFFFAOYSA-N
N1CC4(C1)OC5(COC3=C2C=C(C=CC2=CC=C3)F)CC4(N)C5,33687B9B69A4E9F4_1AFE9817A3DFB2F8_6035_DP,7.7681437,00000000100100000000000000000000000000000010000000000100010000000010000010000000101110110011000111001100110101011100000011000111110111100110001101000001110111110111110,ZWQGBLZYWHZKIC-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC3CCC2(CC2)C3)F,E183A131D979E1F5_BC80712A51EA9B12_7022_UN,7.6377335,00000000000000000000001000000000000000000010000000000000000000000010000000100000001001110011010010001000010100001001001000100000110001110010001010011111010110101111010,RCNUMVZSSNZXMY-UHFFFAOYSA-N
N1CC4(C1)OC5(COC3=C2C=C(C=CC2=CC=C3)Cl)CC4(N)C5,FDE73FBC1797E944_0F2DA5CF0A621BC0_6035_DP,7.768111,00000000100100000000000000000000000000000000000000000100010000000010000010000000101110110011000111001101110101011100000011000111110111100110001101000001110111110111110,ZEUGDDBPFGGOIQ-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2CCCCC23CCNC3)F,3CEF7384F5437340_B4FE269F34CE791F_7022_DP,7.473946,00000000000000000000000000000000000000000010000000000100000000000010000000100000101101110011010010001000110100011001001001100000110101110110001011011111010110101111010,WLHQNLJRQHOHPP-UHFFFAOYSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NCC3C4CCC(C3)CC4,3007FEBF46CC2004_ACABBE9874D98EBD_6041_UN,8.208873,00000000000000000000000001000000000000000010000000000000000000000100000000010101001101010011010010001100011110000000001011100100110001110100001011011011010110101111010,DTJDGZTVLVIRSE-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC3CC2(CCN2)C3,9E15C2E07F265ABF_3F43C6E7CFFE46B0_6041_DP,7.276137,00000000100100000100100000000010000000000000000000000000000000000110000000100001001000100011010000101000110000011000001011000000110101010110011010011111010110101111010,NVTXFVSYNDQOFG-UHFFFAOYSA-N
CC1(C)CCCCC1C=CC2=C(Cl)C=CC3=C2OC=C3,0F03E99C7FD65935_BF95CDEC3672628F_7019_UN,8.496238,00000000000000000000000000000000000000000000000000000000010000000010000000100000000100010000000010010101010110001001101000000100110000100100000011010110100000001011110,IANNJIKBNOJJFO-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NCC4(C3=C[N](C)N=C3)CCCO4,E159C6899082A62C_AB5BB655D67623E2_7022_UN,7.8084254,00000000000000000000001000000000000000000010000000001000010000100110000000010000101100010011011111001000000101001000001011101100110011110110001010011011110111101111110,GJUPUNWZVMNMNB-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NCC4(C3=C[N](C)N=C3)CCCO4,A88AD9B7AEA04981_5F9B44589E35825D_7022_UN,7.808419,00000000000000000000001000000000000000000000000000001000010000100110000000010000101100010011011111001001000101001000001011101100110011110110001010011011110111101111110,OBWNAPHZWAIKSS-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC[C@@H]3OCCN(CC)[C@H]3C4=CC=CC=C4)F,F7689B5C5E7E8198_C70135F335864940_6041_DP,7.323553,00000000000000000000000000000000000000000010000000000000010000100000000000010000101001110011000100101100110111010010101011100100110111110110001011011011110111101111110,PYCNAWPEXIYQLY-VXKWHMMOSA-N
O(C(C1CCNCC1)C2=CC=C(C=C2)Cl)C3=C(C=C(C=C3)C#N)Cl,1CB9063D5670490B_5EC55E5BD598C68A_6035_UN,8.285479,00000000000000000000000000000000000000000100000000000000000000000000000000000000001000110001000000101001100100010100001001000111110000100110001111010011110001100111110,MSMVXDNRKRSQNT-UHFFFAOYSA-N
O(C(C1CCNCC1)C2=CC=C(C=C2)Cl)C3=C(C=C(C=C3)C#N)I,B65A4C1F1AA84DFF_965D7EC34F2671EF_6035_UN,8.285477,00000000000000000000000000010000000000000100000000000000000000000000000000000000001000110001000000101001100100010100001001000111110000100110001111010011110001100111110,LNHXVPTZNXATSH-UHFFFAOYSA-N
N5C[C@@H]4CC[C@@H](OC1=CC=CC(=C1)C2=NC3=C([N]2C)C=CC(=C3)F)[C@@H]4C5,170414604E51DAFC_10E43CE0C804793F_6035_DP,8.111655,00000000000000000000000000000000000000100010000000000000000000100100000000010101001101110011010011001100010100000100001011100111110010100110001111011011110011101111110,JNWDEDBQKLEUCF-JNAXZKDPSA-N
O(C(C1CCNCC1)C2=CC=C(C=C2)F)C3=C(C=C(C=C3)C#N)Cl,0C5D8AF4055F835A_DD932C0185520874_6035_UN,8.28547,00000000000000000000000000000000000000000110000000000000000000000000000000000000001000110001000000101001100100010100001001000111110000100110001111010011110001100111110,VWVAXWWKFJNVKV-UHFFFAOYSA-N
O(C(C1CCNCC1)C2=CC=C(C=C2)F)C3=C(C=C(C=C3)C#N)I,338236CED09AEE58_150B0C991FECBF11_6035_UN,8.285462,00000000000000000000000000010000000000000110000000000000000000000000000000000000001000110001000000101000100100010100001001000111110000100110001111010011110001100111110,VIISLXVNOUBULU-UHFFFAOYSA-N
O(C(C1CCNCC1)C2=CC=C(C=C2)Cl)C3=C(C=C(C=C3)C#N)F,696820AD7647F05F_64ACE22AD2482CF4_6035_UN,8.285461,00000000000000000000000000000000000000000110000000000000000000000000000000000000001000110001000000101001100100010100001001000111110000100110001111010011110001100111110,ZHRJZPCWNOOTAT-UHFFFAOYSA-N
O(C(C1CCNCC1)C2=CC=C(C=C2)F)C3=C(C=C(C=C3)C#N)F,2A0F7201075A0721_E7FA90708282E20A_6035_UN,8.2854595,00000000000000000000000000000000000000000110000000000000000000000000000000000000001000110001000000101000100100010100001001000111110000100110001111010011110001100111110,XOLHGRHEJNQIRV-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC3=NC=C(CC2OCCC2)S3)F,F5234254FFFFDE1F_732DB5B1585B19E1_7022_UN,8.171284,00000000000000000000000000000000000010000010000100000000010000000100000000100100010101111001010010001000001101000001001011100100110011110110001010011111110111101111110,ISMFTZPRYYBXNG-UHFFFAOYSA-N
C1(=CC(=C(C(=C1)F)F)F)NCC23C(C)(C(CC2)CC3)C,8111539ABCB2226F_AE109E1AF31566FF_7022_UN,8.43378,00000000000000000000000000000000000000000010000000000000000000000010000000100000001000010011000010001000010110001000101000000000110001110000000011010111010110101111010,IBHZCYMHBRQWSO-UHFFFAOYSA-N
CC1=CC(=C(C=C1)F)NCC2C(CCCC2)N3CCCC3,73DD1B4C2ED3FDC0_5619E87C56A60278_6041_UN,8.354313,00000000000000000000000000000000000000000010000000000000000000100000000000010000101101110011000010001000000100010000001001100000110001110110001011011011010110101111010,AWJUOJQNDCAKAZ-UHFFFAOYSA-N
CN(C)C5CCN(CC1=CC=C(C=C1)NC3CCC2=NC(=C[N]2C3)C4=C(C=C(C=C4)F)F)C5,309AD4C89BD1F4B5_DE3A489513BF0B95_6041_UN,8.025613,00000000000000000000000000000000000000100010000000000000000000100100000000110101100101110010010010101100110110010000101011100100110001110110001011011111010110101111010,FCWHCQSNQNUYRU-UHFFFAOYSA-N
CC4(C)COC3(C[C@@H]2CC(OCC1=NC=C(F)C=C1)C[C@@H]2C3)OC4,2DBFC81F391A2282_5738C2C6813AD469_6039_UN,8.546843,00000000000000000000000000000000000000000010000000000000010000000110000000100000000000010100000110100100010101011001000011010011110010100110000101100100110111011111110,FBNCBWPMSRODSD-VMZNBEPHSA-N
CC1=CC=C(C=C1)C2=NC(=C(Cl)[N]2CC3CNCC34CNC4)C#N,3C077D7A1EC53F2F_3811F79B0523233F_6034_DP,7.6622033,00000000100100000000000000000000000000100100000000000100000000100110000000010101101101110011000010001001010100001000000011100100110100100110001010001011010110101111010,FNVANMGGHNEZFF-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC3CCCCC3CC=C,CFC95A5D1B3EB700_BD5775929D087F9D_6041_UN,8.305326,00000000000000000000000000000000001000000010000000000000000000000100000000000000100000010011000000110100110100010000001001000100110001110100001011010011000110101111010,IZDVYSLDEKGBMU-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NCC(C2CCNCC2)C3=CC=CC=C3)F)C#N,236A302DA24724E3_56D0B0BAD8EA8D95_6041_DP,7.7994957,00000000000000000000000000000000000000000110000000000000000000000000000000000000001000110001000000101000100100010000001001000100110101110110001011010011010110101111010,DQZQIHRWKQTUQE-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NC3CC(C2=NC=C[N]2C)OCC3)C=C,75F2F1CB5E1F89B9_D9A9926462F78EAB_6041_UN,8.090368,00000000000000000000000000000000001000100010000000000000010000100100000000010101000101010010010111110000100111010000001011100100110011110100001011011011110011101111110,JNRKJSYCVHRKQM-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)NCC2CC3(CN2)CCOCC3)C#N,7F6B347033BF1111_0F3CC9E27B84DAAE_6041_DP,7.6526685,00000000000000000000000000000000000000000110000000000010010000000010000000000001101100110011000010101000110101011000001011000000110111110110001011010011010111101111110,SLFUSZYPELILRR-UHFFFAOYSA-N
COC1=C(N=CC(=C1)NC2C3OCC4CC2CC34)C(F)(F)F,F1DE576D7A647930_56A2FC83EDD301AA_7022_UN,8.349413,00000000000000000001000000000000000000000010000000000000010000000100000000000001000100000011010111100100011101001100000011000011110001110100001111000011110011111111110,JJTYUXLSXCGBBW-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NC4CC(C3=NC=C[N]3C)OCC4,B038527A0D587679_17280F117F3C84C3_6041_UN,8.059534,00000000000000000000000000000000000000100010000000000000010000100100000000010101100101010010010111100100110111010000001011100100110011110100001011011111110011101111110,UWFJGFINPFJQSL-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NCC2=CC(=NC=C2)N3CCN(C)CC3)C4OCCO4,F607E00DDBD939C4_4F439089384039FB_6041_UN,7.600884,00000000000000000000000000000000000000100010000000000000010000100100000010010101001101110000010010101000000101010001101011110100110011110110001011011011010111111111110,DMIGXEWCMVESNR-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)N[C@H]3[C@@H](C3)C4CCOCC4,A8141E3FC0129047_124F1F0AB7556E83_6041_UN,9.048881,00000000000000000000001000000000000000000010000000000000010000100100000000000001000000110011000000100100110101010000001011000100110011110110001011010011010011101111110,SCQGIUKZMRTZOD-WMLDXEAASA-N
CN3CC[C@@H](NC(C2CC1CCC(N1CCC)C2)=O)[C@@H]3C4=CC(=C(C=C4)Cl)F,FB214B8BB461E700_C86C45F30048BE64_6038_UN,7.8634396,00000000000000000001000000000000000000000010000000000000000000100000000000010001100101110011110010101001110110110011111011100000110001100110001011011111011110101111110,MUZRVUDNXLLISL-LBQMSPRHSA-N
CN3CC[C@@H](NC(C2CC1CCC(N1CCC)C2)=O)[C@@H]3C4=CC(=C(C=C4)F)F,89E4F3C36BB46BEC_8B00778DA26B8249_6038_UN,7.863446,00000000000000000001000000000000000000000010000000000000000000100000000000010001100101110011110010101000110110110011111011100000110001100110001011011111011110101111110,PENPSIAWVWPZEJ-LBQMSPRHSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(CCCCC3)C4=CC=CS4,0B64A313817E4E7D_6332F51C19C7B6ED_6041_UN,7.751042,00000000000000000000000000000000000010100000000000000000000000100110000000000100011100001011000010101100010010001000001011000100110001010100011011010111010110101111010,BJUXQCMIXQTQFF-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CC(CC)NCC2=C(C=C(C=C2)Cl)Cl)C=CC(=C3)C)C4,82698225948E7509_76CA953A9F0E1390_6034_UN,8.0392685,00000000000000000000000000000000000000000000000000000000000000000100000000010001001101010000000010001101110110010010101001100100110000100110011011011111010110101111010,BYXAMANKCJTVHM-UHFFFAOYSA-N
CC1=CC(=C(C=C1)C)[C@@H]2CCCC[C@H]2OCC3CNCC4(O3)CCC4,116CD1ACB38FDA6B_9CD9A1103383C92F_6039_DP,8.154301,00000000000100000000000000000000000000000000000000000000010000100010000010000000001000100011000101101000010011001000001011000011110010000110000111010111110101111111110,PWWKCHMBPSMMGD-IZOREMLJSA-N
N(CC12CCCN(CCC1)C2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)Cl,13D6DCB6FDE070C7_D04EFD873E302C64_6038_UN,7.767325,00000000000100000000000000000000000000000000000000000000000000100010000000000000101001110011100000101101010100111000011001100000110000100110001011011011011110100111110,NUXGZEJAITWMLJ-UHFFFAOYSA-N
N(CC12CCCN(CCC1)C2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)F,FB7B092F57C1EF89_1FABA78FE5065542_6038_UN,7.7673225,00000000000100000000000000000000000000000010000000000000000000100010000000000000101001110011100000101101010100111000011001100000110000100110001011011011011110100111110,QJVWFLZNSMGJSN-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NCC3C(CCC3)C4CC4)C,03943D2C7EBDF8C8_80F4D48581FF5B93_6041_UN,8.214464,00000000000000000000001000000000000000000010000000000000000000100100000000000000101000010011000010101100010110000000001001000100110001110100001011010111010110101111010,CWAGRWWBEIMAOE-UHFFFAOYSA-N
O(CC2CCOC1(CCCC1)C2)CC3OCCN(C)C3,0F5B4C86D47BB99E_34048A0F20E890D2_6039_UN,7.07322,00000000000000000000000000000000000000000000000000000000010000000010000010010000000001100000010111101000010011011001101011100010110010000110000001111000110101111101110,PUDBXIIWCYVNLZ-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)F)NCC2(CCCC(C)C2)N(C)C)F,8CB4482FDF7D1437_84D4F460D13B631C_7022_UN,7.71092,00000000000000000000000000000000000000000010000000000000000000000010000000100001001001110011010000001000000110011001101000100000110001110000011011011111010110101111010,AWWDMYUMBULTFI-UHFFFAOYSA-N
C1(=C(C=C(C=C1Cl)F)Cl)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,C880C6808EC7CD5B_BA41ACCB31978130_7022_UN,8.638151,00000000000000000000001000000000000000000010000000000000000000000010000000100000001000010011000000001101010100001001101000000100110001110000000011010111010110101111010,HDYJBXHAECMCFF-UHFFFAOYSA-N
C1(=C(C=C(C=C1F)F)Cl)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,87B80B8CFE3B64CF_F565DB90C199C02A_7022_UN,8.638157,00000000000000000000001000000000000000000010000000000000000000000010000000100000001000010011000000001101010100001001101000000100110001110000000011010111010110101111010,WMSPJGDOCGKTEB-UHFFFAOYSA-N
FC1=C(C=C(C=C1)CC=C)NC2C3(C(N(C)C)C2)CCC3,136B64F0FE5DC7FA_C95A448CD7E8E1A8_6041_UN,7.6035805,00000000000100000000000000000000001000000010000000000000000000000010000000100000100001110011010000010000110110011000101000100000110001110000001010011111000110101111010,ASVOOYHFECGJNE-UHFFFAOYSA-N
C1(=C(C=C(C=C1F)F)Br)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,BE7F6ABA2757F2A0_5F06DCB27D29C685_7022_UN,8.638148,00000000000000000000001000000000000000000010001000000000000000000010000000100000001000010011000000001100010100001001101000000100110001110000000011010111010110101111010,APKOCPHTYULFBR-UHFFFAOYSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3CCOC(C)(C3)C)C4,3F27E5E5D94D1445_8F87C33AF66A2251_6041_UN,7.5820804,00000000000000000000000000000000000000000000000000000000010000000110000000110000101101100011010010101100110011011001101011100100110111010110011011011101110111101111110,OCLGPFWLSPRSAF-UHFFFAOYSA-N
C1(=C(C=CC(=C1F)F)Cl)NCC(OC)C2CCCOC2,C8790DCCC97A3A05_2E81C59632138783_7022_UN,7.897308,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110101010100101001000111000000101000000010110011110110000011010011110111111111110,RABGPIGKXFFYGJ-UHFFFAOYSA-N
CC1(C)[C@@H]4C[C@H]1C3=NC2=C(C=CC(=C2)Cl)C(=C3C4)C5COCCC5,A2C4642E319CBA91_742788FD8C0D84C7_2201_UN,7.498011,00000000000100000000000000000000000000000000000000000000010000100110000000100000000000110000000000100101010101001000101011000100110010100110000011010100010011001111110,HCCABZRQAZJPNK-JSSGYJEFSA-N
CC5=CC1=C(C=C(C=C1C)NC2C3CC4CC2CC(C3)(F)C4)[NH]5,55EB82742E06FDDB_6DD0152488E77494_6041_UN,7.8012705,00000000000000000000000000000000000000000010000000000100000000000110000000000000100100010010000010000100010100001000000001000100100101110100001001000101000010101111010,WEGSBBOFAJTQAT-UHFFFAOYSA-N
N(C1=CC=C(C=C1)N2CC3CCC(C2)O3)C(=O)[C@@H]4C[C@H]4C5=C(C=CC=C5F)F,81B3C93E72737771_B46DA265B383FC5B_6038_UN,7.353481,00000000000000000001001000000000000000000010000000000000010000100000000000010000000101110011100110101000010100100000011011100100110011110110001011011011111011110111110,MWHWWQNXTWJKEH-OPQOLIRYSA-N
CC1=C(C=C(C(=C1)NC2CCCC3(C2)OCCO3)Cl)C4CC4,5A819548DABA4B02_40F112F1E683AC1A_7022_UN,8.079687,00000000000000000000001000000000000000000000000000000000010000100000000010000000000100010011000011000001110111011000001010010000110011110110000011010011110011111111110,UXTGGSCQOGJMMQ-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C(=CC=C2)NCC3CCCC(O3)C4CC4)C,FFB5E5F6FDB972C5_E27F50086A40FFCB_6041_UN,7.86209,00000000000000000000001000000000000000000000000000000010010000100100000000000001001100000011000110101100010000000000001011000100110111010100001011010111110111101111110,GKTWPDCRPIAOIC-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NC3(CCOCC3)C4=CC(=CC=C4)F,D20CB3CC2829DABC_C2EEECE2B79A096D_6041_UN,7.628926,00000000000000000000000000000000000000100010000000000000010000100110000000010100100101110011010011101000100111011001101011100100110011110110001011011011010011101111110,MEIDXSHITINMDT-IBGZPJMESA-N
CC1=C(C(=C(C=C1)F)OC(C)CC2CCCCN2C)F,F06B3F4BEA9EDB31_8E72FC50E39551D3_7022_UN,8.14264,00000000000000000000000000000000000000000010000000000000000000000000000000010000000001110000010001101000000110010101101001100011110010100100010111011110110111101111110,JZYXXXZPDJNIQX-UHFFFAOYSA-N
CN4CCN(CC1=C(C=CC=C1)NCC2C3(C2(F)F)CCOCC3)CC4,FA197BB96131A511_E8FD5A989D8BDA5D_7022_UN,7.4324894,00000000000000000000001000000000000000000010000000000000010000000010000000010001101001110011010000101000010101011001101011100000110011110110001011011011010111101111110,QBWZXRGYRGZYOA-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCCCC3)CC4=CC=CC=C4,D8BDA32F88E20B61_D2EC9A088B27132B_6041_UN,7.5542173,00000000000000000000000000000000000000000010000000001000000000000110000000010000101100010011011010001100010100001000001011101100110001110100001001011001010110101111010,NHACCKRIFDBLRD-UHFFFAOYSA-N
CC1=C(C=CC=C1)NC24CC3CC(C2)CC(C3(F)F)C4,B33CD54D3EFD7311_40BBB6A694AE6434_7022_UN,8.212988,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010001000000000100110100011000000000000000100001110000000011000011000010101111010,LPRYGVQTOBATFP-UHFFFAOYSA-N
CC1=CC(=C(C=C1)Cl)NCC2=NC=CN2C[C@H](CC)NC3CC4=C(CC3)C=CC=C4,AC16BC54E21A03EC_D7E387153BBFD7D5_6034_UN,7.946898,00000000000000000000000000000000000000100000000000000000000000000100000000010101001101010011000010001101110100010010101011100100110101110110001011011111010110101111010,RHYNGBLKLVCYEX-HMTLIYDFSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CCCC23CCNCC3,97B3501A9B1AC285_D340E08E85C1AB35_6041_DP,7.268678,00000000000000000000100000000010000000000000000000000000000000000110000000100001001000100011010010101000110000011000001011000000110101010110011011011111010110101111010,ZWESUPMOVNURAE-UHFFFAOYSA-N
CCC3(COC1=CC=C(C2=C1CN(C)CC2)F)COCCN3,EDE4DA1009EEE45A_70A6DCCCE19DD482_6035_UN,7.4533997,00000000000000000000000000000000000000000010000000000000010000000010000000010000001001110101010101101100110111011111101011100011110010100110001111011101110111111111110,IYECTIIZCYGWLT-UHFFFAOYSA-N
C1CNC(C1)C2=CC=CN2CC(CN)CC3=C(C=CC(=C3)F)F,A6A116DF9221E2DB_338818744B0EB015_6034_UN,8.425867,00000000000000000000000000000000000000000010000000000000000000100100000000010001101111010011000010001000100100010000001011100100110100100110001010011011010110100111010,UMNWPCYEXLQONW-UHFFFAOYSA-N
C1CNC(C1)C2=CC=CN2CC(CN)CC3=C(C=CC(=C3)Br)F,1AF58DF16B69FED3_22AA36653FB24BC4_6034_UN,8.425864,00000000000000000000000000000000000000000010001000000000000000100100000000010001101111010011000010001000100100010000001011100100110100100110001010011011010110100111010,LYHIHVLXHHAKLH-UHFFFAOYSA-N
C1CNC(C1)C2=CC=C[N]2CC(CN)CC3=C(C=CC(=C3)Br)F,1AF58DF16B69FED3_978897E378A882B0_6034_DP,8.425853,00000000000000000000000000000000000000000010001000000000000000100100000000010001101111010011000010001000100100010000001011100100110100100110001010011011010110100111010,LYHIHVLXHHAKLH-UHFFFAOYSA-N
CC3=C2N=C1CCCCC1=C(C2=CC=C3)NC4=C[N](C[Si](C)(C)C)N=C4,CB2EE410590F147E_A8F076E7892173F1_6041_UN,7.5979733,00000000000000000000100000001010000000000000000000001000000000000100000000110001100100100011011010101100010000011001001011101100110001010100011011011101010110101111010,VARVSIUFEPRCBQ-UHFFFAOYSA-N
N(C2C1C3CC4C1CC5C2C3C45)C(C6=C(C=CC(=C6)C7=C[NH]N=C7C)F)=O,44340EE4C14B5572_C26D94E8575E681C_6038_UN,8.331041,00000000000100000001000000000000000000000010000000001000000000100100010000000000100100010001101010000100010100100000010011001100110101100100001011000011001010101111110,XMVLHEFWXZXETP-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)C2OCCO2)C)NC4(CC3=C(C=CC=C3F)F)CCCCC4,D86BCE80AE7E0891_16D9960F8CC5462B_6041_UN,7.7971425,00000000000000000000000000000000000000000010000000000000010000100010000010000000000100010011000010000000100101011000001010010100110011110110000011010111010111111111110,PZDDKYYUBRCBMB-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)C=CC2=C([N](C)N=C2)C3CC3)OC(OC4)C5=CSC=C5,5D46B06B807DF284_E616A21720106949_7019_UN,8.289984,00000000000000000000001000000000000010000010000000001000010000100100000000010000100100011100011010110100010111000100000011111100000000100100001011011010110011111111110,MEFFTZOFOZSTNW-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC3(C)CCC4(CC3)OCCO4,3FE095D64CF74ABB_DCFCA2D6DD1AAF24_7022_UN,8.16579,00000000000000000000000000000000000000000010000000001000010000000110000010010000101100010011001010001000010101011001101011111100110011110110001011011011110111111111110,LEBMCYPUAKZHMD-UHFFFAOYSA-N
C(C[C@]12C[C@H]1CCC2)=CC3=C[N](C)N=C3C4=C(C=CC=C4)Cl,AF8649A3C5639A48_C332AA4E4F3D7D5A_7019_UN,7.659924,00000000000000000000001000000000000000000000000000001000000000100110000000010000100100010000011010010001010100001000001011101100110000100100001011011010000110101111010,YAGKWXJDHNTGCR-BEFAXECRSA-N
CC1=CC(=C(C=C1)Cl)NCC2=NC=C[N]2CC3CCC4(CN3)CCSCC4,F1BB096F4062BEF5_E7E189F4435CBCB2_6034_DP,8.273344,00000000000000000000000000000000000010100000000000000000000000000110000000010101001101111011000010101001110100011000001011100100110101110110001011011011010110101111010,YCWCURDZFYYOEN-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)C3=CC(=CC=C3)C=C(F)F,FA02DF24558BEF51_D8AEAFE200F3BB06_6038_UN,7.564308,00000000000000000000010000000000000000000010000000000000000000000000000000001000001000000011100010011000010100100000011000000000110000100000000001010001011110100111110,YLMYXJDIBHPOLK-UHFFFAOYSA-N
O(C(=O)CN1C2CC(C1)C=C2)CC[N]3C=CC4=C3C=CC(=C4)Cl,C2709C096B9B7B58_E60E4F7458E09DF5_6031_UN,7.989085,00000000000000000000000000000000000000000000000000000000000000000100000000010000000101110000000110111101010101010000001011110110110010100110001001011000011111110111110,HMABZQMZJZFCJM-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC4CN(CC2=CC=CC=C2)C3(CCC3)C4)Cl)C5CC5,E55FDF8D585C99DF_8A7BAD04BC8359AE_7022_UN,8.176968,00000000000100000000001000000000000000000000000000000000000000100010000000010001100101110001000010001001110110011000001001100100110001110110001011011011010110101111010,NNFIHUQYPHVKEP-UHFFFAOYSA-N
ClC1=C(C=CC(=C1)NCC2=NC=C[N]2CCC3CNC(C3)(C)C)Br,A44FCCE936965330_55FE52CEB1584934_6034_DP,8.375904,00000000000000000000000000000000000000100000001000000000000000000110000000110101001101010011000010001001100110011001101011100100110101110110001010011111010110101111010,WHQFMILPKOGSBJ-UHFFFAOYSA-N
CN(CC1CCNCC1)CC2=NC=C(N=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,0843553D892DFB84_474E3CD13BD8981D_6041_DP,8.05765,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100110101110110001001011111010110101111010,KIQFIMRNLWGKTJ-GGAORHGYSA-N
N(CCC1=C[NH]C2=C1C(=CC(=C2)F)F)C([C@@]3(C)C[C@H]4CC[C@@H]3O4)=O,769B8DF4DF49E326_78BAD476BA81BCFF_6038_UN,7.905726,00000000000000000000000000000000000000000010000000000000010000000110000000000000001100010111100011001100110110111001111011000100110110100100001001010001111111111111110,CNDKKBCFMDDRPK-MRAWALMUSA-N
C[N]1N=C(C=C1NC2=C(C=C(C=C2)N3CCCCC3)F)C4CCCC4,50BB060EF90A3320_1E8C91269DB07FF1_6041_UN,8.3158455,00000000000000000000000000000000000000100010000000001000000000100100000000010101100101110000011010101000000100010000001011101100110001110110001011011011010010101111010,JVNFHGBPWKLKBO-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=C1)NCC2CNCC3(O2)CCC3,50998816C05DB81C_71359D75ABA2EF67_6041_DP,7.2710843,00000000000100000000100000000010000000000000000000000100010000000010000000100000101000100011010100101000010000001000001011000000110111010110011011011111110111101111110,YAEGWBLEAWTBGC-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC4CN(CC3=CC=CC=C3)CCC4(F)F)C5=CCNCC5,A3873936417366BA_531D06D73224EAF6_6034_UN,8.517494,00000000000000000000000000000000000000000010000000100000000000100100000000011000101101110001000010111100110100011000001011100100110000100110001001011011010110101111010,DZEFYFBFBJXXFI-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2=C(C=CC=C2)N3CC4CCC3C4)Cl)C5CC5,5900A7DFA395F904_DA0E73138DE7C238_7022_UN,7.5340753,00000000000000000000001000000000000000000000000000000000000000100000000000010001000101010001000010101001010110010000001001100100110001110100001011011011010010101111010,XVAFUISMRCYNFJ-UHFFFAOYSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NCC3C(CCCC3)N4CCCC4,69CC02B314C5CAC4_8EB8CBECF7CBF36C_6041_UN,7.9028025,00000000000000000000000001000000000000000010000000000000000000100100000000010101101101110011010010001100011110010000001011100100110001110110001011011011010110101111010,VYXFQAZNRAYJDV-UHFFFAOYSA-N
CN1CCC(CC1)[N]2N=CC3=C2N=CC(=C3)NC[C@H]4[C@@H](OCC4)C5=CC=C(C=C5)F,E082DAF4A1401138_C1A532CC75DC2BEA_6041_UN,7.4836144,00000000000000000000000000000000000000100010000000001000010000100100000000010101101101110011011011101100010101010001101011101100110011110110001001011011110111101111110,ZZWACYMBVIAYKF-JTSKRJEESA-N
O=C2N(C1=C(COCC1)C=C2C#N)CC4(CC3=CC=C(C=C3)F)CCNC4,5EF2090F1FF0BDE0_3703A35F100CE5DD_6034_UN,7.6390605,00000000000000000000000000000000000000000110000000000000010000000110000000010000101101110011100011101100110101111100011011100101110010100110001111011011011111110111110,MBHOENYXFLNURF-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC(N3CCC(C)CC3)C4=CC=CS4,47A169A6AE56C0E9_2DFEF9575BFF94EA_6041_UN,8.291475,00000000000000000000000000000000000010100010000000000000000000000100000000010101011101111001000010101100010110010001101011100100110001110110011011011111010110101111010,NYUBRAJUQCNQJT-UHFFFAOYSA-N
C1(=CC(=C(C(=C1)F)F)F)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,840AFBB962FBC34B_C4018225B2FAE26B_7022_UN,8.556478,00000000000000000000001000000000000000000010000000000000000000000010000000100000001000010011000000001100010100001001101000000100110001110000000011010111010110101111010,XNLFMXMMCJGLFH-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2CC3(C)CCCC4=C3C=CC=C4)C5CCNCC5)F,273B8015451E79F2_EBACE63784D79963_6034_UN,8.382092,00000000000000000000000000000000000000100010000000000000000000100110000000010101001101110001000010101100110110011001101011100100110000100110001011011011010110101111010,CUJJHIWPIOSZSS-UHFFFAOYSA-N
CN1CCN(CC1)C2=NC(=CS2)C3=CC=C(C=C3)NCC(OC)C4CCCO4,9CB561FB2E01E1F1_BA7F9410EC6BBEE3_6041_UN,8.19353,00000000000000000000000000000000000010000000000100000000010000100100000010010101011101101001010111101000001011010001101011100110110011010110001001011101110111111111110,DAXLENJYZMIDSE-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3=C(C=CC(=C3)C4OCCO4)F,5B0DFB347A338309_9F5FA864AC9C2342_6041_UN,7.230812,00000000000000000000000000000000000000100010000000000000010000100100000010010100101101110001010010101000000111010001101011110100010011110110001011011011010111111111110,IYLQBZCSYNQUOZ-SFHVURJKSA-N
N5C[C@@H]1COC[C@]1(C=CC2=C[N](N=C2C3=CC=CC(=C3)C)C4=CC=C(C=C4)F)C5,4732422F4EDB7AE2_3916F8A97143A7F0_7019_DP,8.542418,00000000000000000000000000000000000000000010000000001000010000100110000000010000101100110011001011011100010101001000000011101100110001110110001011001011010011101111110,FLBRTSIEQBTNTP-YKSBVNFPSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC3C4(CC3)CCC4,5C09954D9543CDB4_55AFA04984917982_6041_UN,7.7074313,00000000000100000000000000000000000000000010000000000000000000000110000000100000100000010011000000100100110100011000001001000100110001110100011011010111000010101111010,VRJHNSRREARMPL-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)N[C@H]3[C@H](CCC3)C4CC4)C,28E7EB04AB1077CC_5C043E902EB855D1_6041_UN,8.672124,00000000000000000000001000000000000000000010000000000000000000100100000000000000100000010011000010100100110100010000001001000100110001110100001011010111000010101111010,GIVQMEIOOZAMRW-NVXWUHKLSA-N
C1(=C(C2=C(C=C1)OCO2)F)NC3CCN(C)C34CCCNC4,7053CC3D67B12C01_81EFD457EA6801B3_7022_DP,7.774009,00000000000000000000000000001000000000000010000000000100010000000010000010010001101101110011010011101100110111011101101011110000110101110110001011011011110011111111110,ITUBEPSSFWMNSP-UHFFFAOYSA-N
FC2=C(C=C1C(=NC=CC1=C2)NCC[C@@H]3CC[C@H]4C[C@@H]3C4(C)C)F,AE718BC29CB6871D_6CDD2236ABC27402_6041_UN,8.232185,00000000000100000000000000000000000000100010000000000000000000000110000000100100001000010001000000101100110110011000101001000100110001110100001011010111010110101111010,FQHRJNYFVHNMBZ-NOLJZWGESA-N
N(CC12CC(C1)C2)C(=O)C3(CCOCC3)C4=C(C=C(C=C4)F)F,123EFD1A98A6CA51_D9493E1608297623_6038_UN,7.2245054,00000000000100000000000000000000000000000010000000000000010000100010000000000000001000110011100000101000010101101000011000000000110010100110000011010011011111110111110,JRUOABWMNWEQJQ-UHFFFAOYSA-N
CCC[N]1C=C(C(=N1)C2CC2)NC4CCCN(CC3=C(C=CC=C3F)F)C4,5CA247AEEE7132B3_1A05489568788BF8_6041_UN,8.038694,00000000000000000000001000000000000000000010000000001000000000100100000000010001100101110011001010101000100100010011001011101100110001110110001011011011010110101111010,HPHJGZSJFZFAST-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=CC(=CC=C2)C3=CN=C(C=C3)F)C4,7316D9073A57B812_F8C72D120338AEB9_6035_UN,8.081346,00000000000000000000000000000000000000000010000000000000000000100100000000100000000001110000010011101000010100000101001001100111110000100100001101011110110111101111110,NZPACEPIRMAFHI-JRYVEOFUSA-N
CN(C)CC1=C(C=CC(=C1)NC2=CC4=C(C=C2)OC3(CCCC3)O4)F,2CA70C26AD5D27D9_8E439C10AFC72D28_7022_UN,7.565929,00000000000000000000000000000000000000000010000000000000010000000000000010100000000101110001010011001100010100001101001010110100010011110100001011011111110111111111110,FBOQFZQCJGTEGA-UHFFFAOYSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC2=C[N](C)N=C2C3=C(C=CC(=C3)F)F)C4,07622952159E54EA_59A127FB82D6D685_7019_DP,8.089329,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010010011010010000110100010000001011101100110000100100001011011011000010101111010,SHMTUEUUHOWLBD-ZLENFMNRSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CCN(CC2CCOC2)CC3)F)CC4,6CF344142069086F_3CDB8639B9EBEF66_6041_UN,7.4878054,00000000000000000001000000000000000000000010000000000000010000000000000000010001100101110010010011101000100111010001101011100000110011110110001011011011010111101111110,HEDDEZPLFHMMPU-UHFFFAOYSA-N
N4CC1=C(C=C(C=C1)NC2=C(C=CC(=C2)CN(C)C)C)C3(CC3)C4,A1999683136FC79D_20770CC2AFCD237F_6041_DP,6.783074,00000000000000000000001000000000000000000000000000000000000000000010000000100000001001100011010000101100010000001001000001100100110101010110011011011111010110101111010,ZOQPUZJPRBAJDN-UHFFFAOYSA-N
N(CC2=NC1=C(C=CC=C1F)O2)C(C3C4CCCC3CN4)=O,27C11A75104DC809_0B9A16BB0898F959_6038_DP,8.244587,00000000000000000001000000000000000000000010000000000100010000000100000000000001101100010011100111001100110100110000011011000100110110100110001001010001111110110111110,FBZOMJXQAREQIQ-UHFFFAOYSA-N
C([CH]2C[C]1(C[CH2]C1)C2)=CC3=C([N](N=C3C)CC4=C(C=CC=C4Cl)Cl)C,A94369AFDAFABB69_BBE2A6B20731FB4E_7019_UN,8.305382,00000000000100000000000000000000000000000000000000001000000000000110000000010000100100010000001010011001010110011000101011101100110000100100001010011110010110101111010,KWSRMPBZRXRDQX-UHFFFAOYSA-N
COC1CC(NC1)C2=NC=CN2CC45CC(CC3=CC=CC=C3)(C4)CO5,6B0535EB3047800D_EF73560F29D988CC_6034_UN,7.505551,00000000000100000000000000000000000000100000000000000000010000100110000000010101001101000011010111001000110001011000100011100111110010000110001110001011110111111111110,GTMRUIYZXDAEOT-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC3(CC3)CC4=C(C=C(C=C4)F)F,2468AD7374CC98D2_0621BE3B90EFD44C_6041_DP,7.8645105,00000000000000000000001000000000000000100010000000000000000000100110000000010101101101010011010010101000100110011000001011100100110101110100001011011011010110101111010,CDMFKUPCICHAIM-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(CC2)CC3CC3)Cl)C4CC4,50820959DE4ADFD2_B080659F0E377A01_7022_UN,7.9683895,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010011000000001001000110001000001000000000110001110000000010010011010110101111010,WDEFXTHDUFEATN-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(=O)CC4=CC(=CN=C4)F,E0EA5DB6C9AE6F62_1819A71DFD1A2496_6038_UN,8.484172,00000000000000000001001000000000000000000010000000000000000000000100000000000000001000010011100010101000110100110000010001000000110010100100001001000001011110100111110,IJHSSUNDNXEREJ-UHFFFAOYSA-N
O(C3CCC4C1CC(C2OC12)C34)CC5=C(C=CC(=C5)C)F,2524253B90373F74_7172B616223241A7_6039_UN,8.717508,00000000000000001001001000000000000000000010000000000000010000000000000000000000000000010000000010100100010111000000001000000011110010100100000111010010110101011011110,LDEBKJMSIFOAFO-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(C3=C(C)C4=C([NH]3)C=C(C=C4)F)=O,D3CFB02336321A80_F25DC6F5EA36F00C_6038_UN,7.8573923,00000000000000000000000000000000000000000010000000000010000000000100000000000001001100010001100110001100110100110000011001000100110100100100001011010011011110101111110,HNKWHPFFIVMASZ-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NCC3=N[N](C)C4=C3CNCC4,04DD50F89720532D_0284974B59BF4422_7022_DP,7.543462,00000000000000000000001000000000000000000010000000001000000000100100000000010001101100110001011010101100110110010000101011101100110101110110001011011011010110101111010,BCRLZOAWRJZVCQ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC3CC2=C(C=N[N]2C)CC3)C4OCCO4,017945220B326F13_EE676247B7947B04_6041_UN,8.238265,00000000000000000000000000000000000000000010000000001000010000100100000010010000100100010010011010000100110111010000101011111100110011110110001011011011010011111111110,MJQDOOWCANOKPG-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NCC3=N[N](C)C4=C3CNCC4,51D04E2B44346C0B_F644654611FCE59D_7022_DP,7.543443,00000000000000000000001000000000000000000000000000001000000000100100000000010001101100110001011010101101110110010000101011101100110101110110001011011011010110101111010,VNRLBGWGXYEUCA-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4)C5CCNCC5,51723557EE1265AB_243811F497EFC7F8_6034_UN,7.7221084,00000000000100000000000000000000000000000010000000000000000000100110000000110000001101110001000010101100110110011000101011100100110000100110001001011101010110101111010,NLSCTHYDNAYHEH-NJNPRVFISA-N
N3CCCCC(C=CC1=C(Cl)[N](C(=N1)N(C)C)C2=CC=C(C=C2)F)C3,938343B63E2929F1_92EC861DD94140CF_7019_DP,7.3000097,00000000000000000001000001000000000000000010000000000000000000100100000000110101001101110011010010011001101100010000001011100100110001110110001010011111010010101111010,LOTXFFCXPVKZOI-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2C[C@H]3[C@@H](CNC3)C4=CSC=C4)C5CCNCC5,05AE354421FD05F3_FE7794C2FCF2A2DB_6034_UN,8.778438,00000000000000000000000000000000000010000010000000000000000000100100000000010000101101111011000010101100110100010000001011100100110100100110001001011011010110100111010,WOKJVNDNMFBLNZ-PXNSSMCTSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)CC4(C(C)CNC4)C,0F3D94A39A54B2C3_1A84EF5C4C9A96F3_6034_UN,7.72724,00000000000000000000000000000000000000000000000000000000010000000110000000010000101101100011000110101100110011011001101011100100110110000110001001011111010111101111110,FXUXRODIEZGAGM-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC(C)C3CCCC3,9956E228FDC021FA_958FCB712FCBBA34_6041_UN,7.8723326,00000000000000000000000000000000000000100000000000000000000000000100000000000100001000000001000010101100010010000001101001000100110001010100011011010111010110101111010,TUBCVXPHTCIONF-UHFFFAOYSA-N
FC1=C(C=CC=C1)C2=CN(C(=N2)C3CCCN3)C[C@H]5N[C@H]4CCC[C@H]4C5,DB57E0593797547F_BB5B139C7C2F9FCC_6034_UN,8.488148,00000000000000000000000000000000000000100010000000000000000000100100000000010101001101010011000010001100110100010000001011100100110100100110001010011011010110100111010,PECWJIJOQQSNQV-AGVJRUGWSA-N
FC1=CC2=C(C=C1)C(=CN2CCCC3(C)CCCN3)C4=CCNCC4,2873BB6761BE644A_1C411C2D0ABBE6BC_6034_UN,8.607237,00000000000000000000000000000000000000000010000000100000000000100110000000011000001101110011000010111100110110011001101011100100110100100110001001011001010110101111010,AWHXSDMMOHWBEB-UHFFFAOYSA-N
C(C1C2CCN(C1)CC2)=CC3=C[N](CC)C4=C3C=CC=C4,27B912BDDC981539_EC36E4CBA6CF00E2_7019_UN,8.523478,00000000000000000000000000000000000000000000000000000000000000000100000000010000000101100000000010111100010000010010001011100100110000000110001001011000010110101111010,DEPVWRQKJZXUDA-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCCC3CC4CCC3O4,A964049DBB2D5D74_CB3C96FBA3F4D5D5_6041_UN,7.8825674,00000000000000000000000000000000000000000010000000001000010000000100000000010000101100010001011010001100110100010000001011101100110011110100001001011001110111101111110,GUFUHOPBVCDJRQ-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC3(CC)COC(CI)C3)C4CCNCC4,30ABB9A70ED1048A_1E5937896C4F7028_6034_UN,8.447973,00000000000000000000000000010000000000000000000000000000010000100110000000010000001101100001000011101100110001011010101011100100110010100110001001011101110111101111110,JCHXABZWLUDCCD-UHFFFAOYSA-N
COC1=C(N=CC(=C1)NCC2C3CC(C2)C4CC34)C(F)(F)F,FE40ADB63AF11A43_15F5336355D23491_7022_UN,8.752304,00000000000000000001001000000000000000000010000000000000000000000100000000000001001000000011010111101000011100001100000001000011110001110100001111000011110111101111110,INWPHLZNKWRVRV-UHFFFAOYSA-N
FC1=CC2=C(C(=C1)F)C(=C(C#N)C=N2)N[C@@H]3CCO[C@H]3C4CCNCC4,8EE2938CED0F6D53_909353C9BC60B3F8_6041_DP,8.046907,00000000000000000000000000000000000000000110000000000000010000100100000000000000101100110011000111101100110101010000001011000100110111110110001011010011110011100111110,ZWYYWOITLZOZIV-BEFAXECRSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCC2(CCC2)C3=C(C=CC=N3)F,CBEF9B1EF86F3982_4E3C61BEA6D252B4_6041_UN,7.811429,00000000000100000000100000000010000010000010000000000000000000100110000000100000111100111011010010101000000100001000001011000100110001110100011010011111010110101111010,SUTSJWFCXXAVAD-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NCC2(CCCC2)C3=CC=NC=C3)F)C4,9CCCA1323860F270_0283B14461B5C187_6041_UN,7.615183,00000000000000000000000000000000000000000010000000000000000000100110000000010000001001110011000010101100010110011010101011100100110001110110001011011001010110101111010,JIQNIRHZVCQFMX-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CC2CCCNC2C)C=CC(=C3)C)C4,2B37A59CA63E518C_ECF335AA706494FF_6034_UN,8.325109,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101000011000010101100110010010010101011100100110000000110011011011111010110101111010,JKSOFFHGCQECAH-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC3CC(C2=CC=N[N]2C)OCC3)C4CC4,771FBEC9289F25E7_92429E678A5B7331_6041_UN,7.8902106,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011011111100000100111010000001011101100110011110100001011011011110011101111110,UPRKCWONDMCXAS-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Br)NC3C4CC3CN(C)C4,024BDC30F92C1553_8B566AD055699FC0_7022_UN,8.0966425,00000000000100000000000000000000000000000000001000000000000000000000000000010000100001110010010000101100010110000001000001100100100001110110001011001011010010101111010,CCYKUWNWPBPTBD-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2CC3CCNC3CC,7DFF82E384577E11_01A5A2BC7D6B81D7_6034_UN,8.90333,00000000000000000000000000000000000000000000001000000000000000000100000000010000101101010011000010001100110110010010101011100100110000100110011010011111010110101111010,IJMFRWUABJIALM-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NC3C4CC3CN(C)C4,773339A205647532_DBB622E6BEE2FBB6_7022_UN,8.096636,00000000000100000000000000000000000000000000000000000000000000000000000000010000100001110010010000101101010110000001000001100100100001110110001011001011010010101111010,SEGHSDRLZVJHSC-UHFFFAOYSA-N
C(C2CCC1(CC1)C2)=CC3=C([N](C)C4=C3C=CC=C4)Cl,2D0F138C378B0560_AC57C4B134A7A55D_7019_UN,8.413273,00000000000000000000001000000000000000000000000000000000000000000110000000010000000101010000010010010101010100001000001001100100110000100100000010011010000010101111010,IEIZUAZTPJYBBN-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2C3=C(CCO2)SC=C3,237EF590E2B3A2D8_071FE713F464CB7A_6041_UN,7.678343,00000000000000000000100000000010000010000000000000000000010000000100000000100001011100101001010110101100010001001000001011000100110011010110011011011111110111101111110,CULINERYNVBFBP-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C[N]2C=C(C=N2)NCC34C(C)(C(CC3)CC4)C)F,B43F4F43B1DBC57B_1AC1561E7AE22B57_6041_UN,8.01129,00000000000000000000000000000000000000000010000000001000000000000110000000110001101100010011001010001000010110011000101011101100110001110110001011011111010110101111010,CCTRXNXQSBAIBJ-UHFFFAOYSA-N
C(C1C2CCOCC12)=CC3=CC(=C(C)C=C3OC(F)F)C,786A6C576A91B525_D9AA311DC06A9F2C_7019_UN,8.801915,00000000000000000001001000000000000000000010000000000000010000000000000000000000000000100000000000110000011101000100001000000011110010100110000111010110110001011011110,BMNIBRVHRMBHPT-UHFFFAOYSA-N
CN(C)CC1=NC(=CC=C1)N[C@@H]2C4=C(OC3(C2)CCCC3)C=CC(=C4)F,B862645349687B1A_BACADD0942F40BCF_6041_UN,7.6509986,00000000000000000000000000000000000000100010000000000000010000000110000000100101000001110001010011101100110100011101001011100100110011110100001011011101110111101111110,VUAIWURPIYBPFM-SFHVURJKSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(C4=C(F)CNCC4)=O,0A11111A22CF008C_1898FD6032708EB6_6038_DP,7.5632715,00000000000000000000000000000000000000000010000000100000010000000000000000001000001100110011100011111100110100110000011011000000110111110110001011010011111011110111110,JGKRBAPGXAMSSG-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3C(C(C)C)OCC3,F3C6BA76B5C782F3_DF77081D6C6C37A6_6041_UN,8.274216,00000000000000000000000000000000000000000010000000001000010000000100000000110000101100010011011011001100010111000000001011101100110011110110011000011111110111101111110,KNNVBLIPUPOVLL-UHFFFAOYSA-N
CC1=C(C(=CC=C1)C)CC2=CN(C=N2)C[C@H]3[C@@H](CCNC3)C4=CC=C(C=C4)F,10FE8798B4A1D55A_E5287AD2851967E5_6034_UN,7.9369736,00000000000000000000000000000000000000000010000000000000000000100100000000010101101101110011000010101000100100010000101011100100110000100110001011011111010110101111010,NYVZOTBNKQSUIC-REWPJTCUSA-N
CC3CCC(CC=CC2=C(N(C)C1CCCC1)C=CC(=C2)F)O3,BAD6DD1F7809BF9F_68465D800E2C8F3F_7019_UN,8.090819,00000000000000000000000000000000000000000010000000000000010000000000000000000000000101010000010010010000000110010001101000100000110011110100000010011110100111101111110,OOARJYGZCWCKFV-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NCC4(C)CC3CC3C4,0AE6C40BAD8F0B52_9B8E6AEF7C74A711_6041_UN,7.7268786,00000000000000000000001000000000000000000010000000000000010000100010000010000000001100010010000010001000010111001001001010010000110011110110000011010011010111111111110,LEWNKNCLIWYMAV-UHFFFAOYSA-N
NCC3(OC2=C1C=CC=C(C1=NC=C2)F)CCCNC3,7E2A49217F8546FC_ACFF638E72CC4A34_6035_DP,8.027569,00000000000000000000000000000000000000000010000000000100000000000110000000000000101010110011000101101100110100011100001011000111110110100110001101010001110111100111110,IYZMGBJUFJHLRP-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CN(CC2)C3COC3)F)CC4,B42FFD65F6E28D31_EC5995658A9EA2BB_6041_UN,7.511468,00000000100100000001000000000000000000000010000000000000010000100000000000010001100101110011010110001000100111010001101011100000110001110110001010011011010111101111110,PLEFRIWMZLMPRS-UHFFFAOYSA-N
NCC3(OC2=C1C=CC=C(C1=NC=C2)Cl)CCCNC3,AAB8D9E2DB0D983D_0217D99E13ABD193_6035_DP,8.027575,00000000000000000000000000000000000000000000000000000100000000000110000000000000101010110011000101101101110100011100001011000111110110100110001101010001110111100111110,ZVOMBGXDJXIYAF-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2CCC(C)N(C)C)C3CCNCC3)F,777FDFF6910B8BB6_4388609D1C7D8501_6034_UN,8.103142,00000000000000000000000000000000000000100010000000000000000000100100000000110101101101110001010010101000100110010001101011100100110000100110011011011111010110101111010,JYOIZTHSYZUBKP-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4=CC(=CC(=C4)F)F,1588438C341DF6C6_B0ADA2294569B514_6041_DP,8.09686,00000000000000000001000000000000000000100010000000000000000000000100000000000101100101010011010010100000110100010000101011100100110101110100001001011001000010101111010,WMCOAMJTNMOKGY-MIFYACCESA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC3CNCC(O3)(C)C,DB7B7FAE7ED6BD65_BA9B354FB43B5BCA_6041_DP,8.084698,00000000000000000000000001000000000000000010000000000100010000000110000000110101101101110010010110101100011110001001000011100100100111110110011011001111110111101111110,WFZYZIFVCFHKCY-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CC[C@@H]2C[C@H]2C3CC3)C(=CC(=C4)F)F)C5,DA04C61281022C29_30B5A7A62C3D2271_6034_UN,8.044318,00000000000000000000001000000000000000000010000000000000000000100110000000110000000101010000000010001100010100011001101001100100110000100100000011011110010110101111010,BSHYABDZIQJZKM-ZBFHGGJFSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC[C@H]2CCS[C@H](C)C2)F)CC3,790A17C5090BECFD_89DD98A1555564AA_6041_UN,7.6097574,00000000000000000001000000000000000010000010000000000000000000000000000000010001111001111011010000101000000110010001101011100000110001110110001011011111010110101111010,FFDHQQJHCAFVGH-SJORKVTESA-N
CN5CCC1=C(C4=C(N1CC2(CCC2)C3CCCO3)C=CC(=C4)Cl)C5,B40CF4E28BBB2A24_AD22D29310C64A61_6034_UN,7.338481,00000000000100000000000000000000000000000000000000000000010000100110000000010000100101110000010011101101010101011001101011100100110010100110001011011000110111101111110,CLCJKYUTDZTZBS-UHFFFAOYSA-N
O(C2CCOC1(CCCC1)C2)CCCCC3(C)OCCO3,0DD202AEE8CAC926_939B71864A414A8D_6039_UN,7.0064397,00000000000000000000000000000000000000000000000000000000010000000010000010000000000100000100000010100000010011001001101010010011110010000110100100110000110101011001110,RAJTWCKVQJBGJM-UHFFFAOYSA-N
CC4(C)COC3(C[C@@H]2CC(OCC1=C(F)C=CC=N1)C[C@@H]2C3)OC4,0A4CA2F716FEF511_C6EFB0A0F4D6DE16_6039_UN,8.642221,00000000000000000000000000000000000000000010000000000000010000000110000000100000000000010100000110100100010101011001000011010011110010100110000111100110110111011111110,LWMJWYIGROOPMK-YIONKMFJSA-N
CN(CC1CCNC1)C2=NC(=NC=C2)N[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,3BBD6826C210225D_47E1DB779F77790B_6041_DP,8.282686,00000000000000000000001001000000000000100010000000000000000000100100000000000100101101110011010010101000101110010001001011100100110101110110001011011011010110101111010,HCEWSPFLLJHFDP-LLQOJDTPSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CCC3CCN(C)C3)Cl,5B95E96AF6286D2D_0CF1978FC260A30C_6034_UN,7.928058,00000000000000000000000000000000000010000000000100000000000000000100000000010110010101111011010010001001001110010001101111100100110001110110001010011111010110101111010,WPAPLSNIPTVBNR-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3C(CCN3)C4CC4,444C9252E9E146AD_C803C9B0224A60B4_6041_DP,7.6672587,00000000000000000000001000000000000000100000000000001010000000100100000000010101101101000011011010001000100010010000001011101100110101010110001010011111010110101111010,IFORCDDAACZEIB-UHFFFAOYSA-N
CC1=C(C3=C(C=C1)N=C2CCCCC2=C3NC(CCCC=C)C4CC4)F,0209766ECD2A1D8B_B0EC817EACD1D363_6041_UN,7.865253,00000000000000000000001000000000001000000010000000000000000000000100000000000000100000010011000000110100110100010000001001000100110001110100001011010011000110101111010,YXDGAYUSSFBYKC-UHFFFAOYSA-N
FC1=C(C=C(C=C1)N[C@@H]2CCN(C)[C@H]2C3=CC=CC=C3)C4OCCO4,975410B776BEC4DD_E8C7629F65F11F03_6041_UN,8.01462,00000000000000000000000000000000000000000010000000000000010000100000000010010001100101110011010010001000100111010001101011110100000011110110001011011011010011111111110,WZPIXSAFGVIYCU-MOPGFXCFSA-N
O=[N](=O)C1=C[NH]C2=C1C=C(C=C2)NC4=C3OCCCC3=CC(=C4)F,317E9AB1FB449A99_7C63D9DEDB75A4E3_6041_UN,8.093213,00000000000000000000000010000000000000000010000001000000110000010100001100000001100100010001001111100110010101000100001111101100101111110100001011111001110011110111110,OSFDRJZTXJHANZ-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CCCC3=C2N=C(C)S3)F,0870335D2FA63E35_3EC9A0C098DC5ACA_7022_UN,7.444053,00000000000000000000000000000000000010000010000100000000000000000100000000100000111101111011010010001100010110000001001011100100110001110110011011011111010110101111010,LCVLESKEEWPQAW-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)C[N]3C=CC4=C3C=CC(=C4)F,CFFE99FC13927743_795F44B715D0ABEC_6038_UN,7.705948,00000000000000000000000000000000000000000010000000000000000000000100000000010001001101010011100110011100110100110000011001100100110010100110001001011001011110100111110,LLHLKZWOPLNIAW-UHFFFAOYSA-N
O([C@@H]1CN[C@H]2COC[C@@H]12)C3=C(CNCC)C=C(C=C3)Br,58BE57E7AD1A942E_02B0F50EE97AF9E9_6035_UN,8.360739,00000000000000000000000000000000000000000000001000000000010000000000000000000000001100110111000111001100110101010110100011000011110110100110001110000011110111111111110,VYBLFZDGVHZWTD-VNHYZAJKSA-N
CC1=C(C=C(C(=C1)NCCC2(C)CCCC2)Cl)C3CC3,809985083B8C8C17_4B238C2D95D34F75_7022_UN,7.680298,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010001000010001001100110011001101000000000110001110000000010010111010110101111010,QWJNEEOKSASQHD-UHFFFAOYSA-N
O(C1CCCOC12CCOCC2)CCC3CCN(C)CC3,FC98E586AF7FAE36_D304086D22CAD45B_6039_UN,6.932953,00000000000000000000000000000000000000000000000000000000010000000010000010010000000001100100010000101000010001011001101011100011110010000110000101111000110101111101110,VOLWTYORPDHTNW-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2C[C@H]4C[C@@H]3NC[C@@H]3C4,EF05C28D3338B245_C672261B8C83AE55_6034_UN,9.217849,00000000100100000001000000000000000000000000001000000000000000000100000000010000001101010011000010001100110100010000100011100100110000100110001010001111010110101111010,LQBUFEBAAVEOMY-WWGRRREGSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC3=C2CCCCC2=CC=C3,C663CF751C39832A_EDC063060589D6D6_6041_UN,7.8656764,00000000000000000000100000000010000000000000000000000000000000000000000000100000000000100011010000000100010000001001001000000100110001010000010011011111010110101111010,HOFDEFCSTQPKKV-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCCCCN2)F)CC3,4572CB71885C10E1_4DCBC486A631865C_6041_DP,7.4492817,00000000000000000001000000000000000000000010000000000010000000000000000000010001101001110011010000001000100110010001101011100000110101110110001010011011010110101111010,GLIPCKCINDDFOG-UHFFFAOYSA-N
N(CC2=CC1=C(C=CC=N1)S2)C(C45CC3(CC(CC(C)(C3)C4)(C)C5)F)=O,A11F775E9DC3C6C4_38C8962CEC80F432_6038_UN,7.963875,00000000000000000000000000000000000010000010000000000000000000000110000000000000011100011010100010101100010110101001010011000100100000100100001001000101011110101111110,FGBWMQDJYWLKKA-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2NCCC3=C2N(C=N3)CCNC4CCC(CC)CC4,D059E0CF0C38ABF4_F5509EC9D3A723AA_6034_UN,8.227329,00000000000000000000000000000000000000000010000000000000000000100100000000010101101101010011000010101100110110010010101011100100110101100110001011011001010110101111010,AAARVVWZBIGZOV-UHFFFAOYSA-N
ClC1=CC=C(C=C1)C2NCCC3=C2N(C=N3)CCNC4CCC(CC)CC4,E6AA0E07764BBF71_10AA21EC1579E35B_6034_UN,8.2273245,00000000000000000000000000000000000000000000000000000000000000100100000000010101101101010011000010101101110110010010101011100100110101100110001011011001010110101111010,NFRUBVOYPBUEEG-UHFFFAOYSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC2=C(C)[N](C(=C2)C)C3=C(C=CC=C3)F)C4,48266641B304FB55_66F2D0E6AEC691D2_7019_DP,8.33004,00000000000000000000000000000000000000000010000000000000000000100100000000010000000101010010000010010000110100010000001011100100110001110100001011011111000010101111010,OQRNSYSTMYLMRY-LMMKCTJWSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC3CCCC(O3)C4CC4,51F1C1A75894E2B5_55A903F4637333CB_6041_UN,8.191993,00000000000000000000001000000000000000000010000000000000010000100100000000000000101000010011000100101100010100000000001011000100110011110100001011010011110111101111110,DDLCXHOYGXTGKW-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCCC3)C4=C(C=CC=C4)F,6658E9447C3D2FBC_C2E87281D8FF68C8_6041_UN,7.606015,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100010001110100001010011011000010101111010,HAKHXXJJSNYYEV-UHFFFAOYSA-N
CC2=CN(C3=C1C=C(C=CC1=NC=C23)Cl)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,401EBD604B9F231E_F3C63A0E778A2549_6034_UN,8.662825,00000000000000000000001000000000000000000000000000000000000000100100000000010101100101010000010010101101010110010000001011100100110001100110001011011110010110101111010,QMXVAEKVWJSDPC-OSPHWJPCSA-N
FC1=CC2=C(C(=C1)F)C(=C(C#N)C=N2)NCC4NC3COCC3C4,EBDC96CDE7AE2014_84150EE633A12CC5_6041_DP,8.012969,00000000000000000000000000000000000000000110000000000010010000000100000000000001101100110011000111101100110101010000000011000100110101110110001011000011010111100111110,DZBWLVYRLURPQL-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(C)C=CCCC3,6D9020286CF97E81_6A88D77C474318B1_6041_UN,8.105879,00000000000000000000000000000000000000000010000000001000000000000110000000010000101100010011011010011100010110001001101011101100110001110100001001011101010110101111010,GOVLUEOZIYFTIC-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4)Cl)C5CC5,380AA2E3B3F5D799_85620BFC8FC46BC9_7022_UN,7.801576,00000000000000000000001000000000000000000000000000000000000000100010000000100000001000010011000000001101010110001001101000000100110001110000010011010111010110101111010,NOOVLJOARRAFEG-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,8FD4CE9067CF7373_C048C605449B434E_6041_DP,8.276562,00000000000000000000000000000000000000000010000000001100000000100100000000010000101100110011011010101100110100010000001011101100110101110110001001011011010110101111010,PSVYWVNAFKPQLF-MAUKXSAKSA-N
C(C1=C(ON=C1)C2=CC=CO2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,B399848121EDCC53_037FC354210598BB_7019_UN,8.496225,00000000000000000000000000000000000000000010000000000000010000100100000110000000000101010000011011010010000110010000101011101100010001110100001010011010100010111111110,MCYQKDGCUHDKIM-UHFFFAOYSA-N
FC2=C1C=CN=CC1=CC=C2NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4,284306850D9BA411_6ABCA69ADEB267A8_6041_UN,8.528437,00000000000000000000000000000000000000000010000000000000000000100100000000010000101001110011010000101100010110010001101011100100110001110110001011011011010110101111010,RALBCEIJNPDASA-AVRDEDQJSA-N
N(CC1CC2CCC(C1)O2)C(C3=C(C=CC4=C3[N](C)N=C4)F)=O,D2888E817D8009F3_61AD2DECA3A8BEB6_6038_UN,7.7744102,00000000000000000001000000000000000000000010000000001000010000000100000000010000101100010010111011101100010100100000011011101100110010100100001011011011111111111111110,LQOJLSIBKCIDAT-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CCC3=C(C=CC(=C3)F)F,A99F8F339630203A_2FCB427A330D6311_6038_UN,7.3743415,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001000110100110000011000000000110010100000000011010011011110100111110,XJIWAIURLNHWRL-UHFFFAOYSA-N
N1CCC2(C1)CCN(CC2)C3=NC(=NC=N3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,90C66287A5F3EA3B_99EA017E809EC5FD_6041_DP,8.160628,00000000000000000000000001000000000000000010000000000000000000100110000000010101101101110011010010101000111110011001101011100100110101110110001001011011010010101111010,KFUHMPVJHNWFMJ-MOPGFXCFSA-N
CC1=C(C=C(C(=C1)NCC3NC2CCOC2C3)Cl)C4CC4,1BA016041DDA89C7_13A9D7BFDECD845F_7022_DP,8.027684,00000000000000000000001000000000000000000000000000000010010000100000000000000001001100010011000111001101110111010000001011000000110111110110001010010011110111101111110,XLCKYFBCYIANRC-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)NC2CC(OCC2)C3=CC=C(C=C3)F)C4[C@@H]5CNC[C@H]45,66CABE3044C11E6A_8C907F052ACADE67_6041_DP,7.8556895,00000000000000000000001000000000000000100010000000001000010000100100000000000101101101110011011011101000110111010001001011101100110111110110001001011001110111101111110,SBBMLTVGTSFNLK-FLANIQCISA-N
OC(CF)C1=CC(=CC=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,281784618393819D_E1360067E966BA66_6041_DP,8.771558,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101100011010010001000100010000000000011100100110111110111001010001011110111101111110,VRNPAMJGXNTPHT-GZJFXKPMSA-N
N(CC1C2CCC(C1)C2)C(CN3C4=C(N(C)CC3)C=C(C=C4)F)=O,13A9DFC8A83C8AB9_805B9054E9AACA66_6038_UN,7.927347,00000000000000000000000000000000000000000010000000000000000000000000000000010001001001110011110110101100110100110001111011100000110010110110001011011001011110101111110,PTIOARPOLIVTFT-UHFFFAOYSA-N
CC1=CC2=C(C(=C1)F)N=CC(=C2)NCC3CCCC(CC)CC3,2879E4DA2DBB7BB6_AA9E2C37B1A1D4B4_6041_UN,8.015954,00000000000000000001000000000000000000000010000000000000000000000100000000000001001000010011000000101100010110000010101001000100110001110100001001010101010110101111010,IHVMQUOIDDBQAZ-UHFFFAOYSA-N
N2C[C@H]1CN(C[C@H]1C2)C3=NC(=CN=C3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,29AA1EF761843D02_1B6938FABAFC6FBB_6041_DP,9.146941,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101100110110010001101011100100110101110110001011011011010010101111010,NKVSVVSRWVXOLB-ONHLAKKPSA-N
CC1=C(C=C(C(=C1)NC2C(CCC3=C2C=CC=C3)N4CCCC4)Cl)C5CC5,48336F40CCC7668B_7D32F6E8F1EB23A6_7022_UN,7.7709913,00000000000000000000001000000000000000000000000000000000000000100000000000010001000101110011000010001101010110010000001001100100110001110110001011011011010010101111010,DBDQZQDSMFZIQS-UHFFFAOYSA-N
CC1=C(C=NC=C1NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#C,5C0DCF91C2EBC265_D9A9B12EBBD1B6AD_6041_DP,8.103329,00000000000000000100000000000000000000000010000000000100000000100100000000000001101000110011000000101000100110010000001011000100110101110110001011010011010110101111010,IAQMOVYREUPZFJ-PKOBYXMFSA-N
C[N]1N=C(C(=C1)C2=CC(=C(C=C2Cl)C3CC3)C)C4NCCCC4,DE3B0FD903EDAB57_5122937D169143F4_6005_UN,7.950514,00000000000000000000001000000000000000000000000000001000000000100100000000010001101100010011011010101001100110010000001011101100110000100100001011011111010010101111010,SHPWGIYYDZATPT-UHFFFAOYSA-N
CN(C)CC1=CC(=NC=C1)NC3=C2OCCCC2=CC(=C3)F,A6F30835E6D2BBBC_25CD20956614CEA8_6041_UN,7.1267385,00000000000000000000000000000000000000100010000000000000010000000100000000100100000001110001010100101100010101000101001011100100100011110110001011011101110111101111110,HCLNDKBBYWKXRA-UHFFFAOYSA-N
C1CC(CCN1)C3=CC2=C(C=CC=C2)N3CC4(CN(C)C)CCCCC4,94090925D7F8C4FA_E407A267E2539AE6_6034_UN,7.2906885,00000000000000000000000000000000000000000000000000000000000000100110000000110000101101100001010010101100110010011001001011100100110000000110001011011111010110101111010,MSNKDMCAFKSGOP-UHFFFAOYSA-N
FC1=C(C=CC(=C1)CC#N)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,E1F9443414B0E018_F13CBC24CF9559AB_6041_DP,6.944256,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110100111010,GKHFDWXXZNOANR-FUHWJXTLSA-N
N4CC1=C(C=C(C=C1)NCCC2=CC=C([Si](C)(C)C)C=C2)C3(CC3)C4,FAF1409771C4E4E4_2BAC559C517FEA9D_6041_DP,7.1418,00000000000000000000101000000010000000000000000000000000000000000010000000100000001000100011010000101100110000011000001001000100110101010110011011011101010110101111010,FQCZTSGUDLBLIS-UHFFFAOYSA-N
CC(NC(=O)CC1CC2CCC1O2)CC3=C[N](C)C4=C3C=C(C=C4)F,E56089B0830F4FBB_F0A214382BF8DB74_6038_UN,7.630527,00000000000000000000000000000000000000000010000000000000010000000100000000010000000101010001110010000100110110110001011011100100110010100100001001011101101111111111110,XEDDANPBUFCPSO-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CC=N2)NC3=C(C=C(C=C3)C4CCOCC4)F,254410A0AE7C1B7C_F875E5DE9233410D_6041_UN,7.716486,00000000000000000000000000000000000000000010000000000000010000100100000000010001100101110000010010100100010101000000001011100100110011110110001011011011010011101111110,KDMPDTCQBMXUEN-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4=C(C=C(C=C4)C5CCOCC5)F,A85811EFBA557ECB_232837AF299CAF87_6041_DP,8.330992,00000000000000000000001000000000000000100010000000000000010000100100000000000101101101110001010010101000010111000000001011100100110111110110001011011011010011101111110,CJGFKKAUSGVZGB-GWTOYCKXSA-N
C(C1CCCC12CCOCC2)=CC3=C(C=C(C(C)C)C=C3)F,C9521561A030D08F_AA1DDDD6294B3D21_7019_UN,8.314754,00000000000000000000000000000000000000000010000000000000010000000010000000100000000000110000000010110000010101001000001000000000110010100110000011010110010001001011110,UOWJRGAMLRJHKL-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CNCC4(O3)CCC4,F16C8CCE74AD8699_9C9C8F0711A9B88D_6041_DP,7.166586,00000000000100000000000000000000000000100000000000000100010000000110000000000100101000100011000100101100010010001000001011000100110111010110011011010111110111101111110,YDHDNQVDHOHESQ-UHFFFAOYSA-N
C[Si](C)(C)C1=C(N=C(C=C1)NCC2C3(C2)C4=C(OCC3)C=CC=C4)F,9174E2C89BD65A38_E0C4EBB37008B989_6041_UN,7.4278026,00000000000000000000101000000010000000100010000000000000010000000110000000100100001000110011010000101100010101001100001011000100110011110110011011011111110111101111110,XYEILAPRCMCQLZ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(CCOCC3)C4=CC=CS4,8C89D8E0671F2BDB_4F669E0FF061EB2C_6041_UN,7.679284,00000000000000000000000000000000000010100000000000000000010000100110000000000100011100101011000010101100010011001000001011000100110011010110011011010111010111101111110,FEFVSMFFCAZZPU-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=NC=C(C=C1)NCC2CCCCN2,44BF771994D13214_9CC3699750736D83_6041_DP,8.338612,00000000000000000100100000000010000000000000000000000010000000000100000000100001001000100011010000101000100000011000001011000000110101010110011001011101010110101111010,ZTPLDZRZLZNBAU-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)F)NC3C[C@H]2CCC[C@H](N2C)C3,61DECA11FC2D8C2B_2C47F46099F1316D_6041_UN,7.806577,00000000000000000000000000000000000000000010000000000000000000000000000000010000100001010001010000100100110110010000101001100000110001110100001011011111000010101111010,COHVBWJPJHAHPC-AGUYFDCRSA-N
CC1=CC(=C(C=C1)F)NCC2CC3CCC(C2)N3C4CC4,82D9AD5FD6157941_D37FA2DF4B3E67B1_7022_UN,7.890073,00000000000000000001001000000000000000000010000000000000000000100000000000010000001101010010000010101000010100010000001001100000110001110100001011011011010110101111010,ZOECTOJQUSMTAH-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3=C4C(=CC(=C3)F)COCO4,145E30CDA8B9459B_701B5F70731DB7E9_6041_UN,7.5540695,00000000000000000000000000001000000000100010000000000000010000100100000000010100101101110101010011101100010111010101101011110100110001110110001011011011110111111111110,ZBOYARGQNYINRN-KRWDZBQOSA-N
O(C[C@@H]2CN(CC1=CC=CC=C1)C[C@H]2F)CC3CNC(CO3)(C)C,DB2DB7D2DB4CA09D_CE63EB93FE0908C7_6039_DP,8.074019,00000000000000000000000000000000000000000010000000000000010000000010000010110000001101110011000111101000100101011001100011100010110010100110001001001111110111111111110,CMMIPPFODDMFEN-PXKIYYGHSA-N
CC1=C(C=C(C=C1)N[C@]23CCC[C@]2(CNC3)F)CC=C,D4DFC6359C1C3ED8_5239B40F135A37AF_6041_DP,8.45434,00000000000000000000000000000000001000000010000000000110000000000010000000000001101100110011000010011100110100011000101001000000110101110110001010010011010110101111010,BXHWXMOSWRDEPY-SJORKVTESA-N
N1CCCC2=C1C=C(C(=C2)NCC4(C)CCN(CC3=CC=CC=C3)C4)F,063656BBD207A1D5_D800D5F936CCF026_6041_DP,7.664383,00000000000000000000000000000000000000000010000000000000000000000010000000010000101101110011000010101100110110011001101011100100110101110110001011011011010110101111010,MBAMCVVBTGTDAV-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NC2CCCCC2CC3CCCC3,F64AE1D302B03A9F_0F182B2BBEA781F8_7022_UN,7.9293294,00000000000000000000000000000000000000000000000000000000000000000000000000000000000000010011000010000001100100010000001000000000110001110000000011010011000110101111010,XQJMAXREMDMNNZ-UHFFFAOYSA-N
CN3CCN(CCOCCC2COC1(CCCC1)O2)CC3,517A20D368D7BE6F_E5571DAFA6FC40F5_6039_UN,6.8765206,00000000000000000000000000000000000000000000000000000000010000000000000010010001000101100100010110101000010001011001101011110010110010000110001000111000110101111101110,HZUXWLBTUGLWIS-UHFFFAOYSA-N
CC1=C(C=CC=C1Br)NC2CCCCC2CC3CCCC3,87D31AC2B11398AC_D31B793717E915CA_7022_UN,7.929316,00000000000000000000000000000000000000000000001000000000000000000000000000000000000000010011000010000000100100010000001000000000110001110000000011010011000110101111010,HGSLATAWGITWMD-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NCC2(CCN(C)CC2)N3CCOCC3)C4CC4,EC3A947D99F2B9A3_B0C262B383E7A278_6041_UN,7.779871,00000000000000000000001000000000000000000010000000000000010000100010000000010001101001110011010100101000000101011001101011100000110011110110001011011011010111101111110,FRBSPPFHVAZWDO-UHFFFAOYSA-N
CN1CCCC1C2=CC=C(C=C2)NC3=C(C=C(C=C3)C4CCOCC4)F,316F9C11ABBA89AC_4733B68A884C0F33_6041_UN,7.705119,00000000000000000000000000000000000000000010000000000000010000100000000000010000000101110000010010101000000111010001101011100100110011110110001011011011010011101111110,DRCSFVJCBVPHIL-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC(N3CCN(C)CC3)C4=CC=C(C=C4)F,79E390F5EB3A8F42_9D7D10DC42DC7E49_6041_UN,7.747259,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110001010010101000000110010001101011100100110001110110001001011111010110101111010,LHLIKURGTBILDT-HMTLIYDFSA-N
N(CC1C2CCC(C1)CC2)C(=O)CCCC3=CC(=C(C=C3)Cl)Cl,4DFC16EDFC4AEEDE_06611BF61F9D353A_6038_UN,7.7068806,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010011100000001001110100110000011000000000110010100000000011010011011110100111110,OVJQPGQWOQQSAA-UHFFFAOYSA-N
N(CC1C2CCC(C1)CC2)C(=O)CCCC3=CC(=C(C=C3)F)F,8AF2F8578BC40D89_9A9D796BA9E119A9_6038_UN,7.7068796,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000001000110100110000011000000000110010100000000011010011011110100111110,MKGLRDMRWCBKHE-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C3=C(C=CC(=C3)C4=C[N](C)N=C4)F)=O,8A2C05684D400A8B_C0A1F6110FF09707_6038_UN,7.6622205,00000000000000000000000000000000000000000010000000001000010000100100000000010000101100010001111010001000110100110000011011101100110010100100001011011011111111111111110,LJVKSMUTUXJRKH-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)N[C@@H]2CCO[C@H]2C3=CC(=C(C=C3)F)F)F)C4,5FC3C4CD571B9862_B6A9E53F8F220BEB_6041_UN,8.1284075,00000000000000000000000000000000000000000010000000000000010000100000000000010000000101110011000111101100110111010010101011100100110011110110001011011011110111101111110,QMVDPRFSFOJIHG-RTWAWAEBSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4=C(C=C(C(=C4)F)N5CCOCC5)F,4005047A042AD4B9_8B51A7269AC612F8_6041_DP,8.080006,00000000000000000001000000000000000000100010000000000000010000100100000000010101100101110011010110101000110101010000101011100100110111110110001011011011010011101111110,JBSIVDJQBWXGES-MUJYYYPQSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OCC2=C(F)C=CC=N2)C3,70C2E6C33C48CB48_870CF9007354AD91_6039_UN,8.1260195,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010111101000010101010001001001100011110000100110001111011110110111101111110,KXABSLOFTVRPBV-RSUWNVLCSA-N
C1(=NC=C(C=C1)CN2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,8518801A00543DFD_390B20AA1C5CD4CE_6041_UN,8.101364,00000000000000000000000000000000000000100010000000000000010000100100000000010101100101110011010110101000100111010001101011100100110011110110001001011011010111101111110,SUONKDKOXIEISU-CTNGQTDRSA-N
N3CCC(C[N]1C=C(C=N1)NC(CC)CC2=CC=C(C=C2)F)CC3,C3AB2980A031DC66_BAF29385F0463B63_6041_DP,7.931822,00000000000000000000000000000000000000000010000000001000000000000100000000010001101100110001001010101000100100010010101011101100110101110110001001011001010110101111010,JWCQVTFYBRBSHG-UHFFFAOYSA-N
C2(=CC(=C1OCCC1=C2)CC#N)NC3=CC4=C(C=C3)CC[S]4(=O)=O,0E03D51C1E559E75_C61E31C4C2F648B5_6041_UN,8.141037,00000000000000000000000000000000000010000100000000010001011111000001000001000000010100001001000010000110010001011100001010001101101011011110001111111001110111110111110,YBFYNVXKPWYXNR-UHFFFAOYSA-N
C1(=CC2=C(C=C1)OC(C2)C3OCCO3)NCC(N(C)C)C4=C(C=CC=C4F)F,0C8BC013CF2E6920_0CE397AF07AE4A9B_6041_UN,8.161243,00000000000000000000000000000000000000000010000000000000010000100000000010100001001101110001010010001100010101010100101010110100100011110110001011111111110111111111110,DERMHXYGYHOVOS-UHFFFAOYSA-N
C[N]1C=CC2=C1C=CC(=C2)[S](=O)(=O)N3C4CCC3CC(CCF)C4,A74FD20419C368A3_3D805FA269277105_6026_UN,8.15488,00000000000000000001000000000000110000000010000000010001001111001101000001010000010101001000011010100110011000011000011011101100111000101100001001011000010110111111110,WVVUAYAPAXABGP-UHFFFAOYSA-N
FC2=C1CCCC1=CC(=C2)NCC3CC4CCC3N(C)C4,3610FD69742439E4_7D8C3D18C4765E47_6041_UN,7.6278615,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001110011010010101100010110010001101001100000110001110110001011011001010110101111010,DGPUFCZXNZVNBU-UHFFFAOYSA-N
FC2=C1CCCC1=CC(=C2)NCC(OC)C3CCCO3,227892461556BDB9_B9B878D8D6C13E29_6041_UN,7.424631,00000000000000000000000000000000000000000010000000000000010000000000000010000000001100010001010111001100010111000000101000000010110011110110000010010001110111111111110,HIMYYKVNHGXJMP-UHFFFAOYSA-N
FC1=NC=C(C=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,32DC2048D764F157_4E825D7A28C8A7F1_6041_UN,8.367176,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,RMHXXWQEWRBVOS-ACJLOTCBSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3CC4(C3)CCOC4,C1590F6DB56251C9_8649F232DB625F4A_6041_UN,6.941402,00000000000100000000000000000000000000100000000000001000010000100110000000010101101101100010011010001000010011001000001011101100110011010110001010011111010111101111110,UDRQAPYWIQVKLK-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC=C2CCNCC2)Cl)C3CC3,57C2C3DE69C0B8A1_BB481F54085D06AE_7022_DP,8.200427,00000000000000000000001000000000000000000000000000100000000000100000000000001000001000110001000000111001100110010000001001000000110101110110001011010011010110101111010,KIBINEZRRIFYAO-UHFFFAOYSA-N
FC1=CC=C(C=C1)C3=C[N]2N=C(SC2=N3)NCC45OC(C)(C)C(C4)C5,332EFC62CFA08593_2E0DC2232244A92C_6041_UN,8.265087,00000000000100000000000000000000000010000010000100001000010000100110000000100101111100011010001110001100011110001000100011101100100011110100001000001101110111101111110,QRUVPDRUDMQISZ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCCC3OCC4(C3)CCC4,25D99D04533FA8E0_3E30BA76376FC510_6041_UN,6.9409075,00000000000100000000000000000000000000100000000000000000010000000110000000000100001100000001000011101100110011011000001011000100110011010110011011010111110111101111110,DKLNTQXPIIHXOO-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC2CCC3(CC2)OCCO3)C=CC(=C4)Cl)C5,7C91243886D955B6_2163F213506ED8F5_6034_UN,6.9123926,00000000000000000000000000000000000000000000000000000000010000000100000010010000100101110000010010101101010101011001101011110100110010100110001011011000110111111111110,MZLMRUJTQULKEK-UHFFFAOYSA-N
BrC2=C1N(C=CC(C1=CC=C2)=O)CC3C4CCC#CCCC34,B8D3F2D71820EDE2_0B508C4CEB9988EA_6034_UN,8.792554,00000000000000000100001000000000000000000000001000000000000000000100000000010000000001010000000001101100010100000100001001100101110000100100000101011000111110100111110,YQHIFMRFHBMLEF-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)[S](C3=CC=CC4=C(CBr)C=CC=C34)(=O)=O,713F39489A5BB9B6_CCDEE093E241530C_6029_UN,8.002551,00000000000000000000000000000000110000000000001000010001001111001001010001000000011000001011001000011110011000001000011000001100111000101010000001011001010110110111110,NZRGXOMEPOXXHE-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC2CC3(CN2)CCCCC3)C=CC(=C4)Cl)C5,05A112B4BD5A463E_EDC8109283F5B1AB_6034_UN,6.85413,00000000000000000000000000000000000000000000000000000000000000000110000000010001101101110011010010101101110100011001101011100100110000100110001011011001010110101111010,RFMBAVUVILBWFX-UHFFFAOYSA-N
C1(=C(C(=CC=C1Cl)Cl)Cl)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,E577FDF3A50F105E_01A57370978C55C7_7022_UN,8.602179,00000000000000000000001000000000000000000000000000000000000000000010000000100000001000010011000000001101010100001001101000000100110001110000000011010111010110101111010,HHBZYVUHWNJYFV-UHFFFAOYSA-N
C1(=C(C=CC=C1)CN2CCCCC2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,2F0887975A5E754D_DC94C698127FEEA4_7022_UN,8.063202,00000000000000000000000000000000000000000000000000000000000000100000000000010000101001110011010000101001000110010001101011100100110001110110001011011011010110101111010,OUURZXOBZQJYMS-UHFFFAOYSA-N
CC1=CC(=CC2=C[N](C)N=C12)NC3C4CC5CC3CC(C4)(F)C5,EC2F01CC6CD7CD73_70775AF939D491CD_6041_UN,7.325372,00000000000000000000000000000000000000000010000000001000000000000110000000010000100100010010011010000100010100001000000011101100100001110100001001001101000010101111010,HUBASIJNLXZMTD-UHFFFAOYSA-N
CC(C)C1=C(C=C(C=C1)NCC2C3(CCNC2)CCOC3)F,493AE184CEB0EF2A_6D9FC7607E0B7425_6041_DP,8.149434,00000000000000000000000000000000000000000010000000000100010000000010000000100000101100110011000010101000110101011000001011000000110111110110001011010111010111101111110,XVRHZISXEPPNKT-UHFFFAOYSA-N
O(C(CC1=C(C=C(C=C1)F)F)C#N)CC3OCC2(CCNC2)C3,73E503947024AE42_F1B975A9B7742298_6039_DP,8.143435,00000000000000000000000000000000000000000110000000000000010000000010000010000000001100110011000111001000110101011000001011000010110010100110001010010011110101110111110,YDVRKPPPNKGAQU-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC3C4(C(O)C3)CCOCC4,FCD106CD92FF0889_D69D7DA8AB5290DA_6041_DP,7.5431447,00000000000100000000000000000000000000100000000000001100010000100110000000010101100101100011011011100000110001011000001011101101110111010111001111011111110011111111110,YCUSJKGSEHMUNF-UHFFFAOYSA-N
C2(=C1CCCCC1=CC=C2)NC3=NC=CC(=C3)CN(C)C,980927437BD4ACC0_7E60B8742BA9809F_7022_UN,7.786687,00000000000000000000000000000000000000100000000000000000000000000100000000100100000001100011010000101100010000000001001001100100110001010100001011011101010110101111010,YIBDPHOPFKWLBQ-UHFFFAOYSA-N
FC2=C(C(=C1N=CC(=C(C1=C2)NCC3CCNC(C3)(C)C)C#N)F)F,F265D8E971928CBE_DD74321620E2335F_6041_DP,8.438091,00000000000000000000000000000000000000000110000000000000000000000110000000100000101000010011000000101100110110011001101011000100110101110110001011010111010110101111010,FTNLLPMBEMSNAQ-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C[N]2C=C(C=N2)NCC3N(C)CC4(CC3)CC4)F,54A844E8555F31CA_F37F9EE3F97C8E7E_6041_UN,8.100822,00000000000000000000001000000000000000000010000000001000000000000110000000010001101101110011011010101000010110011001101011101100110001110110001011011011010110101111010,HMHMJQSUGBFYFD-UHFFFAOYSA-N
NCC1=CC(=NO1)C=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,0B184495785EE6D0_08F0F43EB5701B9C_7019_UN,7.9565563,00000000000000000000000000000000000000000010000000000000010000000100000100000000101111010000011111011010000110010000101011101100010011110100001010011011110110101111110,HMSYVLFQEXEMRC-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCCCC3)C4=C(C=CC=C4)F,66FC203605D942D4_6CFDECD53AF8C110_6041_UN,7.5053563,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100110001110100001011011011000010101111010,AIBYSHLJSMMOEV-UHFFFAOYSA-N
N([C@@H]1CCO[C@H]1C2=CC(=C(C=C2)F)F)C(C3CC4CNCC(C3)C4)=O,0317A7B0B98E306B_78D3EAF150E02321_6038_DP,7.8887362,00000000000000000000000000000000000000000010000000000000010000100000000000000000001100110011100111101100110101110000011011000000100111100110001011010011111011110111110,ZDKRIKSWHBTHKH-NUKCSJPWSA-N
N([C@@H]1CCO[C@H]1C2=CC(=C(C=C2)Cl)F)C(C3CC4CNCC(C3)C4)=O,03A00A68FE0C81C9_4F5E984643B3B81C_6038_DP,7.8887277,00000000000000000000000000000000000000000010000000000000010000100000000000000000001100110011100111101101110101110000011011000000100111100110001011010011111011110111110,OISLPLOJWVUJFO-NUKCSJPWSA-N
FC1=C(C=C(C(=C1)C#N)F)NC[C@H]2CNCC(O2)(C)C,AEAE9FCCF012BDA7_3AF80D910EE8BF37_6041_DP,8.411334,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110001011000111110111101111110,JZEJLBFHMQTVGO-SNVBAGLBSA-N
CC1=C[NH]C2=C1C=C(C=N2)NCC3CCN(C)C3C4=CC=CS4,61C54A3182AAF445_486CE560B4935B5E_6041_UN,8.786531,00000000000000000000000000000000000010100000000000000000000000100100000000010101111101101011010010101100010010010001101011100100110101010110001000011111010110101111010,NINAQKNXIYEZRU-UHFFFAOYSA-N
NCC1(C(CCC1)OC2=C(C=C3C(=C2)CNCC3)F)CC4=CC=C(C=C4)F,6090383001CD55E3_EBB3331D80DAB886_6035_UN,7.5910506,00000000000000000000000000000000000000000010000000000000000000000010000000000000001010110011000011101100110100011100001001000111110110100110001111010011110101100111110,WGKUBFVBRAINPT-UHFFFAOYSA-N
FC1(CCOCC1)C2=CC=C(C=C2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=N[N]4C,AAE20A23C16AAEAC_8F8A28396013F9C0_6041_UN,7.579072,00000000000000000000000000000000000000000010000000001000010000100110000000010001101101110011011010101000000111011001101011101100110011110110001011011111010111101111110,TWRJVQVBOQWJLA-LAUBAEHRSA-N
FC1=C(C=C(C=C1)CC=C)NC3CCC2(COC(C)(C2)C)CC3,3A687B731E6B8F7D_86301587FF2FA710_6041_UN,8.074899,00000000000000000000000000000000001000000010000000000000010000000010000000100000000100010011000010010000110111011001101000000000110011110100000011010111110111101111110,FMGPMPJWWZNIPG-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)CCOC2)[S](C4=CC(=C3[NH]C=CC3=C4)C)(=O)=O,C0D98FA31661B8D7_1A564ADBB37F7840_6029_UN,8.738799,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100101001001010100110011001001000011011001100111111011110001011111001010011111111110,DSFHUIDFXSVTTR-UHFFFAOYSA-N
C[N]1N=CC2=C1C=C(C=N2)NCC3(CCOCC3)C4=CC(=CC=C4)F,A096CC5A56B99496_001F0B3A95C9641B_6041_UN,7.223226,00000000000000000000000000000000000000000010000000001000010000100110000000010001101100110011011010101100010101001000001011101100110011110110001001011001010111101111110,LKCVSRYHZCHWTL-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC=CC3CC3)C4CCNCC4,AF236089ADE08A39_842B33F9BFE5E849_6034_UN,8.616203,00000000000000000000001000000000000000000000000000000000000000100100000000010000001101100001000010111100110000010000001011100100110000000110001001011001010110101111010,NTUKPIMMLSYCOO-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NC[C@@H]3CCCN(C)[C@H]3C4=C[N](N=C4)C,FAB8CD543EAEAC95_E9757A7904DA7BF4_7022_UN,7.612046,00000000000000000000000000000000000000000000000000001000000000100100000000010000101101110011011010101101010110010001101011101100110001110110001011011111010110101111010,GYYXQMGVURVNIG-LAUBAEHRSA-N
C2(=C1CCCCC1=CN=C2)NCCC3=CC=C([Si](C)(C)C)C=C3,1D9506104F921B13_DA7FAAF5B94AE812_6041_UN,7.260779,00000000000000000000100000000010000000000000000000000000000000000100000000100001001000100011010000101100110000011000001001000100110001010100011011011101010110101111010,YIMOOXXFLPDXCC-UHFFFAOYSA-N
COC2=C1C=CC(=NC1=C(C=C2)F)NCC3OC4(CC3)CCOCC4,7807AD74BF393217_6BA266058E7D2DE8_6041_UN,7.1681814,00000000000000000000000000000000000000100010000000000000010000000110000000000100001100110111010111101100010101001100001011000111110011110110001101110001110111111111110,IZAKNYGETCTVJC-UHFFFAOYSA-N
NCC3(COC1=C(C(=CC=C1)C2CNCCC2)F)CCCC3,7793DA534F21E045_61968CBAE05C4473_6035_DP,8.139887,00000000000000000000000000000000000000000010000000000000000000100010000000000000001010110011000011101000100101011100001001000011110100100110001111010011110101100111110,UMPWMTVWHOIATG-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Br)NC[C@@H]3CCCN(C)[C@H]3C4=C[N](N=C4)C,0B2A953F8B47D1E2_B995324FEF511F82_7022_UN,7.612023,00000000000000000000000000000000000000000000001000001000000000100100000000010000101101110011011010101100010110010001101011101100110001110110001011011111010110101111010,OPKYSQRVABEHLJ-LAUBAEHRSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2(CCCNC2)C)F)CC3,933A9070041CE137_46D720E13AA4421C_6041_DP,7.527943,00000000000000000001000000000000000000000010000000000010000000000010000000010001101001110011010000101000100110011001101011100000110101110110001011011111010110101111010,PDHAFOXUKQXFOX-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NCC(N2CCCC2)C3=CN=CC=C3)F)C4,14DA263F5407154C_8A6A77D58E233F78_6041_UN,7.932698,00000000000000000000000000000000000000000010000000000000000000000100000000010001101101110001000010101100010110010010101011100100110001110110001011011001010110101111010,RFMKXZCFKPIFNP-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=NC=C3)NC5CCCN(CC4=C(C=CC=C4F)F)C5,FC75BDF8BEAE4431_E2D55BFB1873B022_6041_DP,8.461166,00000000000000000000001001000000000000100010000000000000000000000100000000010101101101110011010010101000111110010000001011100100110101110110001011011011010110101111010,PZVUFZKRGWHZHJ-CUXMIQLJSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2(C)COCC2)F)CC3,4B7EF868C209FF78_0B759F281555B8EC_6041_UN,7.1418285,00000000000000000001000000000000000000000010000000000000010000000010000000010001100101110011010111001000100111011001101011100000110011110110001010011111010111101111110,UJNOKEWRGXCTIY-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)N[C@@H]2CNC[C@@H]2CC3=CC=CC=C3)C#N,505D6C11CBC9C23A_68E1959113A0B6BB_6041_DP,7.47952,00000000000000000000000000000000000000000110000000000110000000000000000000000001101100110011000010001000100100010000000001000100110101110110001011000011010110101111010,BBDOYYURGLJQQQ-FUHWJXTLSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=C(C=C3C(=C2)C=CC=N3)Br)C4,049D26DEAF30E092_E3D82426A590E25F_6035_UN,8.007083,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000010011101100010100000101001001100111110000100100001111011110110111101111110,KIXZUKVVXYSFFO-OUFKLWKOSA-N
FC1=CC(=CC(=C1)NCC2N(C)CC3(CC2)CCC3)C[N]4C=CN=C4,F73BF3537CFC9179_93097F72BE2BCD4A_6041_UN,7.7147336,00000000000100000000000000000000000000000010000000000000000000000110000000010101001101110011010010101000010110011001101011100100110001110110001001011011010110101111010,OMJSIFAGEFGCIS-UHFFFAOYSA-N
CC1OC(CN(C1)CC2=CC=C(C=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C,4DF1FF95AA595164_A89FB7013756E48D_6041_DP,8.410092,00000000000000000000000000000000000000000010000000000100010000100000000000010000101001110011000100101000100110010001001011100100110111110110001001011111110111101111110,DMGHZLVQPUPVRP-KFTLUPKNSA-N
N(CCC1=CC2=C(C=C1)COC2)[S](C4=CC3=C(C=C(Cl)C=C3)C=C4)(=O)=O,463763A82E588D5A_D6FFF41F7A72363E_6029_UN,8.300594,00000000000000000000000000000000110000000000000000010001011111001001010001000000011100111000001010001111111101011000011000001100111000101110000011111001010111110111110,IQHRCPPDRWSKHS-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)C4CCC3=C(C=CC(=C3)F)O4,DA01980812A9D264_9FB34860165A1BFB_6038_UN,8.123957,00000000000000000000000000000000000000000010000000000000010000000000000010010000101001110011110100101100010110110101111011100000110010100110001011011001111111111111110,WSBIPIXSOJNFGI-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)NC(=O)N2)NCC3SCCC4=C3C=CC=C4,C202728590C48F32_DC9870A1E6254FC3_6041_UN,8.690177,00000000000000000000000000000000000011000001000000000110000000000100000000000101111100001001000010101100011010100100011011000101110101010110001111010011011110101111110,JNSKVVAZXLZGBA-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)Br)C)NCC2=NC=CN2CC3[C@@H]4CNC[C@H]34,FFC38A1D723F2724_7ECAF5DDC020A98F_6034_UN,8.170776,00000000000000000000001000000000000000100000001000000000000000000100000000010101001101110001000010101000010110010000000011100100110101110110001011001111010110101111010,CBQDMMSYZKFUGY-XYPWUTKMSA-N
N(CC1=C2C(=CC=C1)OCCO2)C(C45CC(C3CNC3)(C4)C5)=O,7ED3045A103DF138_660EECC8CA3B0ACA_6038_DP,8.015678,00000000100100000000000000000000000000000000000000000000010000100010000010000000001000100011100001101100010001101100011011000000110110000110001011110001111111110111110,FPEKSPXAZSRVTR-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)Br)C)NCC2=NC=C[N]2CC3[C@@H]4CNC[C@H]34,FFC38A1D723F2724_8447E8DD68B43348_6034_DP,8.170764,00000000000000000000001000000000000000100000001000000000000000000100000000010101001101110001000010101000010110010000000011100100110101110110001011001111010110101111010,CBQDMMSYZKFUGY-XYPWUTKMSA-N
O[C@H](CBr)C1=CC=C(C=C1)C2=CC=C(C=C2)NC34CC(C)(C3)OC45CCOCC5,FA1DD00055CB5567_7138118490178061_6041_UN,8.17083,00000000000100000000000000000000000000000000001000000000010000100010000000000000000100100111000111100000110011011001001010000100110111110111000001110001110111111111110,RQDYDZQORVSKEY-DDRJZQQSSA-N
N(CC1CC2CCC(C1)O2)C(C3=C(C)C4=C([NH]3)C=C(C=C4F)F)=O,54015BB02EB5909D_3E7E944A44A5708E_6038_UN,7.918242,00000000000000000001000000000000000000000010000000000010010000000100000000000001001100010011100110101100010100100000011011000100110110100100001011010011111111111111110,IRBPYJBWSIHJMJ-UHFFFAOYSA-N
CCC(C)C2=C[N]1C=CC=C(C1=N2)NC4CCCN(CC3=C(C=CC=C3F)F)C4,7F4D1C72CD1569B0_513DBB5C5964A6C6_6041_UN,8.38093,00000000000000000000000000000000000000100010000000000000000000000100000000010101000101110011000010101100110100010011001011100100110001110110001011011111010110101111010,CCFXFMCLUUYIFT-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC3C[C@@H]2CCCC[C@@H]2C3,7691F301B3F9182E_2D15968031BCFFB2_6041_UN,8.136238,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100001010010100100110000011000001001000000110001010100011011011111000010101111010,JXFZYHUBIIXZBN-YIONKMFJSA-N
N3CCC1=C(C=CC=C1C=CC2=C(C=C(N)C=C2)Cl)C3,F1E81D16E46EE6BD_627E98DB54F0E41D_7019_DP,8.8726845,00000000000000000000000000000000000000000000000000000000000000000000000000000000001010110001000000111101110100010000001001000100110101110110001011010011010010100111010,OFTACQIEXMYFLM-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCCOC2C3=CC=C(C)C=C3)F)CC4,A56DA4552AFDBCBB_A9EACC78558B2878_6041_UN,7.820387,00000000000000000001000000000000000000000010000000000000010000100000000000010001101001110011010001101000000111010001101011100100110011110110001011011111110111101111110,YANXEMRMHDHJCY-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)N[C@H]3[C@@H](C3)C4CCCCC4,C61F97D89C19887B_B0FB45B9C5205738_6041_UN,8.504286,00000000000000000000001000000000000000000010000000000000000000100100000000000001000000010011000000100100110100010000001001000100110001110100001011010011000010101111010,MPSYOSZTNAEFFH-MAUKXSAKSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCNCC2)F)CC3,F6034A6D0FFBECA3_1937944967C7E711_6041_DP,7.7550178,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010000101000100110010001101011100000110101110110001011011011010110101111010,LGCGXDDMQHAPEQ-UHFFFAOYSA-N
CN5CC(C1=NN=C(C)N1CC2(C)CCCCN2CC3=CC=CC=C3)C4(CNC4)C5,1B7BA8B12F03F9FF_2D0A251EB3BFC93A_6034_UN,7.824401,00000000100100000000000000000000000000100000000000001000000000100110000000010101101101100011011010101000010010011001101011101100110000000110011011011111010110101111010,MLVOLMQIHXDXPB-UHFFFAOYSA-N
CC1=C(C(=CN=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)F,AF85427800B8A595_7318E76645A2A17F_6041_UN,7.956804,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011111010110101111010,BAGHBZKLTOAFDP-KUHUBIRLSA-N
CCN(C)CC1=NC=CC(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,1482BDF16468D8DF_87E4F869B0B69429_6041_DP,7.7106133,00000000000000000000000000000000000000000010000000000100000000100100000000000001101001110011010000101000100100010011101011100100110101110110001001011111010110101111010,UVUFEURGRGZRSB-LAUBAEHRSA-N
FC1=CC=C(C=C1)C2=NC(=CN=C2)NCC[C@@H]3CC[C@H]4C[C@@H]3C4(C)C,5BB6D56C03E993F8_7A1C8B21D52C91FA_6041_UN,8.164861,00000000000100000000000000000000000000100010000000000000000000100110000000100101001000010001000000101000110110011000101011000100110001110100001001010101010110101111010,QQBXUJJXOGJTLD-ZVZYQTTQSA-N
FC1=C(C=CC=C1)C2=CN(C(=N2)C3CCCN3)CC4COCCN4C,4E43DD72B5DE6518_8C9DEE21B116DCC6_6034_UN,7.9365044,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101110011010111101000100101010001101011100100110010100110001011011011010111101111110,WUZRPTJHCXPJEX-UHFFFAOYSA-N
C2(=CC=NC3=C1N=CC=CC1=CC=C23)NC5CCC(C4=NC(=NO4)CC)C5,5F7B57470708186A_BDE610ADFB4F345D_6041_UN,8.59163,00000000000000000000000000000000000000100000000000000000010000100100000100000101100100000011101111100110110000110010011011001100010001010100001001010001000110101111110,CXLLRLHQKCPMSD-UHFFFAOYSA-N
FC2=C1C=CC=CC1=C(C=C2)NCC3CCCN(C)C3C4=CC=CS4,B7FEFECD8516CB01_A11AD7E0F6F68ABB_6041_UN,8.339774,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,HMFBHAHEHDZVQP-UHFFFAOYSA-N
C(C1CCCCC2OC12)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,574274C83FBC3759_3E6A1208BCC9AD39_7019_UN,8.074984,00000000000000001001001000000000000000000010000000000000010000000000000000000000000001010000010010010100010110010000101000100000110011110100000010011010100011101111110,ONWPIHZWTXRKSD-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC3CCOC2(CCCC2)C3)C=CC(=C4)Cl)C5,4A12098040021154_9093BA4D5006657B_6034_UN,6.8332562,00000000000000000000000000000000000000000000000000000000010000000110000000010000100101110000010010101101010101011001101011100100110010100110001011011000110111101111110,YAVSQFAXWMMNFT-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC3CC2CCC(N2C)C3)C4OCCO4,C29D6B1FE476DB3A_DB081B022F26F7D1_6041_UN,7.2007146,00000000000000000001000000000000000000000010000000000000010000100000000010010000100101010001010010100000110111010000101011110000110011110110001011011011010011111111110,TVKUEYUYWKVZBD-UHFFFAOYSA-N
C(C2C1CC3CC(C1)CC2C3)=CC4=C[N](C)N=C4C5=C(C=C(C=C5)F)F,62196897B7EC212D_E5C5FE24609BA3C6_7019_UN,8.319049,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010100010100000000000011101100100000100100001011001010000010101111010,FTQGHEDMINJNCG-UHFFFAOYSA-N
C4CCC1=C(C=CN1CC2(C)CCCC3=C2C=CC=C3)C4,E09280E6143CB0E3_183858C457DEE5AB_6034_UN,8.111752,00000000000000000000000000000000000000000000000000000000000000000110000000010000000101000000000010001100010010011001101001100100110000000100000011011000010110101111010,LQKWLAVFLBKJKV-UHFFFAOYSA-N
C(N3CCC1=C(C=C[N]1C[C@@H]2CNCC(O2)(C)C)C3)C4=CC=CC=C4,FFBEABB7255BB6EC_FA088E4B0E1A8949_6034_DP,7.9098263,00000000000000000000000000000000000000000000000000000000010000000110000000110000101101100010000110101100010010011001001011100100110010000110001011011101110111101111110,GCQIRASPSWHBOA-IBGZPJMESA-N
C2(=C1C=N[N](C1=CC=C2)C3CCCCO3)NC4=C[N](C[Si](C)(C)C)N=C4,3C3D004D9487E85F_55827F8C5A741064_6041_UN,7.5487466,00000000000000000000100000001010000000000000000000001000010000100100000000110001100100100001111110101100010001111001011011101100111011010110011001011101010111101111110,RVOIZOCYFOLHOQ-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NC4CC3=C(C=N[N]3C)CC4,3098439A20A32B3E_91BB86CBD7115206_6041_UN,8.772837,00000000000000000000000000000000000000000010000000001000000000000100000000010001100100010010011010100100110110010000101011101100110001110100001011011011000010101111010,YLRNTYQHBZZLBA-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,EA5A78F4BC545FB9_80E07A9CC8D13260_6041_UN,8.353958,00000000000000000000001000000000000000000010000000001000000000100100000000010001101100010011011010001000000100000000000011101100010001110100001010011011010110101111010,RMIPSEXSLDALGS-NWDGAFQWSA-N
CC1=C(C=C(C=C1)CC#N)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,1B37DD33AC66D086_EB13573FD7132737_6041_DP,6.9570894,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100110010000001001000100110101110110001011010011010110101111010,OJUCETYQZGBXCB-AZUAARDMSA-N
C1(=CC2=C(N=C1)OC=N2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,F46DDF2E65C53EC0_A8DF7C21A24E516D_6041_UN,9.301651,00000000000000000000000000000000000000000010000000000000010000100100000000010001100101110011110110101100110110110001111011100100000001110100001011011011010010101111110,NOJRJFPDQOCREW-ZBFHGGJFSA-N
CC1=NC5=C(C(=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)C=CC=C5F,41F59B1717E24401_B5E211E2B8B6CA8B_6041_UN,7.6346593,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011111010110101111010,URHHWHBFBTZIJQ-MWTRTKDXSA-N
FC1=CC(=CC=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,C6DEF50B83910020_BF65B7D53FD35B13_6041_UN,7.8902073,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,NOLNKVMXPJVLQD-KUHUBIRLSA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=C3)CC4(N)CC5=C(CC4)C=C(C=C5)Br,53D7DE192DCA073B_67C1D6F423773CF3_6034_UN,8.252408,00000000000000000000000000000000000000000000001000000000000000100110000000010001001111110011000010101100110100011000001011100100110101100110001011011001010110100111010,KJEKLQIIENXLHK-UHFFFAOYSA-N
FC1(CCOCC1)C2=CC=C(C=C2)NC[C@@H]3CCCN(C)[C@H]3C4=CN=C[N]4C,37DA927D5D0B98B1_D38EC5CCD7F08893_6041_UN,7.8237042,00000000000000000000000000000000000000000010000000000000010000100110000000010101101101110011010010101000000111011001101011100100110011110110001011011111010111101111110,LJUXULCOFVJLCI-LAUBAEHRSA-N
CC1=C[N](N=C1)CC2=C(C=C(C=C2)NC[C@H]3CNCC(O3)(C)C)F,1A5671E288D969DB_BDD4B38F0B5E293D_6041_DP,8.125089,00000000000000000000000000000000000000000010000000001100010000000110000000110000101100110010001110101000000110011001000011101100100111110110011011001111110111101111110,FVFWWOJKSYYDFD-MRXNPFEDSA-N
CC1=CC=C(C#N)N1C[C@H]2[C@@H](CNC2)C3=CC=C(C=C3)Cl,C78E12F6EBD1AE69_C6D2E9EEF69A5B3F_6034_UN,7.74105,00000000000000000000000000000000000000000100000000000000000000100100000000010001101101110011000010001001000100000000100011100100110000100110001010001011010110101111010,ANUBYXJIVFRWNS-YOEHRIQHSA-N
FC1=C(C2=C(C=C1)C=CN=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,71D9E554F768EBF4_005E2CE5AF65B868_6041_UN,8.3022175,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,HZLPRJYMIIWBRL-ZHRRBRCNSA-N
FC2=C1N=CN=C(C1=CC=C2)NC3CCN(C)C34CCCNC4,FFD2295119A2A757_3E9568B0AF38B6D7_6041_DP,8.334318,00000000000000000000000000000000000000100010000000000100000000000110000000010101101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,WEBGVIGJWDHRDG-UHFFFAOYSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC[C@H]3[C@H]2CCCCN2CCC3,59C9F11CA7870CE7_FC988C1A27EB524E_6041_UN,7.9366283,00000000000000000000100000000010000000000000000000000000000000000000000000100000101001100011010000101100010000011001001001100000110001010110011011011111010110101111010,XMLHDRBIZHXTIF-FXAWDEMLSA-N
N(CC12CCC(CC1)O2)C(=O)C3=C[NH]C4=C3C=C(C(=C4)Br)Br,0175BAC199576AD0_04B9C47CAED2C6F7_6038_UN,7.776701,00000000000000000000000000000000000000000000001000000100010000000110000000000000101100010011100111001100010100101000011011000100110110100100001011010011111111110111110,KTZTXDJMEWGIDI-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)NCC2(CCNC2)C3CC3)F)C#N,81B525DA9EF316B1_3BB8F871962B1A6A_6041_DP,8.565337,00000000000000000000001000000000000000000110000000000100000000100010000000000000101100110011000010001000100100011000001001000000110101110110001010010011010110101111010,GGAOFRMBKSMDHX-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=NC(=C2)NCC3CCCN(C)C3C4=CC=CS4,6D59EAD8078F8EB4_E99ADE72916DD415_6041_UN,8.417065,00000000000000000000000000000000000010100010000000000000000000100100000000010100111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,BXAIWZURKUTWOW-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CC3)C4=CC=C(C=C4)F,13A2ED0399185457_C48F549D3BAD6C5B_6041_UN,7.729062,00000000000000000000001000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100010001110110001011011011010110101111010,PZEYCOZDSIPPQY-SFHVURJKSA-N
FC1=C(C=CC(=C1)C#N)[N]2C=C(C=N2)NCC4OCC3(CCNCC3)C4,3A5ACAF9D8E16560_675F2393F3402042_6041_DP,8.191928,00000000000000000000000000000000000000000110000000001000010000100110000000010001101100110011001110101000110101011000001011101100110111110110001011011011110111100111110,NKDKYFUTEYUABZ-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2CCCCC23CCCNC3)F,64F68C47EBE91686_0F252364DEA3B0D2_7022_DP,7.4408016,00000000000000000000000000000000000000000010000000000100000000000010000000100000101001110011010000101000110100011001001001100000110101110110001011011111010110101111010,DJZUMRACDXUWNZ-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)C#N)N[C@H]2[C@@H](OCC2)C3=CN=CC=C3)F,C2D714C424C7E2A2_D75FF7AEC7596031_6041_UN,7.5063367,00000000000000000000000000000000000000000110000000000000010000100100000000000000100100010011000111100000100101010000001011000100000011110100001011010011110011100111110,CVGACUXEFNBBBI-CJNGLKHVSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCCC2CC)F)CC3,E1952992BF8139B2_2ABB07FAFC6979A0_6041_UN,7.567709,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010010001000000110010011101011100000110001110110001010011111010110101111010,ZWIAVNRNPFNGLJ-UHFFFAOYSA-N
N(C1=C2C(=CC=C1)CCOC2)[S](C4=CC(=C3[NH]C=CC3=C4)C)(=O)=O,F7E787488CEB0489_96BBE3401E58E633_6029_UN,8.661137,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100101011001011100110011001001000011011001100111111011110001011111001010011111111110,ZPJUUMCFXUIICY-UHFFFAOYSA-N
CN5CCC1=C(C4=C([N]1CC2CCC3(CN2)CC3)C=CC(=C4)Cl)C5,DA4D01488A3CCE24_B635951E33DEF9CE_6034_DP,7.189786,00000000000000000000001000000000000000000000000000000000000000000110000000010001101101110011010010101101110100011001101011100100110000100110001011011001010110101111010,VYSFVSOARKOOPL-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3CNCCC3)CC4CC4=CC5=C(C=CC=C5)Cl,D8E8E1164BCFF51D_7E2334827197AE2F_6034_UN,8.107861,00000000000000000000001000000000000000100000000000100000000000100100000000011101101101110011000010111101110100010000001011100100110000100110001011011011010110101111010,KAAPQIKYJFHZGV-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)NCC3(CC2(CNC2)C3)C4=CC=CC=C4)F)C#N,7C7A886887A555E2_04CA144B95F2BB64_6041_DP,7.458806,00000000100100000000000000000000000000000110000000000000000000100010000000000000001000110010000000001000010100001000000001000100100101110110001011000011010110101111010,HHXNKEKDHPBWQV-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[CH]2CC[C]3(CC2)C[CH2]C3)F)CC4,34F3A858A6A3D5FD_F862066BAEEF99D5_6041_UN,7.1975293,00000000000100000001000000000000000000000010000000000000000000000010000000010001100001110010010000001000110110011001101011100000110001110110001011011011010110101111010,LTKCKLSDDAFKSK-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC(CCC)C3=C(C=CC(=C3)F)F,5DA6E56CB4F4A37E_2D5926E56022275D_6041_UN,8.011224,00000000000000000000000000000000000000100010000000000000000000100100000000010100100101110010010010101000100110010011101011100100010001110100001011011111010110101111010,NVXSPZJRMUIAOX-GGYWPGCISA-N
FC1=C(C(=CC=C1)NC[C@@H]2CCO[C@H]2C(C)(C)C)C3CC3,D7B2830DC29AF147_B9C8BF153E217B69_6041_UN,7.999998,00000000000000000000001000000000000000000010000000000000010000100010000000100000001100010011000011001000000111001000001000000000110011110110010010010111110111101111110,QRVBWTNOPTWFCQ-SUMWQHHRSA-N
CC[C@@H](OC[C@@H]2C[C@H]1COC[C@H]1O2)C3=CC(=C(C=C3)C)F,EB6FA577606EA9B0_BF201CC2C56FFE0B_6039_UN,7.9322224,00000000000000000000000000000000000000000010000000000000010000000000000010000000000100110100000010000100010111000010000010000010110010100110000010100110110101011011110,AXMDDTBYHBGIBJ-XJNFMUPTSA-N
CC2=CC1=C(C=C(C=C1)Br)N2CC(CC)C3=CC4=C(C=C3)CCCC4,B39944F8FC3390F7_B34889231B214EBE_6034_UN,7.782695,00000000000000000000000000000000000000000000001000000000000000000100000000010000000101010000000010001100010100000010101001100100110000100100000011011110010110101111010,PEBVIVGCPCPSGY-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1)F)N2CC(CC)C3=CC4=C(C=C3)CCCC4,075F241549CE2732_429B43F366324450_6034_UN,7.782697,00000000000000000000000000000000000000000010000000000000000000000100000000010000000101010000000010001100010100000010101001100100110000100100000011011110010110101111010,INPDXMMZCVKBHD-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[NH]C=C2C3CC3)NC4=CC(=C(C=C4)F)C5CC5,02AFA09376D6BF3A_2FFA8990043A39BB_6041_UN,8.707163,00000000000000000000001000000000000000000010000000000000000000100100000000000000000100010001000010000100010100000000001001000100000101110100001011010011000010100111010,QEDJALCAQOTCHA-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=CC3=C(C=C2)CCCC3,62AF3FE2FFB94232_D0D0AEA1AD7A2FF6_6041_UN,7.8301153,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100001010000100100010000001000001001000100110001010100011011011111000010101111010,YEBLXYWCHUJNHO-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CCNC(C3)(C)C,63D21CEDAF33DD97_32F2EB5CED6C376C_6041_DP,7.8854346,00000000000000000000000000000000000000100000000000000000000000000110000000100100001000000011000000101100110010011001101011000100110101010110011011010111010110101111010,AAZUJZPIAAKAMG-UHFFFAOYSA-N
CN(C)CC1=CC(=NC=C1)NCC2(CCNCC2)C3=C(C=NC=C3)F,36691DD93BEF3752_2AD5EE6B2612AFA0_6041_DP,7.8891535,00000000000000000000000000000000000000100010000000000000000000100110000000100100001001110011010000101000100100011001001011100100110101110110001011011111010110101111010,HXHDMFSGUGGYPF-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2(CCOCC2)C#N)N[C@H]3[C@@H](C3)C4=CC(=C(C(=C4)F)F)F,6BDA16F9EFBE9BF7_884CCD033611C45C_6041_UN,7.581792,00000000000000000000001000000000000000000110000000000000010000100010000000000000000000110010000000100000100101011000001000000100110011110110001011010011010011100111110,LNRJWORUEQVXHR-QFBILLFUSA-N
CC4=CC1=C(C=C(C=C1)NC2CCN(C)C23CCCNC3)[NH]4,BE123D44FCD25AF4_7C2B653EF4F9C55D_6041_DP,7.7192526,00000000000000000000000000000000000000000000000000000100000000000110000000010001101101100011010010101100110010011001101011100100110101010110001001011101010010101111010,MZKJJSAKDYFERZ-UHFFFAOYSA-N
N(CCC1C3CC2CC(CC1C2)C3)C(C4=C(C)C5=C([NH]4)C=C(C=C5)F)=O,2C8B9197C2B5DFDB_E07DC28EFE930078_6038_UN,7.6350527,00000000000000000000000000000000000000000010000000000010000000000100000000000001001100010001100110001100110100110000011001000100110100100100001011010011011110101111110,JNBCCIACSLDVRP-UHFFFAOYSA-N
N3CCC(C)(COCC2COC1(CCOCC1)O2)CC3,670F4AE7B331AB0A_02EC3F1E38BDE6D7_6039_DP,7.973531,00000000000000000000000000000000000000000000000000000000010000000010000010000000001100100101000010101000110011011001101011010010110010000110100001110001110101111101110,KPTULWYKRBIOCZ-UHFFFAOYSA-N
N4CCCC3(CN(CC1=NC=C(N=C1)NC2=C[N](C[Si](C)(C)C)N=C2)C3)C4,EA9ED3FAB6D67390_9BA2B085D6E20857_6041_DP,6.896988,00000000100100000000100000001010000000100000000000001000000000000110000000110101101101100011011010101000110000011001001011101100110101010110011001011101010110101111010,MYSCPTNHSWGBDM-UHFFFAOYSA-N
C2(=C1CCCCC1=NC=C2)NC3=CC=C(CO[Si](C)(C)C)C=C3,80A7FFE79F9B5CF1_3A3D0450247C2E2B_6041_UN,7.602613,00000000000000000000100000000010000000000000000000000000000000000100000000100000100000100011010000100110010001011000101001001110110001010100011011011101010111101111110,RRMBZOBOIBMXAU-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C#N)NC(C2CNC2)C3=CC=C(C=C3)F,2EBE3A6418E7890A_8F8005E714199926_6041_DP,7.3478947,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110010000000001000000100000000000001000100000101110110001011000011010010101111010,JDTOWGBQBSGBBS-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)N[C@@H]3C4=C(OC(C)(C3)C)C=CC(=C4)F,D281284F2AA3B69A_55D04C81E053B62C_6041_DP,8.217509,00000000000000000000000000000000000000100010000000000000010000100110000000110101101101010011010011101100110110011101001011100100110111110100011011011111110011101111110,MVAMBCUXVWJKRP-LYKKTTPLSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NCC3CCCN3CC4CCCCC4,811C0596AF9D4398_A9A3AB9E9316AFB5_6041_UN,7.9425592,00000000000000000000000001000000000000000010000000000000000000000100000000010101001101110011010010001100011110010000001011100100110001110110001011011011010110101111010,BZOIZKVNIUIIDL-UHFFFAOYSA-N
C2(=C1[NH]C3=C(C1=CC=C2)CCC3)NC4=C(C=CC(=C4)[N](=O)=O)F,B8B1FAA9C9473C74_F1AA2A4F527C152A_6041_UN,8.540434,00000000000000000000000010000000000000000010000001000010100000010100001100000001100100010011001010000110110100010000001101101100011101110100001011011011000010110111110,JVBDPAHRJMZUFK-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NCC3(CNC3)C4=NC=C(C=C4)F)C,FE096286E2897771_5E3E3F9B3D7FC2D1_6041_DP,8.174734,00000000100100000000000000000000000000000010000000000100000000100110000000000000101100110010000010101100010100001000000011000100100101110110001011000111010110101111010,QUIUFLQVPSGBQH-UHFFFAOYSA-N
NCC(C1=CN(C2=C1C=CC=C2)CCOC3CNC3)C4=C(C=CC=C4)Cl,D10E52873AC834E0_D91CFD3DF42D8E2F_6034_UN,8.507879,00000000100100000000000000000000000000000000000000000000000000000100000000010000001111110011000110001101010101010000001011100111110110100110001111011011110111100111110,GKLLYEWBEVCUEA-UHFFFAOYSA-N
C(C1CCNCC1)C3=NC2=C(C=CC=C2)[N]3CCC4CNC(C4)(C)C,4C2DF4CD06250277_321B8504C517C121_6034_DP,7.7755003,00000000000000000000000000000000000000100000000000000000000000000110000000110101001101100011000010101100110010011001101011100100110100000110001011011111010110101111010,PVUBVJIXWGCUHV-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCCC(CC)CC2)F)F,7E5D1E963ED04081_A086D295DC559CF2_7022_UN,8.607552,00000000000000000001000000000000000000000010000000000000000000000000000000000000001000010011000000001000000110000010101000000000110001110000000010010111010110101111010,BOKBVOGOOPFGAV-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC3CNCC(O3)(C)C,CF323F6AE06FA79F_BC4D0776BFA58A0C_6041_DP,8.161276,00000000000000000000000000000000000000100010000000001100010000100110000000110101101100110010011110101000000110001001000011101100100111110110011011001111110111101111110,ZHOIFPZWWYGLKZ-UHFFFAOYSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)NCC5(CC4(CNC4)C5)C6=CC=CC=C6)F,76F44F24E446DAC6_674C238F9B83DE04_6041_DP,7.520718,00000000100100000000000000000000000000000010000000000000000000100110000000000000101000110011000000101100010100011000001011000100110101110110001011010011010110101111010,WIWSNDSEPZUORK-UHFFFAOYSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC3=C([N](N=C3C)C4=CC=C(C=C4)F)C,69893D73E9C6E01A_1D2EF2959F9439C2_7019_UN,8.301331,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010000001010010000000100000000000011101100110001110100001010011110000110101111010,RVWSBGPQQPTBMA-UZLBHIALSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC3=C([N](N=C3C)C4=CC=C(C=C4)Cl)C,E993301C98A84034_35F4B5B19F753012_7019_UN,8.301321,00000000000000000000001000000000000000000000000000001000000000100100000000010000100100010000001010010001000100000000000011101100110001110100001010011110000110101111010,WVUKADJDSDYFGK-UZLBHIALSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C)C,0E34AC69898B4F77_429F5863336FC3E4_6041_UN,8.381447,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101100010111010001101011101100110011110110011011011111110111101111110,KOZNDOVJQZAYEE-RXVVDRJESA-N
C1(=CC(=NC=C1)C2=NCCO2)NC3=C[N](C[Si](C)(C)C)N=C3,913E6357CED91BFB_9097E3D0A6DF6056_6041_UN,7.447743,00000000000000000000100000001010000000000000000000001000010000100100000000110011100100100001111110101000000001111001011111101100000011010110011000011101010111101111110,XFZRAJRHQVTDFU-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC(CN)COC2=C(C=CC(=C2)C3CNCCC3)F)Br,A230EDF9EA888736_13AA30D7383F7A70_6035_UN,8.076031,00000000000000000000000000000000000000000010001000000000000000100000000000000000001010110011000001101000100101010100001001000111110100100110001111010011110101101111110,ONSIGMJAEWCIMQ-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)NC(CCC)C2=C(C=C(C=C2)F)F)C3[C@@H]4CNC[C@H]34,D0BC788C382BD2B7_17EC57EF312C9852_6041_DP,8.073268,00000000000000000000001000000000000000100010000000001000000000000100000000000101101101110011011010101000110110010011001011101100110101110110001011011111010110101111010,BRIQIVOTVZTROZ-OSHAMATESA-N
CN(C1CCCNCC1)C2=NC(=NC=C2)N[C@H]3[C@@H](C3)C4=CC=C(C=C4)F,1492B84635CC7941_AF0DFC1E1E0FCE16_6041_DP,7.9485006,00000000000000000001001001000000000000100010000000000000000000100100000000000100101001110011010000101000101110010000101011100100110101110110001001011011010010101111010,GLPDGVFRGKPYHS-UQJFVLDMSA-N
CC5(C)CCC1=C(C4=C(N1CC2[C@@H]3CNC[C@H]23)C(=CC(=C4)F)F)C5,9E7C5EF10C8B7A5A_4216F884AC0D3AC2_6034_UN,8.779974,00000000000000000000001000000000000000000010000000000000000000000110000000110000001101110001000010101100010100011001101011100100110000100110001011011101010110101111010,LCPQGVPPXRFWSS-XYPWUTKMSA-N
CC5(C)CCC1=C(C4=C([N]1CC2[C@@H]3CNC[C@H]23)C(=CC(=C4)F)F)C5,9E7C5EF10C8B7A5A_B89BE5840499A005_6034_DP,8.779975,00000000000000000000001000000000000000000010000000000000000000000110000000110000001101110001000010101100010100011001101011100100110000100110001011011101010110101111010,LCPQGVPPXRFWSS-XYPWUTKMSA-N
O(C2C1CCOC1C23CCCCC3)C4=C(C=C(C(CC)(C)C)C=C4)Cl,CC3DFB489C5A0E89_9CF2B55B1697D996_6035_UN,7.555288,00000000000100000001000000000000000000000000000000000000010000000010000000100000000100010100000010000001010101001111001000000011110010100100010111010110110101011011110,GAVOOHQFRMPLPB-UHFFFAOYSA-N
CN1CCCC1C2=CC=C(C=C2)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,059ACD01630E9E6B_609F8C6FB035A617_6041_UN,7.404179,00000000000000000000000000000000000000000010000000000000010000100000000000010000001101110011010011001000000111010001101011100100110011110110001001011011110111101111110,FNXUEMYJBUCCKF-HURFNXGFSA-N
C1(=CC2=C(C=C1)C=CN=C2C#N)NC[C@@H]3CNCC(O3)(C)C,722662C000DC2EBE_FFACC7A8670BCDEE_6041_DP,7.469275,00000000000000000000000000000000000000000100000000000100010000000110000000100001101000100010000100101100010010001001000011000100100111010110001001000101110111101111110,AVTLJPQKOTYYIO-AWEZNQCLSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC3N(C)CC(CC3)(C)C,FB90B044236B9B34_8631BA0CE366B6D0_7022_UN,8.262344,00000000000000000000000000000000000000000010000000001000000000000110000000110001101101110011011010101000000110011001101011101100110001110110011011011111010110101111010,JXZMMGZPGWDVFQ-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,E6B4228018918B50_98C045EBAA8931CD_6041_UN,8.312254,00000000000000000000000000000000000000000010000000000000000000100100000000010001101101110011010010101100010110010001101011100100110001110110001011011111010110101111010,VUAKZTYVCAYYKT-UWJYYQICSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)N[C@H]4C5=C([C@H](N3CCN(C)CC3)C4)C=CC=C5,FB07D141B635A968_1D3D004FCC76983B_6041_UN,7.913061,00000000000000000000000000000000000000000010000000000000000000100100000000010001100001110000010010101100110100010001101011100100110001110110001011011111010010101111010,DBWPIDUOKKVUKW-DHIUTWEWSA-N
FC1=CC2=C(C=C1)N=CC(=C2)NCC3CCCCN(C)C3,A185ED41E0AE274D_5D76A7A11D3FD968_6041_UN,8.310917,00000000000000000001000000000000000000000010000000000000000000000100000000010001101001110011010000101100010110010001101011100100110001110110001001011001010110101111010,QYEQUOXCDNLOOR-UHFFFAOYSA-N
FC2=C1C=CN=CC1=C(C=C2)NCC3CCCC(CC)CC3,B7828E4EA3469D4B_AF0496A91861C0AB_6041_UN,8.460251,00000000000000000001000000000000000000000010000000000000000000000100000000000000101000010011000000101100010110000010101001000100110001110100001001010001010110101111010,BPTUZLMPOLLIOS-UHFFFAOYSA-N
CC1CCC2=C(C1)SC3=C2C(=NC(=N3)C)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,1723178C31DB42D3_E24D1A0A3F95384C_6041_UN,7.8599615,00000000000000000000000000000000000010100010000100000000000000100100000000010101110101111011010010101100110110010001101011100100110001110100011011011111010010101111010,GASYTFVPFHDVOB-CTJJFZBBSA-N
CC1=C(N=C(S1)NCC2N(C)CC3(CC2)CC3)C4=CC=C(C=C4)F,B90302D88AFA797B_74D05AEB255E25F0_6041_UN,7.5178804,00000000000000000000001000000000000010000010000100000000000000100110000000010101011101111011010010101000011110011001101011100100110001110110001011011111010110101111010,OFRDEBNNHDDJNM-UHFFFAOYSA-N
FC2=C1C=CC=CC1=CC(=N2)NCC3N(C)CC4(CC3)CCC4,9EC20F8250E91C4C_A455333CF84BA662_6041_UN,7.6589565,00000000000100000000000000000000000000100010000000000000000000000110000000010101001001110011010000101100010110011001101011100100110001110110001001011011010110101111010,HSXBSGFNTRMRJX-UHFFFAOYSA-N
O(C3CCN(CC1=CC=CC=C1)C2(CCC2)C3)CCC(C)C(F)F,72FD410C2F71ED6D_AD37C2835F58CAEB_6039_UN,8.067142,00000000000100000000000000000000000000000010000000000000000000000010000000010000000001100000000001101000010101011001101001100011110010100110000101011000110111101111110,LGJDWZRZOWRGQV-UHFFFAOYSA-N
C(C2CCC1(CC1)C2)=CC3=C(Cl)[N](C(=N3)N(C)C)C4=CC=C(C=C4)F,A092C5DD69A5D86B_28FEFE0DF73EA806_7019_UN,7.2636414,00000000000000000000001001000000000000000010000000000000000000100110000000110101000101110000010010010001011100001000001011100100110001110100001010011110000010101111010,XBXPRKIJZVQGPT-UHFFFAOYSA-N
FC1=C(C=NC=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,F40ECDB4DF908692_267C21AFB2AE0AC1_6041_UN,8.172104,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,IRTCNQKMOIEUBS-ACJLOTCBSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NC2=C3C(=CC=C2)CCCO3,30431B18B1CDE59F_41E395644D56926B_6041_UN,7.653256,00000000000000000100100000000010000000000000000000000000010000000100000000100001000000100001010100100100010001001100001011000100100011010100011011011111110011101111110,AGZSEASWWMJGEF-UHFFFAOYSA-N
O(C3CCN(CC1CCCC2=C1C=CC=C2)CC3)CC4CNC(CO4)(C)C,FF3396CD1AF5477E_DBE5663947E968DA_6039_DP,7.9776373,00000000000000000000000000000000000000000000000000000000010000000010000010110000001001100011000101101100110001011001101011100011110010000110001111011101110111111111110,LBNGXTHTFFJWHK-UHFFFAOYSA-N
CN(C)C1CC(CCC1)OC2=C(C=C(C=C2Br)Br)C3=CC=NO3,7FE58891CCB966AD_E4B5FB60A100B507_6035_UN,8.269766,00000000000000000000000000000000000000000000001000000000010000100100000100100000000101110100011011000010000110010100101011101111110011100100001111011110100011111111110,YAWMNKYOTUXREF-UHFFFAOYSA-N
NCCC3(COC1=C(C(=CC=C1)C2CNCCC2)F)CC3,15FBFF8C35AAD221_D40E8D503047A57B_6035_UN,8.511222,00000000000000000000001000000000000000000010000000000000000000100010000000000000001010110011000000101000100101011100001001000011110100100110001111010011110101100111110,QOURGUDOBJAAIV-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NC3=CC(=N[N]3C)C4CCCO4,0A04C9F81A262CBE_6E9B4FE6915D8E8C_7022_UN,8.107023,00000000000000000000001000000000000000100010000000001000010000100100000000010101100100010000011111000000000101000000001011101100010011110100001010011011110011101111110,SGZYIXOHGJYYOL-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NC3=CC(=N[N]3C)C4CCCO4,324F083A16B0A1BC_9A5BBDEBD91E2F33_7022_UN,8.107017,00000000000000000000001000000000000000100000000000001000010000100100000000010101100100010000011111000001000101000000001011101100010011110100001010011011110011101111110,LCRZZBRCNNITHA-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NC2=CC=CC3=C2CCNC3,65F1546C1BB93639_1A10470AA7A16AB2_6041_DP,7.4465766,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100011010000101100110000011000001011000100110101010110011011011111010010101111010,ZWLBWBVQLJRNHV-UHFFFAOYSA-N
FC2=C1C=CC(=NC1=C(C=C2)F)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,4BFE90C2B0971823_B10E74D27C9C55CB_6041_UN,8.631535,00000000000000000000001000000000000000100010000000000000000000000110000000100100001000010011000000101100010100001001101001000100110001110100001011010101010110101111010,UCTKZBPEVZCADN-UHFFFAOYSA-N
C1NCC=C(C1)C3=CC2=C(N=CC=C2)N3CC4(CN(C)C)CCCC4,283963917B31D017_02FFAC20E76244E7_6034_UN,7.7274814,00000000000000000000000000000000000000100000000000100000000000100110000000111100101101100001010010111100110010011001001011100100110000000110001011011111010110101111010,SPPCQLWGZPJBAR-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)C=C[C@@H]2CCO[C@H]2C3=CC=N[N]3C)OC(OC4)C5=CSC=C5,0F361B38A2225795_8E156F9CD3DA2912_7019_UN,8.439652,00000000000000000000000000000000000010000010000000001000010000100100000000010000100100011100011111110100010101000100001011111100000010100110001011111010110011111111110,HZGHTKHQTHJKJE-WEENHAKISA-N
C1(=C(C=CC(=C1F)F)Cl)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,D7D8F4C8D8D34524_9CC5D0BCC4230B60_7022_UN,8.777065,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101010011010010101001000100010000001011100100110001110110001011011011010110101111010,ALCSQIIWMBGREQ-BLVKFPJESA-N
CC2=C1N=CC=C(C1=C(C=C2)NC4=C(C=C3OCCCOC3=C4)[N](=O)=O)F,67AF085680A7A3CC_E2CDB7D7C105ABC9_6041_UN,7.879817,00000000000000000001000010000000000000000010000001000000110000010100001110000001100000010100001001100110010101000100001111101100001011110110101011111011110011111111110,UGXPYHLMZHKYJB-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2CC4[C@@H]3C[C@@H](C3(C)C)CC4)C5CCNCC5)F,E564290B272D3343_CE7DA0DB42201A28_6034_UN,8.242791,00000000000100000000000000000000000000100010000000000000000000100110000000110101001101110001000010101000110110011000101011100100110000100110001011011111010110101111010,CSRTUXLKEBCWTN-MNNMKWMVSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4=C(C=CC5=C4OCO5)F,9011A89777961368_726C816C6F54C1E8_6041_DP,8.473677,00000000000000000001000000001000000000100010000000000000010000000100000010000101100101010011010111100100110101010100101011110100110101110100001011011011110011111111110,PNTBKYYFEHNAMU-CLLJXQQHSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NCC5=NC4=C(C=CC=C4F)O5,827BBCA1A9C6F68F_FC64F56A9C4F1A86_6041_DP,8.462094,00000000000000000001000001000000000000100010000000000000010000000100000000000101101101010011110110101100111100110000111011100100110111110100001001011001110110101111110,OHKCBDOCJWRYEV-BTTYYORXSA-N
N3CCC(C(OC2=CC=C(CNCC1N(CC)CCC1)C=C2)C3)C4=CC=C(C=C4)F,5581A72D0A68FDB7_15B37D14B301DBB8_6035_DP,8.317096,00000000000000000000000000000000000000000010000000000000000000100000000000010001001101110011000110101000100110010110101011100111110110100110001101011011110111101111110,RVVWZHNLQIJZMP-UHFFFAOYSA-N
CN(C)CC1=CN(C2=C1C=CC(=C2)F)C[C@H]3NCC4(C3)CC4,BE56050E1D1C397A_7882C0A767B30418_6034_UN,7.1812015,00000000000000000000001000000000000000000010000000000000000000000110000000110001101101110011010010001100110100011001000011100100110000100110001000011101010110101111010,JLPJALKEDDPRIF-HNNXBMFYSA-N
ClC1=C(C=CC(=C1)NCC2=NC=CN2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4)Br,721A2C12DDFBA1BC_92A758965639D950_6034_UN,7.7845774,00000000000100000000000000000000000000100000001000000000000000000110000000110101001101010001000010001001010110011000101011100100110001110110001011011111010110101111010,PYDJXCYPNMNKSK-ZMSDIMECSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NC4CCN(CC3CCOC3)CC4,E2E2F6AF4421195A_95CF7F5C095713CF_6041_UN,8.520063,00000000000000000000000000000000000000000010000000000000010000000100000000010000100101110010000011101100110101010000001011100100110011110110001011011011010111101111110,KEBZMXQPDSKKQT-UHFFFAOYSA-N
C[N]1N=C(N=C1NC2C(C)(C2)C3=C(C=CC=C3)F)C4CCOCC4,6DEFDDC41302F71E_B327FD224780CD68_6041_UN,7.8819947,00000000000000000000001001000000000000100010000000001000010000100110000000010101100100110010011010100000101101011001101011101100110011110110001011011111010011101111110,HIAGANZKSXKZSE-UHFFFAOYSA-N
FC1=C(C=C(C=C1)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F)CC#N,F25B7D98503B91CF_F13A6CF4594FAB79_6041_DP,7.5675435,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,NYCVFITYUNFZKI-IEBWSBKVSA-N
CCNC4CCC1=C(C3=C(N1CC2(C)CCCCCC2)C=CC(=C3)Cl)C4,3C716938703D1894_CDEE45DE9437746B_6034_UN,7.187919,00000000000000000001000000000000000000000000000000000000000000000110000000010000001101010010000010001101110110011011101001100100110001100110001011011101010110101111010,RTHOGZMELXJGBZ-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NCC2N(C)CC3(CC2)CCC3)F,5DBCFE0C1A39FAB0_931B567E367E3F60_7022_UN,7.500043,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001110011010000101000010110011001101001100000110001110110001011011111010110101111010,BFEPNGQFYNJWGL-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)COCC2)[S](C3=CC4=C(C=C3)C=NC=C4)(=O)=O,C4A9B6077AEB233D_B36433BCF80FAF5B_6029_UN,8.436607,00000000000000000000000000000000110000000000000000010001011111001101010001000000011000101000001000101110011001001000011011001100111010001110001011111001010111110111110,WOXPBUPNKHFBDY-UHFFFAOYSA-N
O(C(=O)CC1=CC(=C(C=C1)Cl)Cl)CC3=CC2CCC(N2)C3,BB05C3CFC79997D6_A7F549B7200B0E67_6031_DP,7.6887283,00000000000000000001000000000000000000000000000000100000000000000000000000001000000100010011000010110001110101010000001001010010110010100100000011010011011111110111110,QTMXZBTVJMISDH-UHFFFAOYSA-N
O(C(=O)CC1=CC(=C(C=C1)Br)Br)CC3=CC2CCC(N2)C3,FC96E217B87CC3F5_F0D7AED5508E5815_6031_DP,7.688727,00000000000000000001000000000000000000000000001000100000000000000000000000001000000100010011000010110000110101010000001001010010110010100100000011010011011111110111110,JRPXXAYGONSTAI-UHFFFAOYSA-N
O(C(=O)CC1=CC(=C(C=C1)Cl)F)CC3=CC2CCC(N2)C3,D1E94F2C5A135883_07170D69CCFD5FEF_6031_DP,7.688724,00000000000000000001000000000000000000000010000000100000000000000000000000001000000100010011000010110001110101010000001001010010110010100100000011010011011111110111110,CDJLNTDACXZXRB-UHFFFAOYSA-N
O(C(=O)CC1=CC(=C(C=C1)Br)F)CC3=CC2CCC(N2)C3,7C8512D20826070C_625A156367DC9BEF_6031_DP,7.6887236,00000000000000000001000000000000000000000010001000100000000000000000000000001000000100010011000010110000110101010000001001010010110010100100000011010011011111110111110,BDQNEQKNFHXCJY-UHFFFAOYSA-N
O(C(=O)CC1=CC(=C(C=C1)F)F)CC3=CC2CCC(N2)C3,B2FBD1D8F5D04ADC_2F46D1EF129CD993_6031_DP,7.6887245,00000000000000000001000000000000000000000010000000100000000000000000000000001000000100010011000010110000110101010000001001010010110010100100000011010011011111110111110,ZLKJRUFJGQUBOU-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NCC3CC(CCC3)F)C,9949571B4852A6A3_6814F55F72D4CD40_6041_UN,8.412731,00000000000000000000000000000000000000000010000000000100000000000100000000000000101100010011000010001100010100000000001001000100110101110100001011010111010110101111010,CSILLCFPJHPIIF-UHFFFAOYSA-N
O(C(=O)CC1=CC(=C(C=C1)F)Cl)CC3=CC2CCC(N2)C3,8D93E8EB246C05CA_621BDF1779353AD0_6031_DP,7.688716,00000000000000000001000000000000000000000010000000100000000000000000000000001000000100010011000010110001110101010000001001010010110010100100000011010011011111110111110,OXHPZEPWTSZNID-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NCC2N(C)CC3(CC2)CCC3)Cl,AE9DCA3570A46369_08934CF6C9B8591E_7022_UN,7.5000105,00000000000100000000000000000000000000000000000000000000000000000010000000010001001001110011010000101001010110011001101001100000110001110110001011011111010110101111010,FYXNWYSSKVPNHM-UHFFFAOYSA-N
O(C(=O)CC1=CC(=C(C=C1)F)Br)CC3=CC2CCC(N2)C3,88066FD6335E0FCD_6BA866BBA6E25DFA_6031_DP,7.6887116,00000000000000000001000000000000000000000010001000100000000000000000000000001000000100010011000010110000110101010000001001010010110010100100000011010011011111110111110,SAXDNVNQNFEKKO-UHFFFAOYSA-N
O(C(=O)CC1=CC(=C(C=C1)Br)Cl)CC3=CC2CCC(N2)C3,7C8B85E916F069F7_B672C4C91A3CAE2A_6031_DP,7.6887035,00000000000000000001000000000000000000000000001000100000000000000000000000001000000100010011000010110001110101010000001001010010110010100100000011010011011111110111110,ZWZLUMQRNJNULU-UHFFFAOYSA-N
O(C(=O)CC1=CC(=C(C=C1)I)Br)CC3=CC2CCC(N2)C3,336CEB3377C14867_756512206221164E_6031_DP,7.6886973,00000000000000000001000000010000000000000000001000100000000000000000000000001000000100010011000010110000110101010000001001010010110010100100000011010011011111110111110,MWNNGWDTTJXEKS-UHFFFAOYSA-N
C(CC1OCCCO1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,8DB77CD77143ADB9_A48F15D5CE93E5FC_7019_UN,7.728034,00000000000000000000000000000000000000000010000000000000010000000000000000000000000001010100010010110000000111010000101010110000110011110110000011011010010111111111110,DUQPVEAVNBEWKS-UHFFFAOYSA-N
O(C3CCC4C1CC(C2OC12)C34)CCC5=C([N](N=C5C)C)C,D58052BBB735C436_2FD5A2E134728888_6039_UN,8.664019,00000000000000001001001000000000000000000000000000001000010000000100000000010000100100000000011010100100010011000000101011101011110010000100011111011110110111111111110,POXVTEXBQPYHKE-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)C#N)NCC2(COCCNC2)F)F,9F9B4A4D64FC35E5_6901345D5F690A5E_6041_DP,8.265631,00000000000000000001000000000000000000000110000000000100010000000010000000000000101000110011000101001000100101011000001011000000110111110110001010010011010111100111110,JGOQSVDAXNQSKH-UHFFFAOYSA-N
N(CC1C2CCC(C1)CC2)C(=O)C3=CC(=CC=C3)C=C(F)F,0ABB8A09973219EA_09EAA2B83CC5246C_6038_UN,7.5154095,00000000000000000000010000000000000000000010000000000000000000000000000000001000001000000011100000011000010100100000011000000000110000100000000001010001011110100111110,XDYXVZBKBBPUFP-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3CNCCC3)C[C@H]4[C@@H](CNC4)C5CCOCC5,4C9FC75690F42FC8_94D96119B97BFB0C_6034_UN,8.134922,00000000000000000000000000000000000000100000000000000000010000100100000000010101101101100011000010101100110001010000001011100100110110000110001011011011010111101111110,YTSFLOKPASFDCH-YPJRHXLCSA-N
ClC1=NC2=C(C=C1)N(C(=O)C=C2)CC3(N)CCCC4=C3C=CC=C4,FF01842BB81DC923_9147DFA4AE44BDD5_6034_UN,8.431247,00000000000000000000000000000000000000000000000000000000000000000110000000010001000011010011100000101101110100111100011011100101110001100100001111011011011110100111110,MCEFXVOGKFQHDD-UHFFFAOYSA-N
FC2=C1C=C[N](C1=CC=C2)CC45OC3(CNC3)C(C4)(N)C5,25CF6CBA29940154_665A1E257C4B3A68_6034_DP,8.663673,00000000100100000000000000000000000000000010000000000100010000000110000000010000101111110011000111001100110100011000000011100100110111100110001000001001110111100111110,YUXSXCMEXXHQBA-UHFFFAOYSA-N
FC1=CC(=CC=C1)NCC2=NC=C[N]2C[C@H]3CNCC(O3)(C)C,4AB2E7839D0EB440_B82B726DB8FA06CD_6034_DP,8.225122,00000000000000000000000000000000000000100010000000000000010000000110000000110101101101110011000110101000000110011001000011100100110111110110001011001111110111101111110,NVSMEYUZIWILTR-OAHLLOKOSA-N
ClC1=CC(=CC=C1)NCC2=NC=C[N]2C[C@H]3CNCC(O3)(C)C,C2C7F4F1C5C88C3D_E5F4C59E18EDA4CC_6034_DP,8.2251215,00000000000000000000000000000000000000100000000000000000010000000110000000110101101101110011000110101001000110011001000011100100110111110110001011001111110111101111110,SHYBTKVRGOWILE-OAHLLOKOSA-N
ClC2=C1C=C[N](C1=CC=C2)CC45OC3(CNC3)C(C4)(N)C5,36CCF1BE7EC0BC7A_848D810B35EE9FCE_6034_DP,8.663631,00000000100100000000000000000000000000000000000000000100010000000110000000010000101111110011000111001101110100011000000011100100110111100110001000001001110111100111110,MTHYTECANDJHJI-UHFFFAOYSA-N
C2(=C1OCCCC1=CC(=C2)CC#N)NC3=CC4=C(C=C3)C=C[S]4(=O)=O,14425591EC19D781_F004EA5728F709C7_6041_UN,8.332321,00000000000000000000000000000000000010000100000000010001011111000001000001000000010100001001000110110110010001011100001010001101101011011100001111111001110111110111110,FEBZJWVEZGPHHS-UHFFFAOYSA-N
BrC2=C1C=C[N](C1=CC=C2)CC45OC3(CNC3)C(C4)(N)C5,D263B6C5C9AEBA72_4EDB595ABB263D02_6034_DP,8.663627,00000000100100000000000000000000000000000000001000000100010000000110000000010000101111110011000111001100110100011000000011100100110111100110001000001001110111100111110,XPAGKUGSFGHQOV-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,1DD20CE090673BF3_B4FE6343FB78F6BE_6041_DP,7.8777366,00000000000000000000100000000010000010000010000000000100000000100000000000100000111100111011010010101000100100011000001011000100110101110110011011011111010110101111010,OVHPQAIUGIWTDS-FUHWJXTLSA-N
N3CCC(C)(COCC2CCC1(CCOCC1)O2)CC3,8448B32FC1602F19_02A5E2E536333D19_6039_DP,7.841847,00000000000000000000000000000000000000000000000000000000010000000010000010000000001100100101000010101000110011011001101011000010110010000110000001110001110101111101110,KPJUHQBVSYRLHK-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3(C)CCCNC3)Cl,7FA174A886262A8C_6F78305FFE23C870_6034_UN,7.7449403,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101111011000010101001101110011001101111100100110101110110001011011111010110101111010,MRPJCVBLLMYIMP-UHFFFAOYSA-N
N(CCN1CC2C(C1)C3CCC2C=C3)C(C4=C(C(=CC(=C4)C)Br)F)=O,AF98F3314F47F8F5_D0A6417E0F843FC1_6038_UN,8.199003,00000000000000000000000000000000000000000010001000000000000000000000000000010001001101110001100010011100110100110000011001100000110000100110001011011011011110101111110,BTFJPATYMATUFZ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CCCC(C2)C3=CC=CC=C3)Cl)C4CC4,CFD006D9639A74C3_C6A7D64675D0FC11_7022_UN,7.7772455,00000000000000000000001000000000000000000000000000000000000000100000000000000000000000010011000000000001100110010000001000000100110001110000000011010011000010101111010,VLZCLHXITJIYLC-UHFFFAOYSA-N
C(C1C2CCOCC12)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,42318063C87B1A86_322FFC788AE4B7AE_7019_UN,8.020392,00000000000000000001001000000000000000000010000000000000010000000000000000000000000001110000010010110000010111010000101000100000110011110110000011011010010011101111110,JXJVFVYPWKGYII-UHFFFAOYSA-N
CC1=C(C=CC(=C1)NCC2N(C)CC3(CC2)CC3)C=C,2F71638EC98A9F23_1B532AB1237AC32F_6041_UN,7.9291267,00000000000000000000001000000000001000000000000000000000000000000010000000010001001001100011010000111000010010011001101001100000110001010110001011011111010110101111010,VVFPVXWPZACRKA-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CC(C2)=C3CCC3)Cl)C4CC4,678A8B2B51F44A4E_7A9C8C40C3F84FC0_7022_UN,7.43124,00000000000100000000001000000000000000000000000000100000000000100000000000001000001000010010000000011001000110000000001000000000110001110000000010010011010110101111010,KVQSQEBBTHDYLT-UHFFFAOYSA-N
N1C4CCC1CC(C=CC3=CC2=C([N](C)N=N2)C=C3)C4,4192DE6C744D4BAB_79963F0B3C31A107_7019_DP,8.854557,00000000000000000001000000000000000000000000000000001000000000000100001000010101100100000011011010110100110000010000001011101100111000000100001001011001000010101111010,CEQYJWPJEBRVSK-UHFFFAOYSA-N
C2(=C1CCOCC1=CC=C2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,0A9ABF5464E9DBC9_A392420EBED33E24_6041_UN,8.563115,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011010010101100110111010001101011100100110011110110001011011011010011101111110,ZLMLHFCKFXFQER-UXHICEINSA-N
CCC4CCC1=C(C3=C(N1CC2(C)CCNCC2)C=CC(=C3)C)C4,A9F7792F4C3500A3_53C93BD1EA12DFCE_6034_UN,8.353897,00000000000000000000000000000000000000000000000000000000000000000110000000010000001101100001000010101100110010011011101011100100110000000110011011011101010110101111010,SEAKCAGHHSDPNA-UHFFFAOYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)N[C@H]4[C@H](CCNC4)C5=CC(=CC=C5)F,057865F4AB2E81F8_23215A40DCA44916_6041_DP,7.010653,00000000000000000000000000000000000000100010000000000010000000100100000000000101101100110011000010101000110100010000001011000100110101110110001001010011010010100111010,SGXOPSKSPKYBTK-CGKHISLQSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC3=NC=C2CCCC2=C3,6573EBE235C0FE55_3251358F26CC97F0_7022_UN,7.9540052,00000000000000000000100000000010000000100000000000000000000000000100000000100100000000100001010010100100010000001000001001000100010001010100011011011101000010101111010,MALRXJZVFSGZHM-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(CCC3)C4=CCOCC4,5AC0D5A846878205_413678418EB2A3D7_6041_UN,7.491459,00000000000100000000000000000000000000100000000000100000010000100110000000001100001000100011000000111100010011001000001011000100110011010110011011010111010111101111110,WJIIFIOFKRNLAL-UHFFFAOYSA-N
CC(C)C1=C(C=C(C=C1)NC[C@@]23CCCN[C@H]2CCCC3)F,DF5B05544685AB0D_6E27634E056FAB1F_6041_DP,7.8256664,00000000000000000000000000000000000000000010000000000100000000000010000000100000101000010011000000101100110100011000001001000000110101110110001011010111010110101111010,LKPRYFPOZPUUPU-RBUKOAKNSA-N
CN(C1CNC1)C2=NC(=CN=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,6071DBA3EE56B67B_C55FABB3FFCF53DB_6041_DP,8.206294,00000000100100000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100000101110110001001011111010010101111010,HUYLETVBXDMDNW-APWZRJJASA-N
FC2=CC(=C1CCCC1=C2)NCC3CCC(C)(C)C4=C3C=CC=C4,68A18F6DFB3BC3F9_1E28E6ADE5C86BBF_6041_UN,7.8797398,00000000000000000000000000000000000000000010000000000000000000000010000000100000001000010011000010001100010100001001101000000100110001110000000011010101010110101111010,TWXHSKUBFPEAPB-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)N[C@H]4[C@H](C3=CC=N[N]3C)C4,E19A2DAD2513113C_4AF28FC7F500C381_7022_UN,7.686399,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010010011010000000100110010000000011101100000001110100001010011011000010101111010,VXXJBNSXVJDNRI-IUODEOHRSA-N
CCN4CCC1=C(C(=CC(=C1)NCC3CCN(CC2=CC=CS2)CC3)F)C4,DBE14C0FDC8E7746_A5AB46711F1D5522_6041_UN,7.790177,00000000000000000000000000000000000010000010000000000000000000000000000000010000011101111011000010101100010110010010101011100100110001110110001011011001010110101111010,XHZDDBWXJXTVHU-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)N[C@H]4[C@H](C3=CC=N[N]3C)C4,C82751E6A3CE1689_BE327DCABD43623E_7022_UN,7.686388,00000000000000000000001000000000000000000000000000001000000000100100000000010000100100010010011010000001100110010000000011101100000001110100001010011011000010101111010,LTPDMAFNJWJZSB-IUODEOHRSA-N
S(C1=CC2=C(C=C1)OCC2)C(C3=CC=CC4=C3[N](C)C=C4)=O,BF11393EB524368C_6D1EF0BE3109B5E1_6038_UN,8.924712,00000000000000000000000000000000000000000000000000000000010100001100000000010000010101001000010011000100010001000100001011100100000010000100000011011000111011111111110,BZVUBAZYCQMPDN-UHFFFAOYSA-N
N(CC1C2(CCC1)CC2)C(=O)C3=CC=C(C=C3)C4=CC(=C(C(=C4)F)F)F,BBF904F96CF8BF1E_20D34376274EAE5D_6038_UN,7.6975484,00000000000000000000001000000000000000000010000000000000000000100010000000000000001000010011100010001000010100101000011000000100110000100000000011010011011110100111110,ITYDCLSAJIEWTQ-UHFFFAOYSA-N
CN(C)CC(OC1=CC=C(C=C1)CC2CCCCN2)C3=CC(=C(C(=C3)F)F)F,7176B118905CC601_BE2C54BEEF751865_6035_UN,7.867091,00000000000000000000000000000000000000000010000000000000000000000000000000100000001001110011010100101000100100010101001001100111110010100110001111011111110111101111110,DZWCOMZMUKJOPA-UHFFFAOYSA-N
NOCC1=C(C=C(C=C1)F)NCC2(CCOCC2)C3=CC=CS3,B43E20F816321065_0D713192B0A9990F_6041_UN,8.075358,00000000000000000000000010000000000010000010000000000000010000100010010100000000011110111011001011101010100101011000001010001110110111110110001011010011010111110111110,GUXLGIKUWGILNB-UHFFFAOYSA-N
C[N]1N=CC2=C1N=CC=C2NCC34OC(C)(C)C(C3)C4,E58DF66B70329C2A_58FC518D708D1EEA_6041_UN,7.110301,00000000000100000000000000000000000000100000000000001000010000000110000000110101101100000010011110101100010010001000100011101100100011010100011000001101110111101111110,FSWADATUBSSCHF-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCCC3OCCC23)F)CC4,85618BE055AC412F_329CC1115A376FF4_6041_UN,7.4827127,00000000000000000001000000000000000000000010000000000000010000000000000000010001100101110011010011001100110111010001101011100000110011110110001011011011110111101111110,QYXSVTQEAHFESF-UHFFFAOYSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC3=CC2=C(CCNC2)C=C3,14CC671E0CF73BC9_B89B0D825B460EBB_6041_DP,7.582411,00000000000000000000100000000010000000000000000000000000000000000000000000100000001000100011010000101100110000011001001001000100110101010110011011011111010110101111010,JHBJGMFJYYPMLR-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2CCCO[C@H]2C3=CC=N[N]3C)Cl)C4CC4,B942789D3097C54E_BAC0E8755E2B89D8_7022_UN,8.104197,00000000000000000000001000000000000000000000000000001000010000100100000000010000101100010011011111101001000111000000001011101100110011110110001011011111110111101111110,BOJGEWAURGBYOE-MGPUTAFESA-N
FC1=C(C=C(C=C1)NC2=CC=CC(=C2)CN(C)CC3=CC=CC=C3)C4OCCO4,13D2444539174D2D_852D6AF377822A05_6041_UN,8.259447,00000000000000000000000000000000000000000010000000000000010000100000000010000000000101110001010010001000000101000001001010110100000011110110001011011011010111111111110,CVVSLKCFUSXUIG-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C3=C2CSCC3)CC4CC4(C5(C)CC5)C,D54FEC855370B538_8F415D18C9840AC1_6034_UN,8.412834,00000000000000000000001000000000000010000000001000000000000000100110000000010000000101111000000010101100010110011001101011100100110000100110000011011110010110101111010,ADAOLJOVOOBGFN-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NC(C[N]3C=NC4=CC(=C(C=C34)C)C)C5CC5,5A4BF49342DD6D1A_F099FB4DFE4B763F_6041_UN,8.549015,00000000000000000000001000000000000000000010000000000000000000000100000000010101000101010011000010101100110100010000000011100100110001110100001011011111010110101111010,KWBUKZAHQCWOHO-UHFFFAOYSA-N
C1(=C(C=CC(=C1)F)OCC2CCCO2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,11996B0E7AA855A5_B1D3BF1A8CBE26B5_7022_UN,7.90035,00000000000000000000000000000000000000000010000000001000010000100100000010010000101101110001011110101000000111010101101011101111110011110110001111111111110111111111110,OAMSJUJQRMHZDH-FUKGKQRISA-N
C[N]1N=C(C(=C1)C3=C2C=CC=CC2=CC=C3Cl)C4NCCCC4,DB991233A7413A6E_26FA6DE82F69A029_6005_UN,8.430818,00000000000000000000000000000000000000000000000000001000000000100100000000010001101100010011011010101101110100010000001011101100110000100100001011011011010010101111010,VMVUCGFZQZAHQV-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC2(CC2)C3CCCCO3)C=CC(=C4)Cl)C5,2580BD29F14A7AAD_E9F80D07ABC0F331_6034_UN,7.3551574,00000000000000000000001000000000000000000000000000000000010000100110000000010000100101110000010011101101010101011001101011100100110010100110001011011000110111101111110,AAULXPCFDPRERW-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4=C(C=CC(=C4)F)F,C51655B5E0A13615_9A162E9F9CDF7088_6041_DP,8.051287,00000000000000000001000000000000000000100010000000000000000000000100000000000101100101010011010010100000110100010000101011100100110101110100001011011011000010101111010,JGOVFJQPALOCRC-BTTYYORXSA-N
C(C1CC12CC2)=CC3=C[N](C)N=C3C4=CC=C(C=C4)F,DAA7200A1E31A94E_4835B506D06B7BEF_7019_UN,7.5186706,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000000011101100010000100100001010011010000010101111010,BJVAQBTVAROBJF-UHFFFAOYSA-N
CC1=C(C=CC(=C1)NC24CC(OC23CNC3)(C)C4)C=C,37B069390CDCD1C6_E994812C65AB0C96_6041_DP,7.5689864,00000000100100000000000000000000001000000000000000000100010000000010000000000000101100100011000111011000110010011001000011000000110111010110001010000111110011101111110,ZHOIIDWFRUVLMV-UHFFFAOYSA-N
C1(=CC2=C(N=C1)[NH]C=C2C3CCC3)NCC4C[Si](C)(CC4)C,6F900CFFC67340BE_1CFA76E1FCC059DE_6041_UN,7.9116287,00000000000100000000100000000010000000100000000000000000000000100100000000100101001100100011010010101100010010001001101011000100110101010110001000011101010110101111010,NNSDAQDMPUWEEH-UHFFFAOYSA-N
CN3CCO[C@@H](CNC(CC2CC1CCC(N1C)C2)=O)[C@@H]3C4=CC=CC=C4,DA6A04B914E1117B_7C59D2D4C3F71D3B_6038_UN,8.015312,00000000000000000001000000000000000000000000000000000000010000100000000000010000101101100001110110101000110011110001111011100000110010000110001001011111111111111111110,LXINDBRLQVBDKM-GUZCGGBQSA-N
CC1=C(C3=C(N1CC2(CC(F)F)CCC2)C=CC=C3)C4=CCNCC4,425E369B55FC26AA_2A13CC0660D273EE_6034_UN,8.756444,00000000000100000000000000000000000000000010000000100000000000100110000000011000001101100001000010111100110110011000101011100100110000100110001011011011010110101111010,LSZGKUKSXHLCDD-UHFFFAOYSA-N
CN4CCN(CC1=C(C=CC=C1)NCC2(C3(C2)CCOCC3)CF)CC4,E1C3C4FA7E5A382E_6C8A136662AB52F7_7022_UN,6.8614216,00000000000000000000001000000000000000000010000000000000010000000010000000010001101001100011010000101000010001011001101011100000110011110110001011011011010111101111110,AGXQBMBQSGRSLG-UHFFFAOYSA-N
N(CC12CC(C1)CCO2)C(=O)C3(CC3)C4=CC(=C(C=C4)F)Cl,94A3A010102C5283_B421551DEB135875_6038_UN,7.789009,00000000000100000000001000000000000000000010000000000000010000100010000000000000001000010011100100101001010101101000011000000000110010100110000011010011111111110111110,PPUMLKVEWQJZQJ-UHFFFAOYSA-N
N(CC12CC(C1)CCO2)C(=O)C3(CC3)C4=CC(=C(C=C4)Br)Cl,E287D1C65D693ABE_3016A12AD4F84596_6038_UN,7.789003,00000000000100000000001000000000000000000000001000000000010000100010000000000000001000010011100100101001010101101000011000000000110010100110000011010011111111110111110,MMDCIHVARZEETC-UHFFFAOYSA-N
O(CC2COC1(CCCC1)O2)CC3OCCN(C(C)C)C3,A82A0AC3CD0D19B1_045742B782B8022B_6039_UN,7.1714053,00000000000000000000000000000000000000000000000000000000010000000000000010110000000101100100000111101000010011011000101011110010110010000110100000111100110111111101110,MHDXPJBMARSQCT-UHFFFAOYSA-N
CN(C)CC(OCC2CCCC1(CCC1)O2)C3=CC(=C(C(=C3)F)F)F,681E89EC713476A7_B7DE6E5BB8CB722B_6039_UN,8.005518,00000000000100000000000000000000000000000010000000000000010000000010000010100000000001110000010100101000010101001001001000100010110010100110000011011110110101111111110,RPZZIXRDQUIMRD-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NCC[C@@H]2CC[C@H]3C[C@@H]2C3(C)C)C4CC4,4EEACF50453955AA_D9EE48FE1BCCFF93_6041_UN,7.935439,00000000000100000000001000000000000000000010000000000000000000100010000000100000001000010001000000001000110110011000101000000000110001110000000011010111010110101111010,HDQRXHZMLPWVMM-MPGHIAIKSA-N
C[N]1C=CC2=C1C(=CC=C2)NC4=NC3=C(CCCC3(C)C)S4,0F797DD0B47DBE3D_C482C2451AFA88ED_7022_UN,8.018621,00000000000000000000000000000000000010000000000100000000000000000110000000110101010101001001010010000100011010001001101011100100100001010100011011011101000010101111010,LTIVDDQRFOOLOQ-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)F)F)NCC23COC(C)(C2)CCC3,B5724CF5E01F9794_E78013132DA05C72_7022_UN,8.296528,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100010011000011001001010111001001101000000000110011110110000011010011110111101111110,HBXKSYOWBHLVRT-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NCC3CCCN(C)C3C4=CC=CS4,F1679D37476D6338_EDF76A0F951161AB_7022_UN,7.8028073,00000000000000000000001000000000000010000000000000000000000000100000000000010000111101111011010010101001000110010001101011100100110001110110001011011011010110101111010,VKVNCDCHFPYYEA-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)F)F)F)NCC23COC(C)(C2)CCC3,28CAD2BD2D718840_0C903F595048F20F_7022_UN,8.296525,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100010011000011001000010111001001101000000000110011110110000011010011110111101111110,LAKTZJKQFDZVET-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)Cl)F)NCC23COC(C)(C2)CCC3,42C9262B95888930_E1A1724B8E0A2009_7022_UN,8.296525,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100010011000011001001010111001001101000000000110011110110000011010011110111101111110,ZVIKOWPFXMCXQP-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NCC3CCCN(C)C3C4=CC=CS4,9254999575CEC001_19379802DD52C014_7022_UN,7.8028016,00000000000000000000001000000000000010000010000000000000000000100000000000010000111101111011010010101000000110010001101011100100110001110110001011011011010110101111010,NOQJPLWKLMXGLD-UHFFFAOYSA-N
O([C@H]1[C@@H](CNC1)C2=CC=CC=C2)C3=C(C=C(C=C3Cl)F)C#N,935F876F2A326211_CFE11968ED5A02F0_6035_UN,7.63783,00000000000000000000000000000000000000000110000000000000000000100000000000000000001100110001000111001001000100000100000001000111010010100110001111000011110001100111110,XNFXVOYYFHKMLO-GOEBONIOSA-N
O([C@H]1[C@@H](CNC1)C2=CC=CC=C2)C3=C(C=C(C=C3Br)Br)C#N,CE068473C22782D8_4279E046EE13D30C_6035_UN,7.6378274,00000000000000000000000000000000000000000100001000000000000000100000000000000000001100110001000111001000000100000100000001000111010010100110001111000011110001100111110,GNPPBWBRJMJOTH-GOEBONIOSA-N
CC1=C[NH]C2=C1C=CC(=C2)NCC3CCCN(C)C3C4=CC=CS4,5C56E02D2728E95E_66C923C2106E4401_6041_UN,8.246436,00000000000000000000000000000000000010000000000000000100000000100100000000010000111101101011010010101100010010010001101011100100110101010110001001011111010110101111010,ZRRQYPHXZYNKCB-UHFFFAOYSA-N
C1(=CN=C(C=C1)C2CCC2)NC3=C[N](C[Si](C)(C)C)N=C3,370F2D266E55600D_5F4430C5A35FC617_6041_UN,7.4483647,00000000000100000000100000001010000000000000000000001000000000100100000000110001100100100001011010101000000000011001001011101100000001010100011000011101010110101111010,ATXBWEKVUINDBS-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2C[C@@H]4CN(CC3=CC=CC=C3)C[C@H]4C(F)(F)F)C5CCNCC5,9E557CA9B47B90B6_F9A34E405133B7F7_6034_UN,8.394995,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101100001000010101100111100011000001011100100110000100110001001011011010110101111010,RUZOZDRGANQPHM-WIOPSUGQSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NCC4=NC5=C([N]4C)C=CC(=C5)F,7DA20DAD726DC164_3B862F327836E9A9_6041_DP,7.701556,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101010011010010101100110100010000101011100100010101110100001011011011010110101111010,XZQBXKOIMSHVFI-SRBZOADZSA-N
CCC1=C(C(=CC=C1)F)NCC2(CCSC2)N3CCOCC3,230C3143461230C6_79430347DDC09CA1_6041_UN,7.7583485,00000000000000000000000000000000000010000010000000000000010000100010000000010001001101111011000110101000000101011010001011100000110011110110001011011011010111101111110,VLEDZBCNVNIUCF-UHFFFAOYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC4=C(C)[N](N=C4)C5=C(C=CC=C5)F,21D94009B7ADACF2_F54488D27847C1A6_6041_DP,7.762368,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011001010100000110100010000001011101100010101110100001011011011000010101111010,MMFPEESXGMDKCP-KSMMKXTCSA-N
FC1=C(C(=CC=C1)NC[C@@H]2CNCC(O2)(C)C)CC#N,6D6AEAF26EA0AE9F_8777416895253C62_6041_DP,7.608096,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110011001000011000000100111110110001011000111110111101111110,IPVXTSOUNNHMBL-NSHDSACASA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3(OCC)CNC3)Cl,115BDEE5CC7EFA96_7F87AE7429D0BD43_6034_UN,8.342763,00000000100100000000000000000000000010000000000100000000000000000110000000010110111101111011000110001001001111001010000111100111110111110110001110001111110111101111110,VTAHBKFGTBYASL-UHFFFAOYSA-N
N(CCN1CC2CCC1C2)C(C3=CC(=C(C)C=C3F)F)=O,DBE385118142BA4F_793430FF439DC996_6038_UN,7.7571397,00000000000000000000000000000000000000000010000000000000000000000000000000010001001101110001100010101000110100110000011001100000110000100110001011011011011110101111110,PMZBYQZHTNUUBA-UHFFFAOYSA-N
CC1=CC=C(C=C1)C2=CN(C(=N2)C3NCCCC3)CC4CC4(C)C5=NC=C(C=C5)F,347B7EFA61D6B018_7D7BE369FBE300FF_6034_UN,8.18622,00000000000000000000001000000000000000100010000000000000000000100110000000010101001101010011000010101000100110011001101011100100110000100110001011011111010110101111010,ZNPFCVFEUALKLP-UHFFFAOYSA-N
O(CC2CCOC1(CCC1)C2)C[C@H]3CNCC(O3)(C)C,522BD212C06CA9DF_CD5D6C8EE6518AE2_6039_DP,7.249902,00000000000100000000000000000000000000000000000000000000010000000010000010100000001000100010000101101000010011001001001011000010110010000110000001110101110101111101110,ZDIUSKOQZKZWNV-ARLHGKGLSA-N
C1(=CC2=C(C=C1)[NH]C3=C2CCCCCC3)NC4=C(C=CC(=C4)CN(C)C)C,4769E3C564FE2C08_9BD8547EB856A3CC_6041_UN,7.209403,00000000000000000000000000000000000000000000000000000000000000000100000000100000000101100011010010001100110000010001001001100100110101010100011011011111010110101111010,ZXAGMKBVMZDTFP-UHFFFAOYSA-N
NCC1=CC2=C(C=C1)C(=O)C=CN2CC4=CC3=C(CNC3)C=C4,6F9E5A306287C1E0_242DB3B8DBFEFDD3_6034_DP,8.781351,00000000000000000000000000000000000000000000000000000000000000000100000000010000001111100001000011101100010000000100000011100101110100000110001111001001111110100111110,GAIBLOBAIVNWDQ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NCC2N(C)CC3(CC2)CC3)C4OCCO4,62E3555B4E57BF6E_D32C14054434059B_6041_UN,6.989737,00000000000000000000001000000000000000000010000000000000010000100010000010010001001101110011010010101000010111011001101011110000110011110110001011011011010111111111110,SNMGYQYKOYFXHX-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC3C(C)(OCC3)C,C9FDE4E320244CEC_F03619EC036298B8_6041_UN,7.8697395,00000000000000000000000000000000000000000010000000000000010000000110000000100000101100010011000011101100010111001000101011000100110011110110011011010111110111101111110,PCPBAEOPBLOHIM-UHFFFAOYSA-N
N1CC4(C1)OC5(COC3=C2C=CC=CC2=CC=C3F)CC4(N)C5,0991C000B2BD1DF8_684AC67EED92ACD4_6035_DP,7.978506,00000000100100000000000000000000000000000010000000000100010000000010000010000000101110110011000111001100110101011100000011000111110111100110001111000011110111110111110,PUEBAISEZDBASH-UHFFFAOYSA-N
N1CC4(C1)OC5(COC3=C2C=CC=CC2=CC=C3Br)CC4(N)C5,E412763ECE2AD154_4220CD7156F8C0EB_6035_DP,7.978505,00000000100100000000000000000000000000000000001000000100010000000010000010000000101110110011000111001100110101011100000011000111110111100110001111000011110111110111110,MZMYHBNWAZLUSG-UHFFFAOYSA-N
N1CC4(C1)OC5(COC3=C2C=CC=CC2=CC=C3Cl)CC4(N)C5,7EDDB14865FD56AD_516893D88E2F3078_6035_DP,7.978484,00000000100100000000000000000000000000000000000000000100010000000010000010000000101110110011000111001101110101011100000011000111110111100110001111000011110111110111110,JYUGQBIRFJYDRH-UHFFFAOYSA-N
CC34CCC(C=CC1=C[N](C)N=C1C2=C(C=CC(=C2)F)F)(CC3)CO4,256DA222FB123DFE_ED85740BC34F007A_7019_UN,7.5725636,00000000000000000000000000000000000000000010000000001000010000100110000000010000100100010000011010110000010101001001101011101100110010100100001011011110110011101111110,JYROOYROIBQCEO-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(=O)C3=CN=C(S3)C4=CC(=C(C=C4)F)F,17468798DB144795_9FBFB0150396D56B_6038_UN,7.7300997,00000000000000000001000000000000000010000010000100000000010000100100000000000000111100011010100011101000010100100000011011000100110010100100001011010011111111110111110,ZXCHELGXGJUMGL-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NC(C[N]3C=NC4=CC(=C(C=C34)C)C)C5CC5,956E9B88E5061230_8904A343AA676027_7022_UN,8.474964,00000000000000000000001000000000000000000000000000000000000000100100000000010101000101010011000010001101110100010000001011100100110001110100001011011111010110101111010,PIZRMARQDCIAHX-UHFFFAOYSA-N
CC1=C(C5=C(N1C[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)C=CC=C5)Br,527458A6A0B4B9C7_B8ECC3465C70CB94_6034_UN,8.251054,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000101011100100110001100110001011011110010110101111010,IOPLZTHCZLCVEZ-ZHRRBRCNSA-N
O(C3CCN(CC1=CC=CC=C1)C2(CC2)C3)C[C@H]4CNCC(O4)(C)C,E822F6FD055847F1_D29FDCCCE4D98D4F_6039_DP,8.010752,00000000000000000000001000000000000000000000000000000000010000000010000010110000001001100010000101101000010011011001001011100011110010000110001101011101110111111111110,OSGPDQACMWITBS-MUMRKEEXSA-N
C(CC1NCCCC1)=CC4=CC2=C([N](N=C2C)C3=CC=CC=C3)N=C4Cl,546CB4CD14A7622B_56655622A7112E69_7019_UN,7.78893,00000000000000000000000000000000000000100000000000001000000000100100000000010101101100010011001010111101110100010000001011101100110001110100001011011011010110101111010,GZRHHPQBNGVHIH-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NC(C[N]3C=NC4=CC(=C(C=C34)C)C)C5CC5,67C6037B4047F61F_7DC4514EE224C198_7022_UN,8.474945,00000000000000000000001000000000000000000010000000000000000000100100000000010101000101010011000010001100110100010000001011100100110001110100001011011111010110101111010,DOZVNPOIRBHNCN-UHFFFAOYSA-N
N(CC12CCC(CC1)O2)C(=O)C3CCCN3CC4=CC=C(C=C4)F,80D24A6E5718977F_2012E08706741E5C_6038_UN,8.013642,00000000000000000000000000000000000000000010000000000000010000000010000000010001001101110011100110001000010100111000011011100000110010100110001001011011111111110111110,IRZZNTKBDOKLBN-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)NC2C(C)(C2)C3=C(C=CC(=C3)F)F)C4[C@@H]5CNC[C@H]45,308E5F03F71E1EF9_4A84D089BE28F78C_6041_DP,8.174124,00000000000000000000001000000000000000100010000000001000000000100110000000000101101101110011011010101000110110011001100011101100110101110110001011001111010110101111010,LUXNBYBPUQENHF-QYCBYKEFSA-N
CC2=C1N=CC=CC1=C(C=C2)NCC3(C(C)(C3)C)C4=C(C=C(C=C4)F)F,8D5F3E40999056B5_8535C01941D2D1AE_6041_UN,8.431534,00000000000000000000001000000000000000000010000000000000000000100110000000100000101000010011000000101100010110001001100001000100010001110100011011000111010110101111010,FTAIKFPWXSGTNU-UHFFFAOYSA-N
CC1=NC(=NC(=C1)NC[C@H]2[C@@H](OCC2)C3=CC=C(C=C3)F)C4CCC4,DC5C25389690C45A_B2B7D6ACC63D5CBF_6041_UN,8.066936,00000000000100000000000000000000000000100010000000000000010000100100000000000100101100010011000011101000000101000000001011000100110011110110001001010011110111101111110,FAKPQEFZQQCDMR-LPHOPBHVSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)NC4=CC=C(CC[Si](C)(C)C)C=C4)F,549EFDBC791B964B_7FCEC8A1309849C5_6041_UN,7.448797,00000000000000000000100000000010000000000010000000000000000000000100000000100000100000110011010000100100010100011001101001000100110001110100011011011111010110101111010,PDDYXRWRYNOUOS-UHFFFAOYSA-N
C2(=C1OC=CC1=CC=C2F)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,70A9ED40C31E6ABF_2E4271790183E11D_7022_UN,8.575749,00000000000000000000000000000000000000000010000000000000010000100000000000010000101101110011010110101101010110010001101011100100110001110110001011011011110110101111110,SZLWUORTJYUTFC-UHFFFAOYSA-N
NCC23CCCC(CN(CC1=CC=CC=C1)C2)C3OC5=C4C=C(C=CC4=CC=C5)F,9550E8500D5578FD_EF793FAAD0328C0E_6035_UN,8.108862,00000000000000000000000000000000000000000010000000000000000000000010000000010000101011110011000001101100010100001100001001100111110000100110001101011011110101100111110,JTNIUZMGLQOMES-UHFFFAOYSA-N
NCC23CCCC(CN(CC1=CC=CC=C1)C2)C3OC5=C4C=C(C=CC4=CC=C5)Cl,6E28B280C5E8F0B5_FAAA0272798F2536_6035_UN,8.108873,00000000000000000000000000000000000000000000000000000000000000000010000000010000101011110011000001101101010100001100001001100111110000100110001101011011110101100111110,UHSZZLBBGMZFRP-UHFFFAOYSA-N
NCC23CCCC(CN(CC1=CC=CC=C1)C2)C3OC5=C4C=C(C=CC4=CC=C5)Br,B139E19C0EC80A55_0FC016A8F85E5825_6035_UN,8.108871,00000000000000000000000000000000000000000000001000000000000000000010000000010000101011110011000001101100010100001100001001100111110000100110001101011011110101100111110,MGGABTOZNACWQJ-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C3CCC2O3)NC[C@@H]4OCCN(C)[C@H]4C5=C[N](N=C5)C,FDA5C85065639AB4_8EA2CD3914841C39_6041_UN,7.178951,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101100001011110101100010011010001101011101100110011010110001011011111110111111111110,SXRZBACPQHCGEH-GUMHCPJTSA-N
FC1=C(C=CC(=C1)N2CCCC2=O)NC5=CC3=C(C4NC3CC4)C=C5,9DE65E6901A0F1BE_5ACF196391AE12B7_6041_DP,7.875144,00000000000000000000000000000000000000000010000000000000000000100000000000010000000101010010100010001100110100110000011011100101010111110100001111011011011010100111110,KICSQWAUOYVDDB-UHFFFAOYSA-N
CCC5CCC1=C(C4=C(N1CC3=CC2=C(C=CC(=C2)F)[NH]3)C=CC(=C4)C)C5,D4747D654146655D_1A95ECFBD5E08AF9_6034_UN,8.481844,00000000000000000000000000000000000000000010000000000000000000000100000000010001000101010000000010001100110110010010101011100100110000100100001011011101010110101111010,VOTDIKYONJRXOU-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(CC3=CC(=C(OC)C=C3)F)=O,E760DBB38B2AB233_7B58F0357D458BBD_6038_UN,7.8531866,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011110000011000110100110100011000000011110010100000000111010011111111111111110,BSLAZVKMQDBSMG-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N(C=C2C3=CCNCC3)CC4(CC)CC4,7BCC1E1AA917AE2F_6AD6DC18BB9470DC_6034_UN,8.358148,00000000000000000000001000000000000000000010000000100000000000100110000000011000001101110001000010111100110100011010101011100100110000100110001001011001010110101111010,JUKUBJFVFQLCGB-UHFFFAOYSA-N
C[N]2N=C1CCCC1=C2NC(C3CCOCC3)C4=CC=C(C=C4)F,41F9F351A8154FE0_70158DCDFF2D908C_6041_UN,7.2077165,00000000000000000000000000000000000000100010000000001000010000000100000000010101100100110011011010100100010111010000001011101100110011110110001011011011010011101111110,PXOHFPWSYSKLRM-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC(N3CCOCC3)C4=CC=C(C=C4)F,8BEF6E1805C4BE91_F23616859B7B195B_6041_UN,7.7508335,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101110001010110101000000111010001101011100100110011110110001011011011010111101111110,ABFUGKYLPORUIA-BGERDNNASA-N
C1(=NC(=CS1)C2CCCCCC2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,50185928726F2CDC_79CE450877CA2305_6041_UN,7.56294,00000000000000000001000000000000000010000010000100000000000000100100000000010101010101111000010010101000001100010001101011100100110001110110001011011011010110101111010,QJOLLASKNMOKCN-UHFFFAOYSA-N
C[N]1N=C(C=C1NC3C2=CC=CC(=C2OCC3)CC)C4CCCC4,B9812D6B7C3A93FD_007812840CCD8B96_6041_UN,7.8832383,00000000000000000000000000000000000000100000000000001000010000100100000000010101100100000010011011100100110001010110001011101100110011010100001011011111110111101111110,YYGLCWOPCVIABA-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCNC3)C4CC4,281AF41F84F6F9AD_763BA31CE0112D72_6041_DP,8.506698,00000000000000000000001000000000000000000010000000001100000000100110000000010000101100110011011010001100110100011000001011101100110101110110001000011001010110101111010,DORWSSDVZNQFDL-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=NC=C1)NC[C@@]23CCCN[C@H]2CCCC3,2D3A163CCEE13A0B_017F005E6865160E_6041_DP,7.6886215,00000000000000000100100000000010000000100000000000000100000000000110000000100100101000100011010000101100110000011000001011000000110101010110011001011101010110101111010,NHXXNNQGNHVCPY-AZUAARDMSA-N
FC1=C(C=C(C=C1)NC2CCCCC2CCC)C3OCCO3,82B58EF0996A7D55_07AEE7A31D032DAE_6041_UN,7.5539494,00000000000000000000000000000000000000000010000000000000010000100000000010000000000100010011000010000000100111010011001010010000110011110110000011010011010111111111110,AJCMCLGXTOJRHJ-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=C1)NCC2CC3(NC2)CCC3,762BCE823096ADF3_A6616807ED4CFF40_6041_DP,7.4560695,00000000000100000000100000000010000000000000000000000100000000000010000000100000101100100011010010001000110000011000001001000000110101010110011010011111010110101111010,FMSSWMMDTLJUGX-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NCC3CC2(CCNCC2)C3,999F7261D289E5AF_B1EECD91CADFC471_7022_DP,7.2503443,00000000000100000000100000000010000000000000000000000000000000000010000000100000001000100011010000101000110000011000001001000000110101010110011001011101010110101111010,OTOFOJNMVDONDY-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CNCC(C)C3)Cl,982B855C4419ABED_F26DC6EC23FED37D_6034_UN,7.875882,00000000000000000000000000000000000010000000000100000000000000000100000000010110111101111011000010101001001110000001000111100100100101110110001011001111010110101111010,WTZIGCWULRAACR-UHFFFAOYSA-N
FC1=C(C=C(C=C1)CC=C)NCC2CCCCN(C)C2,563E41E8ED4DF095_0836E2387F25F704_6041_UN,7.8693023,00000000000000000001000000000000001000000010000000000000000000000000000000010000101001110011010000011000000110010001101001100000110001110110001010011011010110101111010,PTEYHMYRQDKHRC-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CCC2CCC3CC23)C(=CC(=C4)F)F)C5,8397E145D3F7E141_0BDD8AE19DD10798_6034_UN,8.183329,00000000000000000000001000000000000000000010000000000000000000000110000000110000000101010000000010001100010100011001101001100100110000100100000011011100010110101111010,UEFXZYDPUFJCPI-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NC3CCN(CC3C)CC4CCCO4,51FF96A799AA83E2_BC87F3D088C5F6F5_6041_UN,8.069294,00000000000000000000000001000000000000000010000000000000010000000100000000010101100101110010010110101100111111010001101011100100110011110110001011011111110111101111110,RKLGWVGRLGCJHK-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC3CC(C2=CC=N[N]2C)OCC3)C4OCCO4,FEB89F2B08E33C53_F9CBBB2BA04BD892_6041_UN,7.776874,00000000000000000000000000000000000000000010000000001000010000100100000010010000100100010010011111100000100111010000001011111100110011110110001011111011110011111111110,RZIJFXHLSIJEHM-UHFFFAOYSA-N
CCOC2CC(OCC1N(C)CC(C1)(C)C)C23CCOCC3,98D40C39FC2EECEC_DA5938BDC6619171_6039_UN,7.7155995,00000000000100000000000000000000000000000000000000000000010000000010000000110000000101100100010110101000010011011011101011100011110010000110010100111110110111111101110,SQARERMKXDRJMD-UHFFFAOYSA-N
NCC(COCC1OCCC12CCNCC2)C3=CC=C(C=C3)F,FBBD51E45BDFF291_92A495D287A96825_6039_DP,7.9663143,00000000000000000000000000000000000000000010000000000000010000000010000010000000001110110011000011101000110101011000001011000010110110100110001001010001110101110111110,XKLYDAQJLYUVHS-UHFFFAOYSA-N
N(CC12CC(C1)CO2)C(=O)C3(CCC3)C4=C(C(=CC=C4)Cl)F,F2009A2D440A95B7_DC6108BD76FE71AC_6038_UN,7.601862,00000000000100000000000000000000000000000010000000000000010000100010000000000000001100010011100110001001010101101000011000000000110010100110000010010011111111110111110,VRKAYRKCAKFGIK-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)NCC2C(CCN2)C3CC3)C#N,2407D903C3516E9C_4B22C4EEB75C5D45_6041_DP,8.337923,00000000000000000000001000000000000000000110000000000010000000100000000000000001001100010011000010001000100100010000001001000000110101110110001010010011010110101111010,FPEZELBTADUTOB-UHFFFAOYSA-N
FC2=C1N=CC(=CC1=CC=C2)NC3CN(C)C4(C3)CCOCC4,EC287632E51BDCB4_C5A3CCB31F92FCB2_6041_UN,7.943453,00000000000000000000000000000000000000000010000000000000010000000110000000010001100101110001010011101100110111011001101011100100110011110110001001011001010011101111110,QKBFOVOTFSOPEP-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C3(CC2)CCOCC3)F)[N]4C=CC=C4,96381FFDFD4A09F4_971ED1598AABB846_6041_UN,7.7003117,00000000000100000000000000000000000000000010000000000000010000100110000000010000001101110011000010101000010101001000001011100100110011110110001011011011010111101111110,ALLNGLDLLOEAFG-UHFFFAOYSA-N
N([C@@H]1CCO[C@H]1C2=CC(=C(C=C2)F)F)C(=O)[C@H]3CCC=CC3,79C6CB4981FA595B_125FBDF549E495B8_6038_UN,7.8004146,00000000000000000000000000000000000000000010000000000000010000100000000000000000000100010011100111010000100101110000011000000000110011100100000011010011111011110111110,NZKMKTXFRGGLCB-LYRGGWFBSA-N
CCNC5CCC1=C(C4=C(N1CC2(CC2)C3=CC=CS3)C=CC(=C4)Cl)C5,EAE6A121BEE10503_F6A13E1C467847A3_6034_UN,7.7456594,00000000000000000000001000000000000010000000000000000000000000100110000000010000011101011010000010001101110110011010001011100100110001100110001011011001010110101111010,CZHMFTSMJMJEBE-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CCCC3)C4=C(C=C(C=C4)F)F,9141C92504A10876_A4B4F9FFFC0A5F37_6041_UN,7.903906,00000000000000000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,QKXPZSIHNHQKGP-FQEVSTJZSA-N
FC2=C1C=C(N=CC1=CC=C2)NC3CN(C)C4(C3)CCOCC4,C06E5A6F47ECB90A_513B868FF7946F64_6041_UN,7.8654556,00000000000000000000000000000000000000100010000000000000010000000110000000010101100101110001010011101100110111011001101011100100110011110110001001011001010011101111110,VLLOWGBYSFLOLK-UHFFFAOYSA-N
CN1C4CCC1CC(NC(=O)C2(CCCC2)C3=CC(=CC(=C3)F)F)C4,090D9D89297DB61F_F7D7EBEA78745D15_6038_UN,7.758767,00000000000000000001000000000000000000000010000000000000000000100010000000010000100101010011110010100000110110111000111001100000110001100100001001011001001010101111110,OAPKNUSNLBHHEI-UHFFFAOYSA-N
ClC1=CC2=C(C=C1)N(C(=N2)C3CCCCN3)CC[C@H]5[C@H]4C[C@H](C4(C)C)CC5,6552E853ED9E35A1_0FCAFF0EF7D71905_6034_UN,7.8809566,00000000000100000000000000000000000000100000000000000000000000100110000000110101001101010011000010101101110110011000101011100100110000100110001011011111010110101111010,DWJFTUJHLMKRNT-QVUZWJOHSA-N
C1(=NN=C(S1)C2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,2D322BE91AA1CF41_EB8F234981B23680_6041_UN,8.229664,00000000000000000000000000000000000010000010000100001000010000100100000000010101110101111011011010101000101111010001101011101100110011110110001011011011010011101111110,HHYCCEAYPQCCPT-CVEARBPZSA-N
N(C1=CC2=C(C=C1)COCC2)C(C4=CC3=C(C=C[N]3C)C=C4)=O,562AC77E666F59C6_900AE8BBD683EF46_6038_UN,8.556431,00000000000000000000000000000000000000000000000000000000010000000100000000010000000101100001110010100100010001100000011011100100110011010110001011011001011011111111110,ITYRKLUXOWAVCE-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC3CNCC34CC4,358DF47757B2DE79_47CCA0D207993586_6041_DP,7.7126284,00000000000000000000001000000000000000100000000000001110000000100110000000010101101101100011011010001000110000011000000011101100110101010110001010011111010010101111010,YKSBWTMVIJFXDG-UHFFFAOYSA-N
C1(=C(C=CC(=C1)F)OC2CCCCC2)NC[C@@H]3COC[C@H]3N(C)C,9BBA0173B240DA03_C0FDBC4D2CCDC7A3_7022_UN,7.6123037,00000000000000000000000000000000000000000010000000000000010000000000000000100000101101110011010111001000000111010100101000100011110011110110001111011111110111111111110,NUHRCPDYPFRYNC-RDTXWAMCSA-N
C2(=C(C=C1C=CC=CC1=C2)Br)NCC4(C3=C[N](C)N=C3)CCCO4,99A99373B371E658_E523163959067004_7022_UN,7.857752,00000000000000000000000000000000000000000000001000001000010000100110000000010000101100010011011111001100010101001000001011101100110011110110001011011011110111101111110,ZCCDUPFVIHNDFA-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NCC4(C3=C[N](C)N=C3)CCCO4,9161FDD0F42C3B34_B5C35E0FB28D1472_7022_UN,7.8577433,00000000000000000000000000000000000000000000000000001000010000100110000000010000101100010011011111001101010101001000001011101100110011110110001011011011110111101111110,NKESNGCNVVSXAS-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@]34[C@](C)(C3)CNC4)Cl,10902D207F18C681_56B4B078853F69F8_6034_UN,7.954527,00000000000000000000001000000000000010000000000100000000000000000110000000010110111101111011000010101001011110001001100111100100110101110110001011001111010110101111010,YHJHIKVZFYYXSJ-MSOLQXFVSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC(C)[CH]3C[C]4(C3)C[CH2]C4,09EDA1A3CE1D6C67_F5C423D28DB0BDFA_6041_UN,8.153587,00000000000100000000000000000000000000100010000000001000000000100110000000010101100100010010011010100000010100001000101011101100110001110100001010011111000010101111010,ZESFVVRZJUVKES-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC(CC)C3CC4CCC3C4)F,ABB5DC60FCD3599C_EACA417A56558C29_6041_DP,7.276987,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011000010101100110110010010001001000000110101110100001011010011010110101111010,AFKSLLUEGSDPIJ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CCNC34CCC4,84DF658EB3F6F719_D03AB418290E2054_6041_DP,7.4102397,00000000000100000000000000000000000000100000000000000100000000000110000000000100101100000011000010101100110010011000001011000100110101010110011011010111010110101111010,BUNFVKYLFGYREQ-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)N[C@H](C)C3=COC4=C3C=CC=C4F,3843CCC3F9DBE44D_2F5BE86CD7C4E7D3_6041_DP,7.9617195,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101010011010011101100110110010000001011100100110101110100001011011111110010101111110,KBXXOHXPMPVYGD-ZGTOLYCTSA-N
C(N1CCNCC1)C3=CC2=C(C=CC=C2)N3CC4(CCCN(C)C4)C,B792BFE3EC89F127_FF558EDCA6E4E932_6034_UN,8.080159,00000000000000000000000000000000000000000000000000000000000000000110000000010001101101100001010010101100110010011001101011100100110000000110001011011111010110101111010,WWIPNBMTUFMFHD-UHFFFAOYSA-N
C1(=C(C(=CC=C1)Cl)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,1C7126CF41E73A4D_4F6835ECED2AC888_7022_UN,8.481366,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,VNCZMQSVCHOIGE-HOCLYGCPSA-N
C1(=C(C(=CC=C1)Br)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,B30D9F6722BD3BC7_502CB63EA5ED2C72_7022_UN,8.481358,00000000000000000000000000000000000000000010001000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,MRELSXOBKGJAKD-HOCLYGCPSA-N
C1(=C(C(=CC=C1)Cl)Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,0812053A55D5D01A_15904C1C7D6BC58E_7022_UN,8.481348,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,MOPHABBSKSUJOY-HOCLYGCPSA-N
C(CC1OCCO1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,ECD73A7E17E9B462_7652AEEF8747BD28_7019_UN,7.817,00000000000000000000000000000000000000000010000000000000010000000000000010000000000101010000010010010000000111010000101010110000110011110110000010011010010111111111110,DUGQVLHLUINZQM-UHFFFAOYSA-N
C1(=C(C(=CC=C1)Br)Cl)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,5C192DB3C699CBFE_00902AA20C77FAB3_7022_UN,8.4813175,00000000000000000000000000000000000000000000001000001000010000100100000000010000101101110001011110101001000111010001101011101100110011110110001011011111110111101111110,FTROIHQDNXBRDN-HOCLYGCPSA-N
C1(=C(C(=CC=C1)F)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,316B48CBD087710E_8E098082065C182E_7022_UN,8.481322,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,GNVVJXIOGNYHMC-HOCLYGCPSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3CC2(CC(C)OC2)C3)F)CC4,352C39AA8F409CBE_C82BF32965333B2C_6041_UN,7.2249093,00000000000100000001000000000000000000000010000000000000010000000010000000010001100101110001010010001000110111011001101011100000110011110110001010011111110111101111110,SREWHYOKPJBELX-UHFFFAOYSA-N
CNC1=NC(=C(C=C1)Cl)CN(C)CC2=CC(=CS2)C4=C3OCCCC3=CC=C4,679DA0DCB02D940A_DF1D416DD655D598_6004_UN,8.086548,00000000000000000000000000000000000010100000000000000000010000100100000000000101010101111001010010101101010101010101001011100100100011110110001011011111110111101111110,LGFNTLLNURPPSA-UHFFFAOYSA-N
O[C@H](CCl)C1=CC=C(C=C1)NC2CC3CCC2N(C)C3,12FA866E48FFADFF_8402C716D3C8EDAB_6041_UN,8.365412,00000000000000000000000000000000000000000000000000000000000000000000000000010001000001100011010000101001110010010001101001100000110111110111001001011001110111101111110,HFVFNUWJRHPYDC-OJXGMBSESA-N
CC1=C(C2=C(C=C1)C=C[NH]2)NC3CCCCC3CC4CCCC4,162872E1E3435BDF_F3830410461AD41A_6041_UN,7.9030004,00000000000000000000000000000000000000000000000000000010000000000100000000000001000100000011000010000100110000010000001001000100110101010100001011010011000110101111010,NUMFFOFDXVUCTA-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC(CC)C3CCOCC3,ED1D29805BA9EECA_CADA12DD9E86A47D_6041_UN,7.9128747,00000000000000000000000000000000000000000010000000000000010000000100000000000000101000110011000000101100010111000010101011000100110011110110001011010111010111101111110,KXQUGHMYYYLFOE-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C#N)[N]2C=C(C=N2)NC3C4(CCNC3)CCOCC4,DA8C8A24CCCD1A21_F2FA3BDDEBF70FE9_6041_DP,8.011739,00000000000000000000000000000000000000000110000000001010010000100110000000010001101100110011001010101000110101011000001011101100110111110110001011011011010011100111110,DNRRFZPVGRWXFB-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)N[C@H]3[C@H]2CCCCCC[C@H]2C3,E5F3D8554E2B1C41_007D742B0513B889_6041_UN,7.9119487,00000000000100000100100000000010000000000000000000000000000000000100000000100001000000100011010000100100110000011000001001000000110001010100011010011111000010101111010,WWDMVAKQXKJAIG-ABSDTBQOSA-N
CC1=C(C=C(C=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)F,5668B863E3049272_64C9405FF5C24F3A_6041_UN,7.77435,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011111010110101111010,JLTDVFZWGQHQTK-QRWLVFNGSA-N
CC1=C(C=C(C=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)Cl,F6F4DCF1C57B7F84_5AF33EAFB342B0FE_7022_UN,7.7743444,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101001000100010000001011101100110001110110001011011111010110101111010,VPLVCTZRDBDEQV-QRWLVFNGSA-N
N(CC12CCC(CC1)CO2)C(=O)C3=C[NH]C4=C3C=C(C(=C4)Br)Br,FEE42E385A6F05B2_1FDC9AF8A2330EA6_6038_UN,7.7247553,00000000000000000000000000000000000000000000001000000100010000000110000000000000101100010011100111101100010101101000011011000100110110100110001011010011111111110111110,MCHADSRGHSQKQW-UHFFFAOYSA-N
NCC(COC1=C(C=C2C(=C1)CNCC2)F)CC3CC3,2FDE9798207C5B0A_81A8E202CA8AE64C_6035_UN,8.220558,00000000000000000000001000000000000000000010000000000000000000000000000000000000001010110011000001101100110101010100001001000011110100100110001111010011110101100111110,FRGJMARDFXSJTQ-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCOCC3)C4=CC(=CC=C4)F,AF54E0062E386F1B_30433F68D07C5817_6041_UN,7.3821855,00000000000000000000000000000000000000000010000000001000010000100110000000010000101100110011011010101100010101001000001011101100110011110110001001011001010111101111110,DJTLSZOZIALHBP-UHFFFAOYSA-N
O(C1CCCOC12CCOCC2)CCN3CC(OC(C)C3)C,D2C97D2B246A0DB2_984C2FE0B5F05FA8_6039_UN,7.0722256,00000000000000000000000000000000000000000000000000000000010000000010000010010000000001100100000100101000010011011001001011100011110010000110100101111100110101111101110,NYGMOLBIXXUCHC-UHFFFAOYSA-N
O[C@@H](CBr)C1=CC=C(C=C1)C2=CC=C(C=C2)NC[C@@H]3CNC[C@H]3C4=CN=C[N]4C,00B8351061329133_FD889E9FD1B34EFB_6041_DP,8.484065,00000000000000000000000000000000000000000000001000000100000000100100000000010101101101100011010010001000100010000000000011100100110111110111001011001011110111101111110,PIHJEVCLUIWFQU-WPYKKVEZSA-N
CC1=C(C=CC(=C1F)C#N)NC2CC3(OCC2)CCOCC3,948C3834A52D57F5_A8694646CE708B5D_6041_UN,7.467882,00000000000000000000000000000000000000000110000000000000010000000010000000000000000000110111000001100000110101011000001010000000110011110110001011010011110011111111110,KCTSRCSSSJFMBE-UHFFFAOYSA-N
CC1=CC(=C(C=C1)NC([C@@H]2CC(CN2)C34CC(C3)C4)=O)F,8D53F1D879BC7CD4_37B31C0FD0898F3E_6038_DP,7.509972,00000000000100000000000000000000000000000010000000000010000000100010000000000001001100010011100110001000110100111000010001000000010101110100001010000011011010101111110,OWBXMDBPZWRLNF-IQGLFJIHSA-N
CC1=C(C(C4=C(N1CC2(CCNCC2)C3=CC=CC=C3)C(=CC=C4F)F)=O)C,BC3BC855CAD56637_281D262BABAF6D10_6034_DP,8.6739645,00000000000000000000000000000000000000000010000000000000000000100110000000010000001001110001000001101100110110011100101011100101110000100110001111011111111110101111110,IPVGQGKMDQMOTG-UHFFFAOYSA-N
O=[N](=O)C2=C1N=CC=CC1=CC(=C2)NC4=C3OCCCC3=CC(=C4)F,6BF77CA017BFD1E5_890F15A07BE5A006_6041_UN,7.8595304,00000000000000000000000010000000000000000010000001000000110000010100001100000001100000010001001101100110010101000100001111101100101011110100001011111001110011110111110,GMBUXQYYLCTIAO-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C)N=CC=C4,3E81055A194DF810_66BD5F6FD5090A4F_6041_UN,8.125836,00000000000000000000000000000000000000000010000000000000000000100100000000010101101101110011010010101100010110010001101011100100110001110110001011011111010110101111010,RUHAPQGPKQGJFA-MGPUTAFESA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3C(C(C)C)OCCC3,AC1E146A2A334A9A_B973FD84CDC663EA_6041_UN,7.9423757,00000000000000000000000000000000000000100010000000000000010000000100000000100100001000010011000001101100010111000000001011000100110011110110011011010111110111101111110,BJOGHYURFARXBW-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC4CC(C3=CC=N[N]3C)OCC4,ACD274942328BC4C_26CBC20FF08B00D3_6041_UN,8.072019,00000000000000000000000000000000000000000010000000001000010000100100000000010001100100010010011111100100110111010000001011101100110011110100001011011111110011101111110,QQNBFMMYWBBZER-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(=O)CCC(=O)C4=C(C=C(C=C4)F)F,D96B18FBAB1658DD_B0FF2BC308118E1D_6038_UN,7.8749347,00000000000000000001001000000000000000000010000000000000000000000000000000000000001000010011100010001000110100110000011000000000110010101000000011010011111110110111110,DBAPZKDQMAJKGZ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC3(C2=CN=C[N]2C)CC3)C4OCCO4,5D393C94D656D4D1_340D3B58B3A5C9B7_6041_UN,7.828545,00000000000000000000001000000000000000000010000000000000010000100110000010010101100101010010010010000000100111011000001011110100000011110110001010011011010011111111110,SWILVQKESPBREF-UHFFFAOYSA-N
C(C1(CC=C)CCOCC1)=CC2=C[N](C)C3=C2C=CC(=C3)Cl,85229C15F47B9EA4_A69A6661CF673767_7019_UN,8.129,00000000000000000000000000000000001000000000000000000000010000000110000000010000000101110000010010110101010101001000001011100100110010100110000001011000010111101111110,CKMJZDCUTGNKNC-UHFFFAOYSA-N
CC34CC(C=CC1=C(Cl)C=CC=C1N2CCNCC2)(C3)CCO4,A2DD40849BC8AD27_7CF9E55DB4622C84_7019_UN,8.331395,00000000000100000000000000000000000000000000000000000000010000100010000000010001001001110001000000111001110111011001101011100000110011110110001011011011110011101111110,XEVPVSLLDCHZLT-UHFFFAOYSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3(COCC3)F)C4,39947341F03AE060_1471A41DCE518532_6041_UN,7.162674,00000000000000000000000000000000000000000010000000000000010000000110000000010000101101110011010011101100110101011001101011100100110111110110001011011001010111101111110,ZRGLAUBILLEKOL-UHFFFAOYSA-N
CN1CCNCC1C2=NC=CN2CC4(CC3=CC=C(C=C3)F)CC4,3AA9B77081D07906_73B4DF831D480334_6034_UN,7.8679647,00000000000000000000001000000000000000100010000000000000000000100110000000010101101101110001010010101000100100011001101011100100110000100110001011011011010110101111010,ZBZYZLJNSRJWJB-UHFFFAOYSA-N
CN1CCNCC1C2=NC=CN2CC4(CC3=CC=C(C=C3)Cl)CC4,4DEB76B41E51BEA3_80DA03E26CD8F1BF_6034_UN,7.867963,00000000000000000000001000000000000000100000000000000000000000100110000000010101101101110001010010101001100100011001101011100100110000100110001011011011010110101111010,LKPPWPPQZZFFDW-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2C3COCC2CNC3)F)CC4,C8F45681EF790864_227409FADF070009_6041_DP,6.837501,00000000000000000001000000000000000000000010000000000100010000000000000000010001101001110010010001101100010111010001101011100000110101110110001011011011010111101111110,OPVKUYHNWSQCRX-UHFFFAOYSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC5=CC4=C(CCCN(C)C4)C=C5,51A3C170DF2CBDBA_3F15391DBED6A267_6041_UN,7.0904922,00000000000000000001000000000000000000100010000000000000010000100100000000010101000101110001010010101100010111010001101011100100110011110110001011011001010011101111110,PGFFDGTYLFOIJC-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=C2C3CC3)CC(CC)N4CCNCC4,4417E2F08F292159_A3CB3A71DCA08E3B_6034_UN,8.339366,00000000000000000000001000000000000000000000001000000000000000100100000000010001001101110001000010101100110110010010101011100100110000100110001001011001010110101111010,VYLLRYMBWWGFPJ-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC3=NC=C(CC2COCCC2)S3,A79F0D823548257D_93923D93DCC6964B_7022_UN,7.905807,00000000000000000000100000000010000010000000000100000000010000000100000000100100010100101001010010100000001001001000001011000100110011010110011001011101010111101111110,VMWNFOASWIHRMP-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N(C3=C2CNCC3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,2627B7201BF013EC_535F2CFC811D1EDE_6034_UN,8.654787,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101110001010010101100110100010000001011100100110001100110001011011011010110101111010,URULOBHRYHZHMT-GYCJOSAFSA-N
ClC1=CC2=C(C=C1)N(C3=C2CNCC3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,2F59C84712B2672E_4EFF239F9BDDE6F6_6034_UN,8.654785,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101110001010010101101110100010000001011100100110001100110001011011011010110101111010,VOLMTSHIVIPLJU-GYCJOSAFSA-N
BrC1=CC2=C(C=C1)N(C3=C2CNCC3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,3B0F3810DACD0AA4_BDE0762B7D8ECF78_6034_UN,8.654785,00000000000000000000001000000000000000000000001000000000000000100100000000010101101101110001010010101100110100010000001011100100110001100110001011011011010110101111010,SXAYXVHOWQBTLJ-GYCJOSAFSA-N
C(CC2C1CC3CC(C1)CC2C3)=CC4=C[N](C)C5=C4C=CC(=C5)Cl,DA356E1E7144DBE9_E467E5758E666E33_7019_UN,8.011366,00000000000000000000000000000000000000000000000000000000000000000100000000010000000101010000010010010101010100000000000001100100110000100100000001001000000110101111010,CRIGGGCUCAJSNW-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)CCC2)[S](C3=CC=CC4=C3[N](C)C=C4)(=O)=O,9D1B5DF54421DE1C_5F1D29C280A854CC_6028_UN,8.612235,00000000000000000000000000000000110000000000000000010001001111001101010001010000110101001001011011000110011000001000011001101100011001011100001011011001000010111111110,LAMCSLUECTXUDZ-UHFFFAOYSA-N
FC2=CC(=C1OCCC1=C2)NC3=CC=C(C=C3)C4CCCCC4,066B19A35BC9686A_40CECB631856D1A6_6041_UN,8.202106,00000000000000000000000000000000000000000010000000000000010000100000000000000000000100010001000110000100010101000100001000000100110011110100000011010001110011100111110,IPJCDBXWBDDJEE-UHFFFAOYSA-N
C(C1C2CCN(C1)CC2)=CC3=C[N](CC)N=C3C4=CC=CC=C4,E8EF3C3372AFD908_CC56917CC0502DAE_7019_UN,8.568152,00000000000000000000000000000000000000000000000000001000000000100100000000010000100101100000001010111000010000010010001011101100110000000110001011011010010110101111010,QMOHGBNVBWUBCS-UHFFFAOYSA-N
CN(CC1CNC1)C2=NC=C(N=C2)N[C@H]3[C@@H](C3)C4=C(C=C(C=C4)F)F,8FCA26A88D8F1A70_080CBD403E0A7604_6041_DP,8.128575,00000000100100000000001000000000000000100010000000000000000000100100000000000101101001110010010000101000100110010001000011100100100101110110001011001011010110101111010,KBYCFEUPMDPPLZ-GOEBONIOSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC(OC)C3CCCO3,1AB7A6512F4936B9_5B89516ECA373E71_6041_UN,7.9572678,00000000000000000000000000000000000000100000000000000000010000000100000010000100001100000001010111101100010011000000101011000110110011010110011011010111110111111111110,WKSPZDZGBIOERF-UHFFFAOYSA-N
C[N]1N=C(N=C1N[C@H]2[C@@H](C2)C3=CC=C(C=C3)F)C4CCOCC4,F46B9B6C56301460_445032B93C8442BA_6041_UN,7.822036,00000000000000000000001001000000000000100010000000001000010000100100000000010101100100110010011010100000101101010000001011101100110011110110001011011011010011101111110,VRCRSHBOFBQXDA-LSDHHAIUSA-N
C1(=C(C=CC=C1)C(F)F)NCC2N(C)CC3(CC2)CCC3,C538C3E112147E98_45F41EBE38663CE2_7022_UN,7.601691,00000000000100000000000000000000000000000010000000000000000000000010000000010001001001100011010000101000010110011001101001100000110001110110001011011011010110101111010,JQRXXUUMHICVQK-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NC3CCN(C)C4CCCC34,3312EF82C0CCAEC6_44AF8FE8E3F3CF33_6041_UN,8.832883,00000000000000000000000000000000000000000010000000000000000000000100000000010001100001110011010010101100110110010001101011100100110001110100001011011011010010101111010,OHKHPGXXRKCEFK-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)C3=NC2=C(C=CC=C2)N3C[C@H]5[C@H]4CNC[C@H]4C5,FADFE65D2D35CA4B_5DF06E00C8FEE2D8_6034_UN,8.23791,00000000000100000001000000000000000000100010000000000000000000100100000000010101001101110011000010001100010100000000000011100100110000100110001011001011010110101111010,BHWQFIFGULGBLK-VKJFTORMSA-N
CC1=CC2=C(C=C1)C(=CN2CC3=C(ON=C3Br)C4CC4)C5=CCNCC5,DE2277E68822DF2C_3B8A1B6ADCE8396B_6034_UN,8.406663,00000000000000000000001000000000000000000000001000100000010000100100000100011000101101110001001011111110110100010000001011101100110000100110001011011011110110101111110,WMTAGUVZAKZQDS-UHFFFAOYSA-N
BrC2=C1N(C3=C(C1=CC=C2)CSCC3)CC4(C)CCCNC4,5F1C0E9D4DE85461_99C51B6C772E6217_6034_UN,8.329784,00000000000000000000000000000000000010000000001000000000000000000110000000010000101101111011000010101100110110011001101011100100110000100110001011011001010110101111010,NJMVWNBEBULUNR-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2C[C@H]3C[C@H](F)CN3CC4=CC=CC=C4)C5CCNCC5,537BF52E3B090685_3B0FF670DEC6C933_6034_UN,8.47088,00000000000000000000000000000000000000000010000000000000000000100100000000010001001101110001000010101100110100010000001011100100110000100110001001011011010110101111010,UCLOVURSLXDVRH-XZOQPEGZSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)N[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)F)F,100CEDC08F82654C_BF0A16551DCA034C_6041_DP,8.604568,00000000000000000000001000000000000000100010000000000000010000100100000000000101101101110011010111101000110111010000001011100100110111110110001011011011110011101111110,RHNOPSDZWYPDKS-SNMOEOPISA-N
C1CNCC(C1)C2=NC(=CN2CC3(CC)COC(CI)C3)C4=CC=CC=C4,5BC93897A6220714_AA59AC629F46069A_6034_UN,8.014212,00000000000000000000000000010000000000100000000000000000010000100110000000010101101101100011000011101000100001011010101011100100110010100110001011011011110111101111110,XCJJWKNBDRWMFB-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC3C[C@H]2CCC[C@H](N2C)C3)C4CC4,351B0AD0C8C2AE98_7FC8039CBF52AB02_6041_UN,7.601054,00000000000000000000001000000000000000000010000000000000000000100000000000010000100001010001010000100100110110010000101001100000110001110100001011011011000010101111010,DJJDVJZUBZFUNC-GOOCMWNKSA-N
CC1=C(C=C(C(=C1)F)NC2CN(C)C3(C2)CCOCC3)F,8F7E6735D8BCBC14_A947CDB3B767DE36_6041_UN,7.3782263,00000000000000000000000000000000000000000010000000000000010000000010000000010001100101110001010011101000110111011001101011100000110011110110001011011111010011101111110,IUWPPKLBRAALIK-UHFFFAOYSA-N
CN5CCCN(CC1=C(C=C(C=C1)NC3C2CCOC2C34CCC4)F)CC5,92CE76856C6F193F_3759931A777398A3_6041_UN,7.136605,00000000000100000001000000000000000000000010000000000000010000000010000000010001100101110011010011001000010111011001101011100000110011110110001010011011110111101111110,VXVRTDMWNJYGRW-UHFFFAOYSA-N
CC1=C(N=C(N=C1)NC[C@@H]2CNCC(O2)(C)C)C3=C(C=CC=C3)F,F9AA35C15FC47A22_560D0E960DD2013A_6041_DP,7.8955398,00000000000000000000000001000000000000000010000000000100010000100110000000100100101000110010000100101000001110001001000011000100100111110110011011000111110111101111110,ISPYCVOQDMGTTB-ZDUSSCGKSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2OCCC2(C)C)F)CC3,8077BC64CF6CA1E7_F0289D6F13DE15BD_6041_UN,7.6218824,00000000000000000001000000000000000000000010000000000000010000000010000000110001101101110001010110001000000111011001101011100000110011110110011010011111110111101111110,ZBFJQNWWRCVCDE-UHFFFAOYSA-N
CN5CC(C1=NN=C(C)N1CC2CCN(CC2)C3=C(C=CC=C3)F)C4(CNC4)C5,2F25885C1C761F25_122DB273C2E71E46_6034_UN,7.57499,00000000100100000000000000000000000000100010000000001000000000100110000000010101101101110011011010101000010110011001101011101100110001110110001011011111010110101111010,FUZUSAUJLHALOS-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,C01CE94F1584F8E1_27C3C17D377875D0_6041_DP,8.490457,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101110011010010101000110110010001101011100100110101110110001011011111010010101111010,QMHUDJBUXCBJIE-JIQXVJSQSA-N
N1CCCC2=C1C=C(C(=C2)NC(C[N]3C=NC4=CC(=C(C=C34)C)C)C5CC5)F,8DF555F6E6C58A1F_D69169D0EDCB78A9_6041_DP,8.362818,00000000000000000000001000000000000000000010000000000000000000000100000000010101001101010011000010101100110100010000001011100100110101110110001011011111010110101111010,FYAGXOUBZOOUEN-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2(CCOCC2)C#N)N[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,15633FADC5EF3392_D9FF505D33647104_6041_UN,7.670859,00000000000000000000000000000000000000000110000000000000010000100010000000000000000100110011000111100000100101011000001010000100110011110110001011010011110011110111110,LIZGNVOAKYBAIH-RTWAWAEBSA-N
CSCC1=C(C=CC=C1)NCC3(C2CCNCC2)CCOCC3,DD2F065239FFBEF4_3E79903E57F0053F_6041_DP,8.089345,00000000000000000000000000000000000000000000000000000000010000100010000000000000001000101011010000101000100001011001001011000000110111010110001011010011010111101111110,FXTKNYLTLJZZJK-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NC2=CC(=CC=C2)C3=NC=C4CCCC[N]34,746B004A58E3FE47_E02C0336E72AC460_6041_UN,8.039894,00000000000000000000100000000010000010100000000000000000000000100100000000100101010101101000010010101100010000011000001011100100110001010100011011011111010010101111010,OOCMVAQNGFGQRZ-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NC[C@@H]3CCO[C@H]3C=C)C,4C6C32BB7E75C4FD_E551DE3F227E9EA2_6041_UN,8.110153,00000000000000000000000000000000001000000010000000000000010000000100000000000000101100010011000011111100010111000000001011000100110011110110001011010111110111101111110,ADLOPLFRBLNSRD-GUYCJALGSA-N
O[C@H](CBr)C1=CC=C(C=C1)C2=CC=C(C=C2)NCC34CC(C)(CO3)CCC4,27FF42911F1FDCE6_68D21112B2C0E41D_6041_UN,7.7276726,00000000000000000001000000000000000000000000001000000000010000100010000000000000001100000011000110001000110011001001101000000100110111110111000001010001110111111111110,PMBFRETWNHRBIK-DDRJZQQSSA-N
CC1=C(C4=C(N1C[C]2(CN)C[C]3(C2)C[C](C3)(F)F)C=CC=C4)C5=CCNCC5,DDF713F615A86336_FB41ED07372B2214_6034_UN,7.908721,00000000000100000000000000000000000000000010000000100000000000100110000000011000101111110011000010111100110110011000101011100100110100100110001011011011010110101111010,ZFCNODVELVQWRB-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NCC3CCCC(O3)C4CC4,122A15CA1756DC66_2D2C978B84A92564_6041_UN,7.878834,00000000000000000000001000000000000000000010000000000000010000100100000000100000101000010011000100101100010100000000001011000100110011110100011011010111110111101111110,LLCXFMYJMPKQHW-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)F)N[C@H]2[C@@H](OCC2)C3=C[N](N=C3)CC4CC4)F,C42445EA85C91C67_67D7B97C64579630_7022_UN,8.568268,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011001111001000100101010000001011101100010011110110001010011011110111101111110,FPYPYNJFFPKSPA-QAPCUYQASA-N
CC1=C(C=C(C(=C1)NCC2CC3=C(CN2)C=CC=C3)Cl)C4CC4,26CC236F4BC5EA0C_2D90C6DBA7B108EC_7022_DP,7.940715,00000000000000000000001000000000000000000000000000000010000000100000000000000001001000010011000000101101110110010000000001000100010101110110001011010011010110101111010,GRKIHWYXBPCFGU-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C)[N+]#[C-],9FC9F608FAF9111B_4D992C9C1C527DA2_6041_DP,7.3877854,00000000000000000000000000000000000000000110000001000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010111010110101111010,NOHBLURQEUMSSY-FXAWDEMLSA-N
O([C@@H]([C@H]1NCCC1)C2=CC=CC=C2)C3=CC(=C(C=C3)C#N)Cl,B2DF2020C855944A_A0F2FAB507C8D2FC_6035_UN,7.5733714,00000000000000000000000000000000000000000100000000000000000000000000000000000000001100010011000110001001100100010100001001000111010000100100001111010011110011100111110,YREBRPZDARXWAX-ZWKOTPCHSA-N
FC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]5[C@H]4CNC[C@H]4OC5,5BC2A51763AD5E9C_367187C8CB21913C_6034_UN,8.694657,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101110011000111001100110101010000001011100100110110100110001010011011110111100111110,AIEIUGDAESVLAI-HTGGYDROSA-N
O([C@@H]([C@H]1NCCC1)C2=CC=CC=C2)C3=CC(=C(C=C3)C#N)F,0B26FC961C4CB77E_46E6F8EB1A849964_6035_UN,7.573349,00000000000000000000000000000000000000000110000000000000000000000000000000000000001100010011000110001000100100010100001001000111010000100100001111010011110011100111110,ITXJSHGIBRATEE-ZWKOTPCHSA-N
CCN(C)CC1=NC=CC(=C1)NC3(CC2=C(C=CC=C2F)F)CCCCC3,580AD6D733B6C119_1005620872D5FD13_6041_UN,7.835148,00000000000000000000000000000000000000000010000000000000000000000110000000000001100001110011010000101000100100011011101001100100110001110110001011011111010110101111010,MARCFKAYWXANRJ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(C)CC=CCC3,F9A56B1C0B36CE80_E51D37999599FADB_6041_UN,8.019854,00000000000000000000000000000000000000100000000000000000000000000110000000000100001000000011000000111100010010001001101001000100110001010100011011010111010110101111010,BTSTZJWXEAOOHV-UHFFFAOYSA-N
CC2=C(C=C1N=C(C(=CC1=C2)C)NCC(C3CCNCC3)F)C,6F7C919C9CA7E072_C24E946B0EBB0B77_6041_DP,8.262046,00000000000000000000000000000000000000100010000000000000000000000100000000000100001000100001000000101100110110010000001011000100110101110110011011010111010110101111010,UCCGILORYVQLTC-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NCC(N3CCOCC3)C4=CC(=CC=C4)F,2640BF043F0CF3E0_5045C1890F125B7E_6041_UN,7.324009,00000000000000000000001000000000000000000010000000001000010000100100000000010001101101110001011110101000000101010000001011101100110011110110001011011011010111101111110,IQDYICRRSVMXLC-UHFFFAOYSA-N
N(CC12CC(C1)CCO2)C(=O)C3CCCCN3CC4=CC=C(C=C4)F,56F0FA5B5CDB136E_F45337FDC1E18460_6038_UN,7.989024,00000000000100000000000000000000000000000010000000000000010000000010000000010001001001110011100100101000010101111000011011100000110010100110001001011011111111110111110,MQPKKASRCMYPBX-UHFFFAOYSA-N
CN4CCC1=C(C3=C(N1CCOC2CCCCC2CC)C=CC(=C3)Cl)C4,7053139FD5B79246_B27D116534ECB69B_6034_UN,7.8095994,00000000000000000000000000000000000000000000000000000000000000000100000000010000100101110000010110101101010111010011101011100111110010100110001111011110110111101111110,CJSBSIVWQRKPKO-UHFFFAOYSA-N
N(CC12CCC(CC1)CC2)C(=O)C3(CCC3)C4=C(C(=CC=C4)Cl)F,F9BBDEB77A84FDC1_556DF3C5265B1BFF_6038_UN,7.0506516,00000000000100000000000000000000000000000010000000000000000000100010000000000000001000010011100000001001010100101000011000000000110000100000000011010011011110100111110,HFZBHWDBKYGXKV-UHFFFAOYSA-N
C[N]1N=CC(=C1)C4=NC2=C(C3=C(S2)CC(C)CC3)C(=C4C5NCCC5)C6=CC=C(C=C6)Br,7478485F52B03F56_8DEACF48FDCA001C_2201_UN,8.15458,00000000000000000000000000000000000010000000001100001000000000100100000000010000111100011011011010101100110100010001101011101100110000100100001011011111010010101111010,PSBVNKOTZQFPKR-UHFFFAOYSA-N
CN(C1CCCNCC1)C2=NC(=NC=C2)N[C@H]3[C@@H](C3)C4=C(C=CC=C4)F,1BCC90140FDFD3A2_41AF065382740E32_6041_DP,8.020519,00000000000000000001001001000000000000100010000000000000000000100100000000000100101001110011010000101000101110010000101011100100110101110110001011011011010010101111010,VIFLDNVTIXAJSQ-RNYWFIABSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC4(C)CCOC3(CCC3)C4,4DC6D671B8CF808B_C9ABB75830A3D703_7022_UN,8.0890465,00000000000100000000000000000000000000000010000000001000010000000110000000010000101100010011001010101000010111011001101011101100110011110110001011011011110111101111110,YFXJFJPDWZYSQI-UHFFFAOYSA-N
C1(=CSC(=N1)N2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,7F0779CD856337E6_3977237713A03EE8_6041_UN,8.53985,00000000000000000000000000000000000010100010000100000000010000100100000000010101110101111011010110101000101111010001101011100100110011110110001011011011010011101111110,HJVMYJDDPUJGNH-WBVHZDCISA-N
CC3(C)CCCC(C=CC1=C(Cl)C=CC2=C1OC=C2)C3,0BF7716354D1BDBA_E31664E597A0E2FE_7019_UN,8.325359,00000000000000000000000000000000000000000000000000000000010000000010000000100000000100010000000010010101010110001001101000000100110000100100000011010110100000001011110,ZEXMVZUNNZHXTG-UHFFFAOYSA-N
CC1=C(C=C[N](=C1)=O)NC2(CNC2)C3=NC=C(C=C3)F,E3C3D0B07193FCE5_9DC693E529EB330F_6041_DP,8.268193,00000000100101000000000010000000000000000010000001000010000000100110000100010001101000110011001000101010100100011100000011101101000101110110001111001011010010101111110,HTZBFPXNKQVRPL-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)COC2)[S](C4=CC(=C3[NH]C=CC3=C4)CC)(=O)=O,DAB06B9531991C5C_D46BFCDDF39569D8_6029_UN,8.435122,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100101010001010001110011001001010010011001100111100001110001011101001010111111111110,QUJZNFTXBIUKCW-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2CC3(CC2)CCC3)F,B8267F20FFFF5CD8_79B2CF1DE73ECD75_7022_UN,7.468584,00000000000100000000000000000000000000000010000000000000000000000010000000100000000001110011010010001000110100011001001000100000110001110000001010011111010110101111010,ROOQWNPUCXDSBQ-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=CC=C2NCC3CCCC(O3)C4CC4)C,4311EB297195C829_D19CAD5CE3E78154_6041_UN,7.8490286,00000000000000000000001000000000000000000000000000000100010000100100000000000000101100000011000110101100010000000000001011000100110111010100001011010111110111101111110,VJKZAESIIRMOJH-UHFFFAOYSA-N
CC1=CC(=CC(=C1)NC([C@@H]2CC(CN2)C34CC(C3)C4)=O)F,10C665D0BF889141_4D5C56926294DF89_6038_DP,7.57033,00000000000100000000000000000000000000000010000000000010000000100010000000000001001100010011100110001000110100111000010001000000010101110100001000000001011010101111110,KLKCBCFAHYEKDE-IQGLFJIHSA-N
FC1=C(C2=C(C=C1)SC=C2)NCC(OC)C3CCCO3,227F8F07BA6A5F9B_4237281F9F774278_6041_UN,8.151063,00000000000000000000000000000000000010000010000000000000010000000000000010000000011100011001010111001100010111000000101010000110110011110110000010010011110111111111110,BINZULTXMCBDCK-UHFFFAOYSA-N
COC1=C(C=CC(=C1)C(F)(F)F)NCC3C2CCC(CN2)C3,93FCA51472893CF4_7FD523EF0F899094_7022_DP,8.484592,00000000000000000000000000000000000000000010000000000100000000000000000000000000101000000011010100101000111100011100001001000011110101110110001111010011110111101111110,OFPMNLKQFQJPAJ-UHFFFAOYSA-N
FC1=CC2=C(N=C1)C(=CC=N2)NC3=CC=CC(=C3)CC4CCCN(C)C4,378BBD1314987FB8_1B94C5EDBF00205E_6041_UN,7.606704,00000000000000000000000000000000000000000010000000000000000000000100000000010001100001110001010000101100010110010001101011100100110001110110001001011001010110101111010,WJWWBPIBYXMUKW-UHFFFAOYSA-N
CC(C)CC1=CSC2=C1C(=NC(=N2)C)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,55C208A9BCAF3338_11BFD9F116510E6F_6041_DP,8.151232,00000000000000000000000000000000000010100010000100000100000000100100000000100100111100111011000010101100110100010001001011000100110101110110011001010111010110101111010,BJULXMDLAHHCSS-AZUAARDMSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC4(CC3CC3)CCCC4,81F2B0F139AE6652_85861E2AF89C7FA5_6041_UN,8.022512,00000000000000000000001000000000000000000010000000000000000000000110000000000000101000010011000010101100010100001000001001000100110001110100001011010011010110101111010,DWCMPYGLWWXIDY-UHFFFAOYSA-N
FC2=C1C=CC=CC1=C(N=C2)NCC3N(C)CC4(CC3)CCC4,8D2775B74AD19119_1F3B1E4FA602868E_6041_UN,7.6352735,00000000000100000000000000000000000000100010000000000000000000000110000000010101001001110011010000101100010110011001101011100100110001110110001001011011010110101111010,PJKCHRAONYGICS-UHFFFAOYSA-N
CCC5CCC1=C(C4=C(N1CC3CCCN(CC2=C(C=CC(=C2)F)F)C3)C=CC(=C4)C)C5,C8F492637828FA54_EAE5A53D6CCCE825_6034_UN,8.023033,00000000000000000000000000000000000000000010000000000000000000000100000000010000100101110000000010101100010110010010101011100100110000100110001011011110010110101111010,GOVAUIYBIPSUGH-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC34OC(C)(C)C(C3)C4,130070393437FDA8_A781F8D2B35DBD05_6041_UN,7.7213864,00000000000100000000000000000000000000100000000000001000010000100110000000110101101100000010011110001000010010001000100011101100100011010100011010001111110111101111110,ZVHUGJVRQZLYBR-UHFFFAOYSA-N
CC1=C(C=C(C=C1)N2C=CN(C2=O)C[C@H]4N[C@H]3CCO[C@H]3C4)Cl,CEF4716CA28B70E0_E4BB0C9A97EC88F0_6034_UN,8.582617,00000000000000000000000000000000000001000000000000000000010000100100000000010101000101010011000111001101111101110100011011100101110011110110001110011011111111111111110,PIENITVQYFBSAT-RCBQFDQVSA-N
O=C1CCCC2=C1C5=C(N2C[C@H]3[C@@H](CCNC3)C4=CC=C(C=C4)F)C=CC=C5,B8CD0B9F04126A83_20C25A1CBD1A05EE_6034_UN,8.155728,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000011101100110100010000001011100101110010100110001111011011111110100111110,NVDPIIDIJDLWPK-HKUYNNGSSA-N
N4CC1=C(C=C(C=C1)NC(C#N)C2=C(C=CC(=C2)F)F)C3(CC3)C4,444FB78511D2C5CB_C362BA4573F5FE4E_6041_DP,7.5508623,00000000000000000000001000000000000000000110000000000000000000000010000000000001001000110011000000101100010100001000000001000100110101110110001011010011010010100111010,LPVCZJBSTHQFTI-UHFFFAOYSA-N
C(C1CCNCC1)C2=CN(C=N2)CC(CC)NC(C)C3=C(C=CC=C3)Br,695E6B6B2AB49781_843E4B564871DD04_6034_UN,8.159968,00000000000000000000000000000000000000000000001000000000000000000100000000010101001101110001000010101000100110010010101011100100110100100110001011011111010110101111010,CSHIETGRZUKYFU-UHFFFAOYSA-N
N4CCC1=C(C=C(C(N1CC2(CCNCC2)C3=CC=CC=C3)=O)C#N)C4,8615C70E6AA2EEA6_B4BD77B147D725EF_6034_DP,8.371188,00000000000000000000000000000000000000000100000000000000000000100110000000010000101001100001100001101100110000111100011011100101110100000110001111011011011110100111110,SLLDLDRVRVNSLK-UHFFFAOYSA-N
C[N]6C=C(CC3CCC4=C(C1=C(SC2=C1CCC(C)C2)N=C34)C5=CC=C(C=C5)Br)C=N6,F3E7DE0316DC7EB3_211A5B5CBDDAC0F3_2201_UN,8.242622,00000000000000000000000000000000000010000000001100001000000000100100000000010000110100011000011010100100010110000001101011101100110000100100001011011100000110101111010,GTMUEHWYRLXNTM-UHFFFAOYSA-N
FC1=C(C=CC2=C1CCC2)NC(C3=NC=C[N]3C)C4CCOCC4,44CCAE7EFA6006C7_055182C174E04BD3_6041_UN,7.611477,00000000000000000000000000000000000000100010000000000000010000000100000000010101000101110011010010100100010101000000001011100100110011110110001011011011010011101111110,YWTLMCFCPUOVGT-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC3CC4(C3)CCOC4,DE68FA266E6A665A_94218BB0B4A7EE75_6041_UN,7.3009844,00000000000100000000000000000000000000100000000000001000010000100110000000010101101100100010011010001000010011001000001011101100110011010110001010011111010111101111110,SFQAWVUNTFHTIJ-UHFFFAOYSA-N
CSCC1=C(C=CC=C1)NC2CC3(NC2)CCOCC3,DBEDD494107DF07D_C1FEF7D47882710A_6041_DP,8.414991,00000000000000000000000000000000000000000000000000000110010000000010000000000001101100101011010011101000110001011001001011000000110111010110001011010011010111101111110,DWKVIPFVRQAXES-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C3=C(SC)C(=CC=C3)F)=O,0E721596B3D8F825_77F2860E38F1C108_6038_UN,7.914976,00000000000000000000000000000000000000000010000000000000010100001000000000000000011100011001110010001000110100110000011000000000110010100100000011010011111111111111110,RUMCIPGACULWFB-UHFFFAOYSA-N
CCC4CCC1=C(C3=C([N]1CCC2CCNC2)C=CC(=C3)C)C4,5AB196528131EB1C_73019F5A4024BFD0_6034_DP,8.53338,00000000000000000000000000000000000000000000000000000000000000000100000000010000001101100011000010001100110010010010101011100100110000000110001011011101010110101111010,YHFLLLPJLKHBJQ-UHFFFAOYSA-N
CC1=C(N=C(N1CC2(CCCN(C)C2)C)C3CCCN3)C4=CC=CC=C4,022F71AFF58ECDEB_FA607440DF671E12_6034_UN,7.9073896,00000000000000000000000000000000000000100000000000000000000000100110000000010101101101100011010010101000100010011001101011100100110000000110011011011111010110101111010,VBVWAUVALZGGTA-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3(C)CCCS3,BCCC9A6CF50DD8BB_BDA9954FBC21052F_6041_UN,7.8900976,00000000000000000000000000000000000010000010000000000000000000000110000000000001011100011011000010101100010110001001101011000100110001110110001011010111010110101111010,MSHOPEZXDRKPRU-UHFFFAOYSA-N
C2(=C1OC=CC1=CC(=C2)F)NCC3CNCC(C3)(C)C,E6BD4BBC9C800AC0_7CE9905989FDF504_7022_DP,7.635786,00000000000000000000000000000000000000000010000000000100010000000010000000100000101100110010000110101100010110001001000011000100100101110110001001000101110110101111110,OEOQFGROLNEULI-UHFFFAOYSA-N
C(C1(CCC1)C2CCCCO2)=CC3=C[N](C)N=C3C4=C(C=CC(=C4)F)F,D49C7B7F2C21485C_17DEE249AA8B3D0F_7019_UN,8.03223,00000000000100000000000000000000000000000010000000001000010000100110000000010000100100010000011010110000000101001000001011101100110010100100001011011010110011101111110,TVDRUWOZFIYVGQ-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C#N)[N]2C=C(C=N2)N[C@H]3CO[C@H]4CNC[C@@H]34,81BDF8A699B37618_1D03FC3FB70D47E7_6041_DP,7.90221,00000000000000000000000000000000000000000110000000001100010000100100000000010001101100110011001111001100110101010000000011101100110111110110001010001011110011100111110,HHUXTCPCQIIRKT-NOLJZWGESA-N
CC1=CC(=C(N=C1)NCC[C@@H]2CC[C@H]3C[C@@H]2C3(C)C)F,B54B7324766FB1BA_49B7BE8ADFD9E7B5_6041_UN,8.024722,00000000000100000000000000000000000000100010000000000000000000000110000000100100001000010001000000101000110110011000101001000000110001110100011011010111010110101111010,KFBUMPBOJLOPPU-IHRRRGAJSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NCC[C@@H]2CCCN2,6DD8DA4B5EB83A66_84E6E8F445A93A0B_6041_DP,8.140072,00000000000000000100100000000010000000000000000000000100000000000100000000100001101100100011010010101000100000011000001011000000110101010110011000011101010110101111010,VLLVLRCKPUTZFM-HNNXBMFYSA-N
CCN4CCC1=C(C(=CC(=C1)NC2=CC(=CC=C2)C3CCOCC3)F)C4,9B07183B0BB3DCB2_2C8D5708E96E4B55_6041_UN,7.1437097,00000000000000000000000000000000000000000010000000000000010000100000000000010000000001110001000000101100010111010010101011100100110011110110001011011001010111101111110,QXPRRYOWUVHLEB-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2CCCCC2CC=C)F)CC3,07A5D2E718242FAA_6D9F8BC2405222E4_6041_UN,7.975281,00000000000000000001000000000000001000000010000000000000000000000000000000010001100001110011010000011000100110010001101011100000110001110110001011011011010110101111010,DIANDQMXEDBMLE-UHFFFAOYSA-N
NCC3(OC2=C1C=CC(=CC1=CC=N2)Br)CCCNC3,841C77E3798A2639_815C617D0B44FF65_6035_DP,7.8016834,00000000000000000000000000000000000000000000001000000100000000000110000000000000101010110011100100101100110100111100011011000111110110100110001101010001110111100111110,NVNLPVUCMAJZLV-UHFFFAOYSA-N
CN4CC[C@@H](NC(C13CC(OC12CCNCC2)(C)C3)=O)[C@@H]4C5=CC(=C(C=C5)Cl)F,413AE08B277A3E0F_18F881DE3F1A470E_6038_DP,8.015004,00000000000100000000000000000000000000000010000000000000010000100010000000010001101101110111110011101001110110111001111011100000110111100110001011011111111011111111110,JZTLITQPGOVLDW-BDWAOYLISA-N
CN4CC[C@@H](NC(C13CC(OC12CCNCC2)(C)C3)=O)[C@@H]4C5=CC(=C(C=C5)F)F,75859EE78CEB96B5_5B94B3A09D397B23_6038_DP,8.015008,00000000000100000000000000000000000000000010000000000000010000100010000000010001101101110111110011101000110110111001111011100000110111100110001011011111111011111111110,ZGVFFDLONILTES-BDWAOYLISA-N
N(C1=C2C(=CC=C1)CCOC2)[S](C4=CC3=C(C=C[N]3CC)C=C4)(=O)=O,9EDD824F6C5D8BBF_92CC21C3355AC814_6029_UN,8.402227,00000000000000000000000000000000110000000000000000010001011111001101010001010000010101101011001011101110011001001010011011101100111011011110001011111001010111111111110,LVDKETAPZZYGRE-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)N[C@H]3C4=C(OC(C)(C3)C)C=CC(=C4)F,D9E655F0E2285C62_0CD4616521839582_6041_DP,8.139408,00000000000000000000000000000000000000100010000000000000010000100110000000110101101101010011010011101100110110011101001011100100110111110100011011011111110011101111110,MVAMBCUXVWJKRP-OEMAIJDKSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(C4=CC(=NC5=C4C=C(F)C=C5)C)=O,8E32B4C8BBA098D2_1E423084651D4153_6038_UN,7.720131,00000000000000000000000000000000000000000010000000000000010000000100000000000000000100010001100011100100010100100000011011000100000011110100001011010001101011111111110,KRZGAPATDWCSRB-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NCC3(C)CC4CCC3C4,38E1424DB5C0712E_04217251736EC8A8_6041_UN,7.0965385,00000000000000000000000000000000000000000010000000000000000000000010000000000000001000010011000010001100010110001001101000000000110001110000000011010001010110101111010,HCBDDBVLKZIIQR-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C(=O)C3(CCCC3)C4=CC(=CC(=C4)F)F,50C8BDEF57CD1C51_FD4D5DA48EDE600E_6038_UN,7.5043683,00000000000000000001000000000000000000000010000000000000010000100010000000010001001101110011100110101000110100111000011011100000110010100110001001011001111111110111110,ANKPGDFUEIYMID-UHFFFAOYSA-N
C[N]1C=CC(=C1C#N)NC(C2CNC2)C3=CC=C(C=C3)F,F160EEF2CCC8707D_C5A2AB0BA4972C2E_6041_DP,7.3882356,00000000100100000000000000000000000000000110000000000100000000000100000000010001101101110010010010001000000100000000000011100100000101110110001010001011010010101111010,ILNBFPGDFMVIHU-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CC3NCC3(C)C)CC#N)F,45BFCCD022A725F7_AB19F35726B8E3CA_6034_UN,8.25306,00000000100100000000000000000000000000000110000000000000000000000110000000110001001101010011000010001100110100011001100011100100110000100110001010001111010110101111010,PNVXOAQMFPZCAX-UHFFFAOYSA-N
CC1=N[N](C(=C1)NCC2C(C)(C)C3CCC2C3)C4=CC=C(C=C4)F,CEEA938F9BBF065B_A01619AFDDCF9DB8_6041_UN,8.346146,00000000000000000000000000000000000000100010000000001000000000100110000000110101101100010001001010001000010110001000101011101100110001110100011011011111010110101111010,RKDNHUARVJXRTO-UHFFFAOYSA-N
N1CCC4(CC1)CC(OCC2=NC(=C(S2)C(C)(C)C)C)C3=C(C=CC=C3)O4,944A54BD04388015_1094AAEB689C23D6_6039_DP,7.8108034,00000000000000000000000000000000000010000000000100000000010000000110000000100000011100101101000111101100110011011100001011000111110010000110011111010111110111111111110,TVLSYVJMKFEVJB-UHFFFAOYSA-N
CN1CCC(CC1)CC=CC3=CC=C(C2=C(F)C=CC=N2)O3,D2E66E20D59CEA5E_1AC2E4A651C2837C_7019_UN,8.008997,00000000000000000000000000000000000000000010000000000000010000100100000000010000000101110000010110111000000100010001101011100100110000100110001011011010110110101111110,FFSQFFCVQJMVDH-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,C2B2AAC5DDB29AD1_05BCD00D5A58991A_7022_UN,7.6511374,00000000000000000000001000000000000000000110000000000000000000000010000000100000001000010011000000001101010100001001101000000100110001110000001011010111010110101111010,TXJMVOYYZJHNBK-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CCCNC3)C,42CC4AE5A8666D40_22AE54D3ED57B561_6041_DP,7.600668,00000000000000000000000000000000000000100000000000000100000000100110000000010100101101100011010010101000100010011001101011100000110101010110001001011111010110101111010,JFEBIQZFXSOOHG-MYJWUSKBSA-N
FC2=C1CCCC1=CC(=C2)NCC(CC)C3CCOCC3,80A81FEBDD425CBE_F1C94795D1910A7A_6041_UN,7.148194,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110011000010101100010111000010101000000000110011110110000011010001010111101111110,IWBOKOHZCFLNFO-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NCC3CCC2(CCNCC2)CC3,A313A4FB71D406EE_5A80796001A2A0EB_7022_DP,7.2123113,00000000000000000000100000000010000000000000000000000000000000000010000000100000001000100011010000101000110000011000001001000000110101010110011001011101010110101111010,NGDWKPXHDLXWKE-UHFFFAOYSA-N
FC1=C(C=CC=C1)C2=NC(=NC=C2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,B3ACC5D74463A7A7_EABD1CDAC8C27BC0_6041_UN,8.585772,00000000000000000000000001000000000000000010000000001000010000100100000000010100101101110001011110101000001111010001101011101100110011110110001011011111110111101111110,SMHHDIPAPRXLOA-OALUTQOASA-N
CC1=CC2=C(C=C1)N(C(=N2)C3NCCC3)C[C@H]4[C@@H](CNC4)C5CC5,3EC72057C2ED9B10_171249DA8604D067_6034_UN,8.416187,00000000000000000000001000000000000000100000000000000000000000100100000000010101101101100011000010001100110000010000001011100100110100000110001010011011010110101111010,NENMYPJFUWVVIO-PYNWJHIZSA-N
CC5(C)COC4(C[C@@H]3CC(OCC2=C1N=CC=CC1=C(F)C=C2)C[C@@H]3C4)OC5,A72C78E48319DD06_5289800376660BA9_6039_UN,8.409534,00000000000000000000000000000000000000000010000000000000010000000110000000100000000000010100000011100100010101001001000011010111110010100110000101100100110111011111110,NGJZXXBREKWZEW-JWTNVVGKSA-N
FC1=CC3=C(C(=C1)NCC2CCCCN(C)C2)C=CO3,7C3D81F3FC6BFFDB_469F7BABF6091F33_6041_UN,7.653289,00000000000000000001000000000000000000000010000000000000010000000000000000010000101101110011010011001100010110010001101011100100110001110110001000011001110110101111110,MVKYVHXJVWPTRV-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CC2CCCNCC2)C=CC(=C3)C)C4,3D996855AEE7D96D_D9003C40C97EBBB0_6034_UN,8.577978,00000000000000000001000000000000000000000000000000000000000000000100000000010000001101100011000010001100110010010010101011100100110000000110001011011101010110101111010,GFDHOSYTDNYQQJ-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC3(F)CCCOC3)C4=CCNCC4,5B94581C085FCF32_1B8B88ED3EC1CD07_6034_UN,8.393557,00000000000000000000000000000000000000000010000000100000010000100110000000011000001101110001000011111100110101011000001011100100110010100110001001011001010111101111110,PETGUIJYKFLVFY-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC4(N(C)CC3=CC=CC=C3)CCOCC4)F,0CEF98ADAB03B6A0_08052D3B02F5E6FD_6041_DP,7.5715933,00000000000000000000000000000000000000000010000000000000010000000010000000000001001001110011010001101100110111011001101011100100110111110110001011011011010111101111110,RVSYMMSUISJQMK-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)N[C@@H]4CCN(C3CC3)[C@H]4C5=CC(=C(C=C5)F)F)C,F760227F6BE33941_FF45D5CD808CA5BC_6041_UN,9.004047,00000000000000000000001000000000000000000010000000000000000000100100000000010001100101010011000010101100110100010000001011100100110001110100001011011111010010101111010,YPDBXSKPEUPCQR-QPPBQGQZSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NCC3OC2(CCC(C)(CC2)C)CC3,8864B110BD2DC450_00F9B78FC1578AAA_7022_UN,7.7487006,00000000000000000000000000000000000000000110000000000000010000000010000000100000001100010011000110001001010100001001101000000000110011110100001011010111110111101111110,GACDEROURAKRID-UHFFFAOYSA-N
N(CC1C2=C(CC1)C=CC=N2)[S](C4=C3C=CC=NC3=C(C=C4)C#N)(=O)=O,7348A91E96A1A1EE_23F4AA899C7EBDEA_6029_UN,8.673971,00000000000000000000000000000000110000000100000000010001001111001101010001000000111000001011001010101110011000001000011011001100111000001100001011011001010110110111110,HJADSVYONDHAFO-UHFFFAOYSA-N
CC2=C1N=C(C=C(C1=CC=C2)C)NCC3(CC3)CC4CC4,2A5C42F7BEB34A35_7B665739E870608A_6041_UN,8.128298,00000000000000000000001000000000000000100000000000000000000000000110000000000100001000000011000000101100010000001000001001000100110001010100001001010101010110101111010,PJTXYEZWUQXHCZ-UHFFFAOYSA-N
N(CC12CC(C1)CCO2)C(=O)C3CCCN3CC4=CC=C(C=C4)F,4050AB123F6E9C48_8921B5FBFC669A8A_6038_UN,8.082937,00000000000100000000000000000000000000000010000000000000010000000010000000010001001101110011100110101000010101111000011011100000110010100110001001011011111111110111110,QDBAUXFOECJTGR-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)CCC3=CC(=C(C=C3)Cl)Cl,DE040F7F79F2E30A_E923FA97D2DDB74F_6038_UN,7.9950094,00000000000000000000000000000000000000000000000000000000000000000000000000010000101001110011110000101001110110110001111001100000110010100110001011011011011110101111110,QHKDJQNREOIYRB-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)CCC3=CC(=C(C=C3)Cl)F,FFF5A67F495035DB_F87E411E47B7FC14_6038_UN,7.9950113,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001110011110000101001110110110001111001100000110010100110001011011011011110101111110,SROPAWPBCODUPG-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)CCC3=CC(=C(C=C3)Br)Cl,05BD2AFD2C8B8B09_937A6782112EFE07_6038_UN,7.9950066,00000000000000000000000000000000000000000000001000000000000000000000000000010000101001110011110000101001110110110001111001100000110010100110001011011011011110101111110,QZXUWBUUHXTIFU-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC=C2NC(CC)C3CCCCC3,59D7932CB73747E8_764E7D9D12D43D23_6041_UN,8.168031,00000000000000000000000000000000000000000010000000000100000000000100000000000000100100010011000010000100110110010010001001000100110101110100001011010011000110101111010,VTOBGEDXWHQUHV-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)NC(COC)C2CCCOC2)F)S,53C6A2AE200FE0A1_D531BEFF186876F9_6041_UN,7.1523294,00000000000000000000000000000000000000000010000000000000010100001000000000000000010000111011010101100000100101010001001000000010110111110110000011010011010111111111110,YPMIHWQMEWWHOR-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)N[C@H]2CO[C@H]3CNC[C@@H]23)F,20A0CE372D096EA6_0D7D823203B74ED8_7022_DP,7.4877934,00000000000000000000000000000000000000000010000000000100010000000000000000100000101101110011010111001100110101010001000011100000110111110110001010001111110111101111110,WBGKQPNICLCEGW-QEJZJMRPSA-N
N(CCC1=CC(=C(C=C1)F)F)C(C23CCC(C)(C2)CO3)=O,E28CCA25A161027E_00E58B3096DBF03B_6038_UN,7.9569016,00000000000000000000000000000000000000000010000000000000010000000010000010000000001100010011100110101000110111111001111000000000110010100110000011010011111111111111110,XLNDWTCXAUWVKA-UHFFFAOYSA-N
N(CCC1=CC(=C(C=C1)Br)F)C(C23CCC(C)(C2)CO3)=O,9DAA36C7163822B7_F306E3853A3F1E47_6038_UN,7.9568853,00000000000000000000000000000000000000000010001000000000010000000010000010000000001100010011100110101000110111111001111000000000110010100110000011010011111111111111110,GKYOMIPRNRTXEH-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CCC3)C4=CC(=CC=C4)F,005250CE41FBD016_91FFA36EA48A2E3F_6041_UN,7.6660843,00000000000100000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,ZUTFTHNDJQUSTH-IBGZPJMESA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC3C4CCC(CC3)C4,1DBA3C6FAFF87950_734BDB0DF2ECDAA6_6041_UN,7.7833567,00000000000000000001000000000000000000100010000000001000000000100100000000010101100100010011011010100000110100010000001011101100110001110100001011011011000010101111010,BWIMKQYEBLEECA-UHFFFAOYSA-N
N(CCC1=CC(=C(C=C1)Cl)Cl)C(C23CCC(C)(C2)CO3)=O,9ECC5777D8AEE364_6E42DF16093D225A_6038_UN,7.9568863,00000000000000000000000000000000000000000000000000000000010000000010000010000000001100010011100110101001110111111001111000000000110010100110000011010011111111111111110,WGKMMSJZNOZFDM-UHFFFAOYSA-N
N(CCC1=CC(=C(C=C1)F)Br)C(C23CCC(C)(C2)CO3)=O,11F57049A8250121_343791B8D9B5FD45_6038_UN,7.956881,00000000000000000000000000000000000000000010001000000000010000000010000010000000001100010011100110101000110111111001111000000000110010100110000011010011111111111111110,IWTKHZBDBQFLHZ-UHFFFAOYSA-N
C1(=CC2=C(C=C1)OCC2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,48E589ED4AF26E30_EEF06F4BA145334C_7022_UN,8.282878,00000000000000000000000000000000000000000000000000000000010000100000000000010000101101110011010010101101010111010101101011100100110011110110001011011011110111101111110,CTJPAEVKLQLYDS-UHFFFAOYSA-N
CC1=C(C=CC=C1)C(NC(C2=C[N](C)N=C2C3CC4CCC3C4)=O)CF,E881CF7E99C9E03F_D11392939C884CE8_6038_UN,8.068278,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100000000111011000000110010110000011011101100110000100100001011011111011110101111110,LBWWBMSLRUPUEW-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]3CC[C@@H]([C@H]1OCC2N(C)CC(C2)(C)C)C3,D403C6669B8CC017_82A6B0DAD85BF1F3_6039_UN,7.8250666,00000000000000000000000000000000000000000000000000000000000000000010000000110000000101100000010111001000010011011001101001100011110000000110011100011110110111101101110,RTYWGDYMSDZWRY-BFZKSOEOSA-N
CC1=CC2=C(C=C1)C(=CN2CCCC3(C)CC3)C4=CCNCC4,CC03F84B1229B1FA_97821705884EB491_6034_UN,8.117043,00000000000000000000001000000000000000000000000000100000000000100110000000011000001101100001000010111100110010011001101011100100110000000110001001011101010110101111010,PQMOQNQMBDQGAL-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C#N)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F,347980C234A7D225_C77331DB0342A8B7_6041_DP,7.6055694,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010101111010,LRNNPMXVFUKALU-DNVCBOLYSA-N
CC2(C)O[C@@H]1[C@@H](CBr)O[C@H]([C@@H]1O2)N3C=CC(=O)N(C3=O)CCC5CC4CCC(N4)C5,CEC584153AED17CC_016775E099CFDA0F_6034_DP,7.9681797,00000000000000000001000000000000000001000000001000000000010000100100000010110100100101000111100111101100111000111100011011110001110011101110101111111111111111111111110,YFMSHSLWPDZXQT-RHDMZKLYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)N[C@H]3[C@@H](OCC3)C4=CC=NC=C4,836474A28DA23BAA_11296B03BD29C8DC_7022_UN,7.2350264,00000000000000000000001000000000000000000110000000000000010000100110000000000000000100010011000111100000100101011000001011000100000011110100001011010011110011100111110,LKJAEGCAWHKMML-AEFFLSMTSA-N
CC1=C(C=C(C(=C1)NCCN2CCCCC2C)Cl)C3CC3,C60CF6CA436C887A_5D88271F85DA4BF2_7022_UN,8.152474,00000000000000000000001000000000000000000000000000000000000000100000000000010001001001110001000000101001100110010001101001100000110001110110001011011111010110101111010,GSQWPHOAEKUPTK-UHFFFAOYSA-N
O[C@H](CCl)C1=CC(=CC=C1)NCC23CC(C)(CO2)CCC3,F54B6E4070DF1E4E_38D6D458CA8C2D6A_6041_UN,7.960241,00000000000000000001000000000000000000000000000000000000010000000010000000000000001100000011000110001001110011001001101000000000110111110111000001010001110111111111110,OMMGOEJDXZBZFI-KLAILNCOSA-N
O[C@H](CF)C1=CC(=CC=C1)NCC23CC(C)(CO2)CCC3,C932F28E6B7F3344_757808D9FD57863D_6041_UN,7.9602623,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100000011000110001000110011001001101000000000110111110111000001010001110111111111110,JIDRZBCLDYSDIS-KLAILNCOSA-N
CC1=CC(=C(C=C1)C)[C@@H]2CCCC[C@H]2OCC(F)C3CCOCC3,00E398C029C12A27_D33CC911DD94663F_6039_UN,8.015509,00000000000000000000000000000000000000000010000000000000010000100000000000000000000000100000000000100000000111000000001000000011110010100110000111010110110101011011110,FXMZHEPYARBNLJ-MNBHBKLXSA-N
CC1=C(C=NC(=N1)C2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,146EB01C57AD2C93_E8B600091280BB52_6041_UN,8.566666,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101110011010010101000100110010001101011100100000001110100001011011111010010101111010,FOXQULYUJMTKBM-AEFFLSMTSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,83FA786AD738BA17_0D28C5953DF0106A_6041_DP,7.300058,00000000000000000000100000000010000000000010000000000100000000100100000000100001101000110011010000101000100100011000001011000100110101110110011011011111010110101111010,CKGIJTNKXPTRBK-FUHWJXTLSA-N
N(CC12CC(C1)CCO2)C(=O)C3(CCC3)C4=C(C=C(C=C4)F)F,67E4188D0EFAAC0D_3DCF2A11CBC43A55_6038_UN,7.6872826,00000000000100000000000000000000000000000010000000000000010000100010000000000000001000010011100100101000010101101000011000000000110010100110000011010011111111110111110,MNNPHAOLMLZMBM-UHFFFAOYSA-N
C1(=C(C=CC=C1)C(F)F)NC2CCN(C)C23CCCNC3,E6F2A5777FA0BC7A_1EE8AD8FB42F0910_7022_DP,7.640267,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101100011010010101000110110011001101011100000110101110110001011011011010010101111010,QIFKZIHOATXBDZ-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)N[C@@H]4[C@@H]3CC[C@@H](N3)C4,309E261091D3BA19_70BF811A9415D08C_6041_DP,7.9387503,00000000000000000000000000000000000000100010000000001110000000100100000000010101100100010011011010100000110100010000001011101100110101110100001011011011000010101111010,KVEXCOADIHXUPQ-MDZLAQPJSA-N
N4CCC1=C(C=C(S1)NCC3(C2=CC(=C(C)C=C2)C)CCC3)C4,08EFC29A97481C93_BAAE7275225FF2DF_6041_DP,7.4464912,00000000000100000000000000000000000010000000000100000000000000100010000000000000011100101011000010101100110000011000001011000100110101010110001011010111010110101111010,GQERVJPKPJAMNB-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NC2=CC3=C(C=C2)CNCCO3,B2D656E07D6AAF84_6B2B627122BE770E_6041_DP,7.599812,00000000000000000101100000000010000000000000000000000000010000000100000000100001001000100000010101101100110001011100001011000100110111010110011011011101110011101111110,KVHMGUYIGHWACM-UHFFFAOYSA-N
CC1=CC=C(S1)C2=CSC(=N2)NC3CCN(C)C34CCCNC4,11CCF12A52308256_0796D49297329463_6041_DP,8.456807,00000000000000000000000000000000000010000000000100000100000000100110000000010101111101101011010010101000111010011001101011100100110101010110001000011101010010101111010,GTLSIGRGMUWCIQ-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=NC=C3)NC4=CC(=CC=C4)C5=C(C=CC=C5F)F,99D3786DE86F06AD_D305669BC9313381_6041_DP,8.057141,00000000000000000000001001000000000000100010000000000000000000100100000000000100101101110001010010101000011110000000000011100100110101110110001011001011010010101111010,GCGFRIKGTQGTAM-GWTOYCKXSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3(C2CCNCC2)CC3)F)CC4,D9CB534F122767A0_60E241ACD0167957_6041_DP,8.027,00000000000000000001001000000000000000000010000000000000000000100010000000010001101001110011010000101000100110011001101011100000110101110110001011011011010110101111010,ALPRJYXSJKCRJX-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CC34CCC(F)(F)CC4)Cl,4F4E6567E3AA61B1_8D1F3EBA891C9F5D_6034_UN,7.950716,00000000000000000000001000000000000010000010000100000000000000000110000000010110010101011011000010001001011100001000001111100100110001110100001011011011010110101111010,ONPKGQBMKOONRH-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CC(=N2)NCC3CCN(C(CC)C)C3,0EE8797C0C7C853F_912AB2671312644D_6041_UN,8.450161,00000000000000000000000000000000000000100010000000000000000000000100000000010100101101110011000010101100010110010011101011100100110001110110001001011101010110101111010,PEWWGANAIXYFIV-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC2CC3(NCC2)CC3,6AA801E2F74807DF_8509CD7559E23128_6041_DP,7.4940443,00000000000000000000001000000000000000000110000000000000000000000010000000000000001000010011000000101000110110011000001001000000110101110110001011010011010110101111010,QFMCMRUPKPALFP-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)F)Cl)NCC23C(C)(C(CC2)CC3)C,4B7C6C2E6A70581D_3E6BA42C74E3F635_7022_UN,8.344031,00000000000000000000000000000000000000000010000000000000000000000010000000100000001000010011000010001001010110001000101000000000110001110000000011010111010110101111010,BECXXNFXGOBKED-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)F)F)NCC23C(C)(C(CC2)CC3)C,4F3AA5477367AFFF_5ADB1FEFCA90CFC5_7022_UN,8.344027,00000000000000000000000000000000000000000010000000000000000000000010000000100000001000010011000010001000010110001000101000000000110001110000000011010111010110101111010,ISKSMUZQJXRIRN-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)Cl)Cl)Cl)NCC23C(C)(C(CC2)CC3)C,7DEBB4C65DFB41CC_A1EC65E02AF1F1F9_7022_UN,8.344027,00000000000000000000000000000000000000000000000000000000000000000010000000100000001000010011000010001001010110001000101000000000110001110000000011010111010110101111010,WEKUGCXDLVPKRT-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)NCC4=C(C3CNC3)OC=N4,E83861B9A3E6CA9E_3F6905FE2EC42162_7022_DP,7.510305,00000000100100000000001000000000000000000110000000000000010000100110000000000001001100110010000111001000000100111000010011000100100101110110001010010011110110100111110,OLSTZHDBUKDXEW-UHFFFAOYSA-N
FC2=C1C(=C[NH]C1=CC=C2)NCC34COC(C)(CC3)C4,4235BB55625125DA_CB2EFE0B646F61F3_6041_UN,7.273275,00000000000000000000000000000000000000000010000000000110010000000110000000000001101100010011000011101100010111001001101011000100110111110110001001010001110111101111110,KRMXVWSNLGQLAH-UHFFFAOYSA-N
CC2=C1CCCC1=CC(=C2)NC4CCOC(C3=CN=C[N]3C)C4,BAC8D9F06C527A59_8B2693969E865BF5_6041_UN,7.1224585,00000000000000000000000000000000000000000000000000000000010000100100000000010101000101000011010111100100110011010000101011100100110011010100001011011111110011101111110,QSOKDYDTFPSIHQ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CCCC(CCC)C)C3=CCNCC3,6E20031F9742CA14_347ED7A1AF027C74_6034_UN,8.745647,00000000000000000000000000000000000000000010000000100000000000100100000000011000001101110001000010111100110110010011101011100100110000100110001001011101010110101111010,TVZQQEVNRKTFHJ-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC3=CC=CC(=C3)CN4CCN(C)CC4)F,1E39B4B7A84170D6_F4835A44BA85187C_6041_DP,6.982841,00000000000000000000000000000000000000000010000000000000000000000000000000010001001001110011010000101100110100010001101011100100110101110110001011011011010110101111010,ARTQNDOSZAFZRZ-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CC(CCC2)F)F,24AA2EE12D3E8945_5586855FBA554D9D_7022_UN,7.9746475,00000000000000000000000000000000000000000010000000000000000000000000000000100000001001110011010000001000000100000001001000100000110001110010001011011111010110101111010,XOSVSJJUPOAIGM-UHFFFAOYSA-N
C2(=C1OCCCC(C1=CC=C2)=O)NC3=CC=CC4=C3[N](C)C=C4,9CFD8F9303256341_884F6C0A8B098BB9_6041_UN,9.229347,00000000000000000001000000000000000000000000000000000000010000000100000000010001000101000101010110000100010001000100001011100101000011010100001111011001111011111111110,PHVZHXBWMRSJKR-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2C(CCCCC2)(F)F)F,2BFDDFFAA2088D30_5BB967AFEFFA2E20_7022_UN,7.703906,00000000000000000001000000000000000000000010000000000000000000000000000000100000001001110011010000001000000100001001001000100000110001110010001010011111010110101111010,PZNUZQUVAVGIOR-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC3CCCC34CCOCC4,6F85121367AD98B8_4D74601BDE67749E_6041_UN,7.2224245,00000000000000000000000000000000000000100000000000001000010000100110000000010101100101100011011010100000110001011000001011101100110011010110001011011111010011101111110,HWJGXVDLPPGJIM-UHFFFAOYSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NCC3CC2(CCNCC2)C3,16C06DD08814BE7E_6701325248C5A5B9_6041_DP,7.508298,00000000000100000000100000000010000000000000000000000000000000000010000000100000001000100011010000101000110000011001001001000000110101010110011011011111010110101111010,RFNFEGVGUZWZKV-UHFFFAOYSA-N
COC1=C(C=CC(=C1)C(F)(F)F)NC3C2C(OCC24CCC3O4)=O,3AA8D04B4FD90270_7FD7C00351EE2101_7022_UN,8.490653,00000000000000000000000000000000000000000010000000000000010000000010000010000000000100000111010111000100011101001100001010010011110011110100100111110011111011111111110,CTNGHIPDOBOPMV-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCSC(C)C2)F)CC3,F659DACBF102C6EA_EA1F85D4CAE458BB_6041_UN,7.6018934,00000000000000000001000000000000000010000010000000000000000000000000000000010001111001111011010000101000000110010001101011100000110001110110001011011111010110101111010,FFDHQQJHCAFVGH-UHFFFAOYSA-N
NOCC1=C(C=C(C=C1)F)NCC2CNC3(CO2)CCC3,3843D9D4A01ED327_44BD516BCC2206F2_6041_DP,7.662397,00000000000100000000000010000000000000000010000000000100010000000010010100000000101010010011001101101010110101011000001011001010110111110110001011010011110111110111110,YZBAZQRIUWKCLQ-UHFFFAOYSA-N
CC1=N[N](C(=C1)NC[C@H]2[C@@H](C2)C3=C(C=CC=C3F)F)C4CCCCO4,86A08B31A94EF99F_154EDC3C77E6BB0D_7022_UN,8.052406,00000000000000000000001000000000000000100010000000001000010000100100000000010101101100010011101111101000000101110000011011101100110011110110001011011011010111101111110,KBQWMZIBFBPGQK-BWLUYJDISA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=CC3=C(N=C2)C(=C(F)C=C3)F)C4,44565355267C6696_5C073D493DDA9D16_6035_UN,8.18741,00000000000000000000000000000000000000000010000000000000000000000100000000100000000001110000010111101100010100000101001001100111110000100100001111011110110111101111110,LYQGWAJIDOJWLR-MWUJEHJQSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=CC3=C(N=C2)C(=C(Cl)C=C3)Cl)C4,6F325B743DCA7468_2C624ACF2FA9BAFE_6035_UN,8.187407,00000000000000000000000000000000000000000000000000000000000000000100000000100000000001110000010111101101010100000101001001100111110000100100001111011110110111101111110,AHVWLKOSYUFSBQ-MWUJEHJQSA-N
C(C1COCCN1)C2=C[N](C3=C2C=CC=C3)CC4(CCNC4)C,0A83DF11A351A6C9_71936CEE37B456AB_6034_DP,7.7551413,00000000000000000000000000000000000000000000000000000000010000000110000000010000101101100011000110101100110011011001101011100100110110000110001001011001010111101111110,RYHJGXLKMUVFET-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)N[C@H]3[C@@H](C3)C4=CC5=C(C=C4)OCCO5,912F65E5A39FD55A_47BD24A7B701FF7C_6041_UN,8.501186,00000000000000000000001000000000000000000010000000001000010000100100000010010000100100010010011010100100110101010100001011101100000011110110001011011011110011111111110,LVXOAIKGFFAVIB-GOEBONIOSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCCOC2C3=CC=CC=C3)F)CC4,822B33A80C98D567_0E88D83BBB288EBB_6041_UN,7.7423577,00000000000000000001000000000000000000000010000000000000010000100000000000010001101001110011010001101000000111010001101011100100110011110110001011011011110111101111110,TXEITHJHCDTBHI-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F)C,351605387EFAC773_1AC6352B5640C008_6041_UN,7.6771398,00000000000000000000000000000000000000000010000000000100010000100100000000000000101100010011000011001100010101000000001011000100110111110110001011010111110111101111110,ABBMEPCIFOQFJK-KKSFZXQISA-N
N(CCN1CC2CCC(C1)O2)C(=O)C4=C3C=CC(=CC3=CC=C4)F,6570E8C1671A9CA3_566292EE7F30D29C_6038_UN,7.5902734,00000000000000000001000000000000000000000010000000000000010000000000000000010001001101110001100110101100110100110000011011100100110010100110001001011001111111110111110,UAONDBGVLNJRSA-UHFFFAOYSA-N
FC1=CC2=C(C=C1)SC=C2NCC3C(CC)CCCC3,685AA31B613D379F_332497923446A5BC_6041_UN,8.0456915,00000000000000000000000000000000000010000010000000000000000000000000000000000000011100011011000010001100010110000010101000000100110001110100000001010011010110101111010,VPBWWYTTYBYEMR-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC3(CCCC3)C4=C(C=C(C=C4)F)F,B43300F89E82E836_274BBDE64C494775_6041_UN,7.778291,00000000000000000000000001000000000000000010000000000000000000100110000000010101001101010011010010001100011110001000001011100100110001110100001011011011010110101111010,IWWJDMBKDGAWAX-UHFFFAOYSA-N
CCN6CC[C@@H](NC(=O)C1C4C2CC5C3CC(C1C23)C45)[C@@H]6C7=CC(=C(C=C7)Cl)F,A07CE9A8242445DB_29F86E5734EEA2B6_6038_UN,8.48403,00000000000000000001000000000000000000000010000000000000000000100000000000010001100101110011100010001101110110110010111001100000110001100110001011011011011110101111110,MOQBBLQKBAUPCY-DKXVFJASSA-N
FC1=CC2=C(C=C1)C=C(N=C2)NC3CN(C)C4(C3)CCOCC4,B2B0375590A7F8BF_069ED1D88E6B8382_6041_UN,7.9297256,00000000000000000000000000000000000000100010000000000000010000000110000000010101100101110001010011101100110111011001101011100100110011110110001001011001010011101111110,UATFAEHNIZEDAO-UHFFFAOYSA-N
N1CCC5(CC1)CCC2=C(C=CC(=C2)NCC3(CC[Si](C)(CC3)C)C4=CC=CC=C4)O5,7C9D5FA994E48272_2A8D7CBEA108A99F_6041_DP,7.97622,00000000000000000000100000000010000000000000000000000000010000100010000000100000001000100011010001101100110000011101101011000100110111010110001011011101110111101111110,PYULERVIPVIOGQ-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NCC3CCN(CC2=CSC=C2)CC3)F)C4,A8898E7B05FE61E9_E95EA998D8EBC2DD_6041_UN,7.7008915,00000000000000000000000000000000000010000010000000000000000000000000000000010000001101111011000010101100010110010010101011100100110001110110001011011001010110101111010,SJQFJYFFPDBHQV-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NCC2(C)CCC3(CC2)CC3)C4CC4,6C99CEB85B85409B_C5F8526B1CDD7E9A_6041_UN,7.8272634,00000000000000000000001000000000000000000010000000000000000000100010000000000000001000010011000000001000010100001001101000000000110001110000000011010011010110101111010,PFUKXCXAFWXMSD-UHFFFAOYSA-N
CC(NC(=O)CC1CC2CC1C=C2)C3=NC(=C[NH]3)C4=CC(=C(C=C4)Cl)Cl,042C8789BA412975_71ABD97DA9CAB7AD_6038_UN,7.908704,00000000000000000000000000000000000000100000000000000010000000100100000000000101000100010001100010010001110110110000010011000100110110100100001011000011001110101111110,BWEJUXWRWBBPIJ-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3CCOCC3)C=CC(=C4)Br)C5,5373C6EDAE18EAB2_1EF77EEBCDEAB9FF_6034_UN,7.996765,00000000000000000000000000000000000000000000001000000000010000100110000000110000101101110011000010101100010101011001101011100100110010100110001011011111010111101111110,WMVONTMPTNEEEM-UWJYYQICSA-N
BrC1=CC2=C(C=C1)N(C=CC2=O)CC3(N)CCCC4=C3C=CC=C4,2C7B3A14FEAD4BB7_615BEE14F85D0B2A_6034_UN,8.640199,00000000000000000000000000000000000000000000001000000000000000000110000000010001000011010011000001101100110100011100001001100101110001100100001111011001111110100111110,CWGWNRRBDZBERA-UHFFFAOYSA-N
C2(=C1CCC(C1=CC=C2)=O)NC3CCOC4=C3C=C(SC)C=C4,56DE46DA4A122A5B_84CBA4410E7F725B_6041_UN,9.208497,00000000000000000000000000000000000000000000000000000000010100001000000000000000010000001011010011100100110001010100001000000101000011010100000111010001111011111111110,QPKCVXUOJVTZCU-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC3CCC2(CCNCC2)CC3,260216328F86A734_CD3216D085945A1F_6041_DP,7.848895,00000000000000000000000000000000000000000110000000000000000000000010000000000000001000110011000000101000110110011000001001000000110101110110001011010011010110101111010,CAFGMTHXGNBZAH-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2COCCC2)F)CC3,2D973A240FF9261A_C9DF56875F5D2EBC_6041_UN,6.924306,00000000000000000001000000000000000000000010000000000000010000000000000000010001101001110011010001101000000111010001101011100000110011110110001011011011010111101111110,VGSYRMNOUFOABE-UHFFFAOYSA-N
CC1=NC4=C(C(=C1)NCC2N(C)CC3(CC2)CCC3)C=CC(=C4F)F,AAF677257741FE26_430D537E2C5CE93B_6041_UN,7.7235823,00000000000100000000000000000000000000000010000000000000000000000110000000010001101001110011010000101100010110011001101011100100110001110110001011011111010110101111010,AIIRBKHWFYOPLZ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC3CC(C2=CC=N[N]2C)OCC3)C=C,141F43E45EE13E13_067F3B2B5396EA1E_6041_UN,7.9187927,00000000000000000000000000000000001000000010000000001000010000100100000000010000100100010010011111110000100111010000001011101100110011110100001011011011110011101111110,HWDNCTKKGAXYHF-UHFFFAOYSA-N
CN5CCC1=C(C4=C([N]1CC2(CCNCC2)NCC3CC3)C=CC(=C4)Cl)C5,CA5D2B717285BBA9_3CA793CBF5F23F80_6034_DP,7.7248964,00000000000000000000001000000000000000000000000000000100000000000110000000010001101101110011010010101101110100011001101011100100110101100110001011011001010110101111010,ZARNFVIOBFMXPR-UHFFFAOYSA-N
CC1=C(C=N[N]1C)C2=NOC(=C2)C=CC3CCCC(F)C3,4ED815B8B2CC0600_D44647C578570314_7019_UN,8.646297,00000000000000000000000000000000000000000010000000001000010000100100000100010000100100010000011011010010000100000000001011101100111000100100001010011110100010101111110,QDCWCEADCAIMLI-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC2(CCNCC2)NCC3CC3)C=CC(=C4)Cl)C5,CA5D2B717285BBA9_CA98BE902A7F885B_6034_UN,7.724881,00000000000000000000001000000000000000000000000000000100000000000110000000010001101101110011010010101101110100011001101011100100110101100110001011011001010110101111010,ZARNFVIOBFMXPR-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC4(C3=C[N](C)N=C3)CCCO4,E0E152DE14BF9031_0D800BEE12F03CC9_6041_UN,7.8773994,00000000000000000000000000000000000000100010000000001000010000100110000000010100101100010011011111101100010111001000001011101100110011110110011011011111110111101111110,TYRFBSJRGYSDLM-UHFFFAOYSA-N
CN(CC1CNC1)C2=NC(=CN=C2)N[C@H]3C5=C(OC4(C3)CCCC4)C=CC(=C5)F,5456C4A826AAB702_7A7B705CC7D246E0_6041_DP,8.095239,00000000100100000000000000000000000000100010000000000000010000000110000000000101101001110011010011101100110110011101001011100100110111110110001011011001110111101111110,DHUKABMDOSSZHK-GOSISDBHSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NCC4(CCCC4)C5=C(C(=CC=C5)F)F,F8F9DCA57618A395_9F025052DC15F5E2_6041_DP,7.8556166,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000010110001000001011100100110101110110001011011011010110101111010,IXWOKDKMWLSGMI-YLQYIJTPSA-N
O(C(=O)C1=CC2=C(C=C1)C3CCC2O3)CC4=C(C=CN=C4)Cl,BCB232336A57957A_0A4FED291EE0F1AD_6031_UN,8.435423,00000000000000000000000000000000000000000000000000000000010000000100000000000000000100010000000011100101010101000000001011010110000010100100000011110010111101010111110,GOMPXFQFDABZKR-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC3CCN(C)C34CCCNC4,E9541CC72DF788A8_C1D23843D7D75ACA_6041_DP,7.657406,00000000000000000000000000000000000000100000000000000100000000000110000000010101101101100011010010101100110010011001101011100100110101010110011011011111010010101111010,OCQAJNUBJNVKTB-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC3CCC(CCC(C)C)C3,1F6AD8CF1347F09D_38BACA9C189E61F7_6041_UN,8.462843,00000000000000000000000000000000000000000010000000000000000000000100000000100001000000010011000010100100110100010001101001000100110001110100011011010111000110101111010,USOBSCUUJFYYHL-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CCC3CNCC3)C4=CCNCC4,5608EC407DB3E11A_F064F153AD9DE10A_6034_UN,8.36323,00000000000000000000000000000000000000000000000000100000000000100100000000011000001101100011000010111100110000010000001011100100110100000110001001011001010110101111010,LCLWAUVIPMYKOA-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2OC3(CC2)CCCCC3)F,CD8B29CC374DA339_50F00F399E686144_7022_UN,7.164859,00000000000000000000000000000000000000000010000000000000010000000010000000100000001101110011010110001000010100001001001000100000110011110110001011011111110111101111110,BOYNOOYRHODGJN-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC[C@@]34[C@@H](CCC3)OCC4,55D30778A9E06066_A7D9585488D305BE_6041_UN,6.9942145,00000000000000000000000000000000000000100000000000000000010000000110000000000100001100000011000011101100010011001000001011000100110011010110011011010111110111101111110,DWNKRCPLKYTBES-YLJYHZDGSA-N
ClC1=CC=C(C=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]5[C@@H]4CNC[C@@H]4C5,D9D5122757DE4D4C_04C4F4BC9840C2B0_6034_UN,8.610886,00000000000100000001000000000000000000100000000000000000000000100100000000010101001101110011000010001001110100010000001011100100110100100110001010011011010110100111010,QJNCJWHPDNHMDS-XLHDVRGUSA-N
BrC1=CC2=C(C=C1)N(C=CC2=O)C[C@H]4[C@@H]3CNC[C@@H]3C4,9CC95FAA6BCB5B39_E8396A13C5823289_6034_UN,9.068429,00000000000100000001000000000000000000000000001000000000000000000100000000010000001101110011000011101100010100000100000011100101110000100110001101001001111110100111110,FAANCHWUUZPDLE-COPLHBTASA-N
CC2=C1CCCC1=CC(=C2)NCC4=CC=C(CN3CCCN(C)CC3)C=C4,671F36D8C495CB66_8C3FB49E02FE64C3_6041_UN,7.5971327,00000000000000000001000000000000000000000000000000000000000000000000000000010001101001100001010010001100010010010001101011100100110001010110001011011101010110101111010,ZTZFJRPRUVNMCS-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2CCCCC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,28E49A470709332A_415E6E08506D0290_6041_UN,7.998087,00000000000000000000000000000000000000000010000000000000000000100000000000010001100101110011010010001000100110010001101001100100110001110100001001011011010010101111010,CBJGWAWJMHZBMX-PKTZIBPZSA-N
CN(C)C4CCN(CC1=CC=C(C=C1)NCC2(CCC2)C3=C(C=NC=C3)F)C4,924D282C1586CFC1_2B79D5EA0503786E_6041_UN,8.212096,00000000000100000000000000000000000000000010000000000000000000100110000000110001101101110011010010101000000110011000101011100100110001110110001011011111010110101111010,FPVUZHPASVOSPY-UHFFFAOYSA-N
CC1=NC(=NC(=C1)NCC2(CCCC2)C3=C(C(=CC=C3)F)F)CC4CC4,4E991A7AC0D12351_388D07221A994669_6041_UN,8.257331,00000000000000000000001000000000000000100010000000000000000000100110000000000100101000010011000010101000000110011000001011000100110001110100001011010011010110101111010,XZAIGIWODWPUBQ-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)C#N)NCC2CNCC(C2)(C)C)F,180DE70F1701715D_CB3F8F47E04C0F38_6041_DP,7.9576387,00000000000000000000000000000000000000000110000000000100000000000010000000100000101000110010000000101000000110001001000001000000100101110110001011000111010110101111010,ZZGLNPLOGFUMHO-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C=C)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,B0717C1988F7E240_3D82A5E165B79E61_6041_UN,8.628216,00000000000000000000000000000000001000000010000000001000010000100100000000010000101101110001011110111000000111010001101011101100110011110110001011011111110111101111110,APJLVTNGYRJIDE-ROUUACIJSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[C@@H]3CCO[C@H]3C4=C[N](C)N=C4,951698E4CAD0A1B5_313DACD60924B161_6041_UN,7.837476,00000000000000000000000000000000000000000010000000001000010000100100000000010001101100010011011011101100010111000000001011101100110011110110001011011111110111101111110,WKRLZCCJVPWWMP-IFXJQAMLSA-N
CN1C(CCC1)CC=CC2=CC(=C(C=C2)N3CCOCC3)F,F0C22B7366FA1DAE_9A5C1AFD1F88481C_7019_UN,8.340819,00000000000000000000000000000000000000000010000000000000010000100000000000010000000101110000010110111000000111010001101011100000110011110110001011011010010111101111110,VYWMANHWUUNBPK-UHFFFAOYSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NCC6=CC4=C([N](C)C(=N4)C5CC5)C=C6,80874D8B453749DF_BF858C4C59025413_6041_UN,7.878568,00000000000000000000001000000000000000100010000000000000010000100100000000010101001101110000010010101100010111000000001011100100110011110110001011011011010111101111110,LWCJFPXWTBZNJQ-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=C3C(=CC=C2)CCOC3,37E1C4722901E5A8_A1131AD8D4FBB702_6041_UN,7.511409,00000000000000000000100000000010000000000000000000000000010000000100000000100001000000100011010001100100010001001000001011000100110011010110011011011111010011101111110,NJIYJQFCTHQEFE-UHFFFAOYSA-N
O[C@H](CCl)C1=CC=C(C=C1)NCC23COC(C)(C2)CCC3,EDB395D990E44EBD_BC89B98BA92025CB_6041_UN,8.671656,00000000000000000001000000000000000000000000000000000000010000000010000000000000001100000011000011001001110011001001101000000000110111110111000001010001110111111111110,GPXGYDKYRYWCPH-KLAILNCOSA-N
CC2=NC1=C(C=C(C=C1C)Br)N2CC4(CC3=CC=C(C=C3)F)CCNC4,BACA6E373A629FEE_D569F40062BA9B6C_6034_UN,7.9151278,00000000000000000000000000000000000000100010001000000000000000000110000000010101101101110011000010001100110100011000101011100100110000100110001011011111010110101111010,MZQCZCMSJCCBCD-UHFFFAOYSA-N
CCC(C)C1=CSC(=N1)N[C@@H]2CCN(C)[C@H]2C3=CC(=C(C=C3)F)F,3577FA959EF609FF_612785EBABADFDB7_6041_UN,8.745323,00000000000000000000000000000000000010000010000100000000000000100100000000010101110101111011010010001000101110010011101011100100000001110100011010011111010110101111010,HXAIKZHFATVWPM-ZBQDIEFISA-N
C1(=C(C=C(C=C1F)F)Cl)NCC(OC)C2CCCOC2,59E2246EDFA543A6_068A67F03DD80D00_7022_UN,8.097725,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110101010100101001000111000000101000000010110011110110000011010011110111111111110,DKKWIDWYYNCLHT-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@H]3[C@H](CCCC3)N4CCOCC4,8903450029755C49_ED2D0A0FF965D9A6_6041_UN,7.264879,00000000000000000000000000000000000000100010000000000000010000100100000000010100101001110011000100101100010111010000001011100100110011110110001011011111010111101111110,ZDJIMKMBJSRHMR-PXNSSMCTSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3CC4CCCC(C3)C4,77E0CFA006A4A243_A409C4F1FF1B9C90_6041_UN,8.462022,00000000000000000000000001000000000000000010000000000000000000000100000000010101000101010001010010000100111100010000001011100100110001110100001011011011000010101111010,HCGIBQFCUFMKHK-UHFFFAOYSA-N
C1(=C(C=C(C=C1F)F)Br)NCC(OC)C2CCCOC2,A5518567D02AA354_ACE960D281680BAF_7022_UN,8.097725,00000000000000000000000000000000000000000010001000000000010000000000000000000000001000110101010100101000000111000000101000000010110011110110000011010011110111111111110,JHSWRCDRWMSHQD-UHFFFAOYSA-N
C1(=C(C=C(C=C1Cl)F)Cl)NCC(OC)C2CCCOC2,18F096D6D0F1A748_49AE10ABCDD64C1A_7022_UN,8.097713,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110101010100101001000111000000101000000010110011110110000011010011110111111111110,BQWOSGKNDIPMBO-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C(=O)C3(CC3)C4=CC(=C(C=C4)F)Cl,F1A5908BDCD180CA_7D589FFEF1CF97A2_6038_UN,7.4591894,00000000000000000001001000000000000000000010000000000000010000100010000000010001001101110011100110101001110100111000011011100000110010100110001011011011111111110111110,NJBORTXBJOPCDI-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C(=O)C3(CC3)C4=CC(=C(C=C4)Br)Cl,9ACDE1120608DA4B_F96F6BC9CE248A41_6038_UN,7.45919,00000000000000000001001000000000000000000000001000000000010000100010000000010001001101110011100110101001110100111000011011100000110010100110001011011011111111110111110,PVTNVPRMCDHMMF-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC(C)[CH]2C[C]3(C2)C[CH2]C3)F)CC4,33FB86F0B472148C_AE6D0783305ADF58_6041_UN,7.641018,00000000000100000001000000000000000000000010000000000000000000000010000000010001100001110010010000001000010110011001101011100000110001110110001010011111010110101111010,PWOOMRNCESLJLV-UHFFFAOYSA-N
O(C2CCC1COCCC1C2)C[C@@H]3CNCC(O3)(C)C,22EE582CA5F51417_D6E1329ECDD203B5_6039_DP,7.89562,00000000000000000000000000000000000000000000000000000000010000000010000010100000001000100010000101101100010011001001001011000011110010000110000101110101110101111101110,WZILVDUSQNBRTK-BOADVZGGSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CC(C3)C4CCC4,CBA6995DFD6FB144_30E75F29BB8B0368_6041_UN,7.7077055,00000000000100000000000000000000000000100000000000000000000000100100000000000100001000000010000000101100010010000000001001000100110001010100011011010111010110101111010,NAEKJETVZWVQNU-UHFFFAOYSA-N
C1(=CC2=C(C=C1)CC3CCC(C2)C3=O)NCC4=CC(=CC(=C4)F)F,6D2B9A44D3AC4E26_A02B06651064344F_6041_UN,7.9543757,00000000000000000001000000000000000000000010000000000000000000000000000000000000001000010001000010001100010100000000001000000101110001110000000111010001111110100111110,JEWMENUJYLIUCR-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC3(CC2(CNC2)C3)C4=CC=CC=C4,9D12CC234E1F43C7_F419643028A4E82F_6041_DP,7.320963,00000000100100000000000000000000000000000110000000000000000000100010000000000000001000110010000000001000010110001000000001000100100101110110001011000011010110101111010,WHLQVFNBBBMGGB-UHFFFAOYSA-N
C2(=CC1=C(C=C(C=C1)F)O2)O[C@@H]7CC6=CC[C@@H]3[C@H](CC[C@@]4(C)[C@H]3CC=C4C5=CN=CC=C5)[C@]6(CC7)C,796530759F22461A_AE4D74D5AC324EA3_7022_UN,8.456037,00000000000000000000000000100000000000000010000000100000010000100110000000001000000100010000000010110100010110001101101011010111110010100100000101010110100001011111110,HTHFYOBDUKPBIM-RMAZQVEGSA-N
CN(C1CCCNCC1)C2=NC(=NC=C2)N[C@H]3[C@@H](C3)C4=CC(=CC=C4)F,437D7C3F8B643C69_C0D5DC3F382B21BE_6041_DP,7.9161463,00000000000000000001001001000000000000100010000000000000000000100100000000000100101001110011010000101000101110010000101011100100110101110110001001011011010010101111010,FTSDIXHHWRJQSW-UQJFVLDMSA-N
C2(=CC1=C(C=C(C=C1)Cl)O2)O[C@@H]7CC6=CC[C@@H]3[C@H](CC[C@@]4(C)[C@H]3CC=C4C5=CN=CC=C5)[C@]6(CC7)C,8A143CC3C6E02B14_BDE105171E4430C2_7022_UN,8.456031,00000000000000000000000000100000000000000000000000100000010000100110000000001000000100010000000010110101010110001101101011010111110010100100000101010110100001011111110,KEZIUXHDGFUIIH-RMAZQVEGSA-N
C1(=CC=C(S1)C2(CCC2)C#N)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F,AC6B4104D8B33E14_1FEBD517F16B69FB_6041_DP,7.2135735,00000000000100000000000000000000000010000110000100000010000000100010000000000001011100111011000010101000100100011000001011000100110101110110001011010011010010100111010,JVMWNYRLQHEAHN-RHSMWYFYSA-N
BrC1=CC2=C(N=C1)N(C=C2C3CC3)CC(NC4=C(CC)C=CC=C4C)C,51172E82E15561D1_15BA20A8A94A27A9_6034_UN,8.84664,00000000000000000000001000000000000000100000001000000000000000100100000000010101000101010010000010101100110110010011000011100100000001110100011011011111010110101111010,CCUHZKUHPDSNCS-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4=C(C=CC=C4)C5=C(C=CC=C5F)F,E75664D0E4BA0D72_42F79FA817DFB347_6041_DP,7.750023,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110001010010101000010110000000000011100100110101110110001011001011010010101111010,DXZLPSPZNHNNSY-SZLXDWMPSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4CCSC5=C4C=CC=C5F,8B197F3C6BCB88EB_EC263914F050DC50_6041_DP,7.9514713,00000000000000000000001000000000000010100010000000000000000100000100000000000101111101111011010010101100110110010000001011100100110101110110001011011001010010101111010,DFRYUSPTICVJLW-GYABFAJESA-N
C[N]1N=CC=C1C2CCCC3=C(C4=C(N=C23)C=C(C=C4)Cl)C5COCCC5,C1695509DE274401_038A29F51093FC84_2201_UN,8.222754,00000000000000000000000000000000000000000000000000001000010000100100000000010000100100110000011010100101010111000000001011101100110010100110001011011010010011101111110,FTAHGKCFBPCRIU-UHFFFAOYSA-N
CC1=C(C=NC(=C1)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)C#N,AA339FC8B7C7CFAE_C8661E8D724BBAE0_6041_DP,7.5236835,00000000000000000000000000000000000000100110000000000010000000100100000000000101101000110011000000101000100100010000001011000100110101110110001011010011010010101111010,NMFPESJODRYVQP-RHSMWYFYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3CCN(CC3C)CC4CCCO4,61A45C9F1B2E5D88_4887B60C8BD924BC_6041_UN,8.073138,00000000000000000000000001000000000000000010000000000000010000000100000000010101100101110010010110101100111111010001101011100100110011110110001011011111110111101111110,BVYCKBGNMNXRAC-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)N[C@H]4[C@@H](CCC4)C5=CC=C(C=C5)F,540E277512E2E3CB_D91ADAE018F04DF7_6041_DP,7.9747066,00000000000000000001000001000000000000100010000000000000000000100100000000000100100101010011010010100000111100010000101011100100110101110100001001011011000010101111010,HQFRINKJLDPQIX-HGJUEJDCSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC(C3CCCC3)C4CCCC4,29C42CBF791DB56F_182C6A9B29A82BD5_6041_UN,7.5907083,00000000000000000000000000000000000000100010000000000000000000000100000000000100001000010001000010101100010110000000001001000100110001110100001011010111010110101111010,POPPLVQRCIQKLE-UHFFFAOYSA-N
C(N3CCC1=C(C=CN1CC(OCCC)C2=C(C=C(C=C2)F)C)C3)C4=CC=CC=C4,9CEBBB40DC7E8395_1591383202E7BE3E_6034_UN,8.376866,00000000000000000000000000000000000000000010000000000000000000000100000000010000100101110000000110101100010111010011001011100110110010100110001011011110110111101111110,SQCMBGOTYJXWLK-UHFFFAOYSA-N
N4C[C@@H]1COC[C@]1(C=CC3=C(N(C)C2CCCC2)C=CC(=C3)F)C4,4DE16DC390A65346_A0860994034352B5_7019_DP,8.381863,00000000000000000000000000000000000000000010000000000000010000000010000000000000001101110011010011011100010111011000101011100000110001110110001010011011010011101111110,ONWXWSZHBBYUEH-UZLBHIALSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,EB33A3D5962BDEE3_4E4A24CF5309EF79_6041_UN,7.8237686,00000000000000000000001001000000000000000010000000001000000000100100000000010101101101010011011010101100011110010000001011101100110001110110001011011111010110101111010,JKBNOPNCMMIBSU-KUHUBIRLSA-N
O([C@H](C1CCCC1)C2=CC(=CC=C2)F)CC4=CC3=C([N](N=C3C)C)N=C4,84856042BCEA16B3_264FE44590C4D93B_6039_UN,8.270819,00000000000000000000000000000000000000100010000000001000000000000100000000010101100100010000011011100100010101000000001011101110110000100100001001011100110111101111110,NIECNJTYXITMOT-HXUWFJFHSA-N
C(C1CCCCC2OC12)=CC3=C([N](N=C3C)C4=C(C=C(C=C4)C)C)Cl,AB09C00C84C44B1A_CC7952946C7EC829_7019_UN,8.383821,00000000000000001001001000000000000000000000000000001000010000100100000000010000100100010000001010010101010100000000001011101100110011110100011010011110100011101111110,HZXRPZGIFVPXOD-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=C[NH]2)NC4CCN(CC3CCCO3)CC4,8E481A328D9C4049_56ECDBA017EC8707_6041_UN,8.283957,00000000000000000000000000000000000000000000000000000010010000000100000000010001100101100010000110101100110001010000001011100100110111010110001011011011110111101111110,KCIHQLBBFNVDDX-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3=CC=C(C=C3)N4CC5CCC(C4)O5,5F5E7D04B7660C08_78025871F6D8BFE2_6041_UN,8.403119,00000000000000000001000001000000000000000010000000000000010000100100000000010101000101110000010110101100011100000000001011100100110011110110001011011011110011101111110,KDPKAKGLTLYNNB-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=C[N]2C[C@@]34CCCN[C@H]3CCCC4)C5=CCNCC5,ED8D81B847FE8E79_76E5A6965EE7EAD9_6034_DP,8.474543,00000000000000000000000000000000000000000010000000100000000000100110000000011000101101110011000010111100110100011000001011100100110100100110001001011001010110100111010,LWKZPBKXSHMKNC-XZOQPEGZSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,B03FB34FDB8BC86D_D0539E5A526771E5_6041_UN,8.056313,00000000000000000000000000000000000000100010000000000000000000100100000000010101100101110011010010101000100110010001101011100100010001110110001011011111010010101111010,IXCLNKWQEXYOBW-AABGKKOBSA-N
C[Si](C)(C)C#CC1=CC(=CC=C1)NCC2CCCC3=NC=C[N]23,7604868EC962AEBE_1337C0E060A603F1_6041_UN,8.083333,00000000000000000100100000000010000000100000000000000000000000000100000000100101001101100011010010101100010000011000001011100100110001010100011011011101010110101111010,CYLVIRIVYBXEFV-UHFFFAOYSA-N
FC1=NC2=C(C=C1)C=C(C=C2)NC3CN(C)C4(C3)CCOCC4,0D354FE12041DBA9_5433ACAAB8FFBAB9_6041_UN,7.7790995,00000000000000000000000000000000000000000010000000000000010000000110000000010001100101110001010011101100110111011001101011100100110011110110001001011001010011101111110,JYTKOAWRNILTIW-UHFFFAOYSA-N
FC1=CC=C(C=C1)CC2=NC(=CC=N2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,BDCB902C480104A0_31F0EDDBBCF3A860_6041_UN,8.745576,00000000000000000000000000000000000000100010000000001000010000100100000000010100101101110001011110101000000111010001101011101100110011110110001001011111110111101111110,GJQWYADAXSPDJD-RXVVDRJESA-N
FC1=CC=C(C=C1)C(CCC=CC3=C2CSCCC2=N[N]3C)C4=CC=C(C=C4)F,B401B4CD9FD88169_67B4FF511BC2F56C_7019_UN,8.082029,00000000000000000000000000000000000010000010000000001000000000000100000000010000100100111000011010110100010110010000001011101100110000100110001011011010010110101111010,MUBYKLRLHSTAMN-UHFFFAOYSA-N
CC1=NC(=C(C(=C1)C)F)NCC2C(CCCC2)C3CC3,4E12C2B2362FD0A0_E30682D8C77E30C5_6041_UN,8.841431,00000000000000000000001000000000000000100010000000000000000000100100000000000100001000010011000000101000000100000000001001000000110001110100001011010111010110101111010,KWOAXNMPJNDXEG-UHFFFAOYSA-N
CN(CC1CCNC1)CC2=NC=C(N=C2)NC3C(C)(C3)C4=C(C=C(C=C4)F)F,BE9822493A0CDFEF_123389935E54FDE7_6041_DP,8.001314,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000100110011001101011100100110101110110001011011111010110101111010,IUZULQRXSAEFML-UHFFFAOYSA-N
N5CC1=C(C=C(C=C1)NC3(CC2=CC(=C(C=C2)F)C)CC3)C4(CC4)C5,8C0DBA86B536FB42_334ABF5297F9C49F_6041_DP,8.008931,00000000000000000000001000000000000000000010000000000000000000000010000000000000001000110011000000101100110110011000001001000100110101110110001011010011010110101111010,BYMYGNDGHCFJOT-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2=CC(=NC=C2)N3CCSCC3)F,A6E9B9E4C850143E_C6262C8D76379DAF_7022_UN,8.043277,00000000000000000000000000000000000010100010000000000000000000100100000000110100001001111001010000101000000100010001001011100100110001110110001011011111010110101111010,UHTSMOTXPHSTLS-UHFFFAOYSA-N
CC1=CC(=C(C=C1)F)NC24CC3CC(C2)CC(C3)(C4)F,6FCB8863BA7D9606_333888AF06F29A3E_6041_UN,8.807392,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010001000000000100110100011000000000000000100001110000000011000011000010101111010,NVAAJVJNYKWLKM-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,8358D30CBC8F51F6_1344F0F61E5FA7D0_6041_UN,7.920969,00000000000000000000000000000000000000000010000000000000010000100100000000010000101001110001010100101100010111010001101011100100110011110110001011011111110111101111110,KYZHVMHMGDNPTA-UGKGYDQZSA-N
FC1=C(C(=CC=C1)NC3CC(C2=NC=C[N]2C)OCC3)C=C,6EBB8553BE8D524C_AB72A6847EFE0ECD_6041_UN,7.974352,00000000000000000000000000000000001000100010000000000000010000100100000000010101000101010010010111110000100111010000001011100100110011110100001011011011110011101111110,TWVPTYRVBRZRHN-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2C4CCC(C2C3=CC=CC=C3)C4)Cl)C5CC5,A460126EC8112F43_B8D705E2EA5EF214_7022_UN,7.658262,00000000000000000000001000000000000000000000000000000000000000100000000000000000000000010011000010000001010110000000001000000100010001110000000011010011000010101111010,MTDHCEUZHUSVHK-UHFFFAOYSA-N
N(C2C1CC(C1)C3=C2C=CC=C3)C(=O)[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)Cl)F,C1FE78CD8012A4C1_6DECF6E0B8744C85_6038_UN,7.5144973,00000000000100000000000000000000000000000010000000000000010000100000000000000000000100010111100011000101010101100000011000000100000011100100000011010011111011110111110,XPLVVZBOKFRMSC-QPQMHHNLSA-N
N(C2C1CC(C1)C3=C2C=CC=C3)C(=O)[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)F)F,BE8B560F33C0A1E1_0E7917C2BD91B500_6038_UN,7.514482,00000000000100000000000000000000000000000010000000000000010000100000000000000000000100010111100011000100010101100000011000000100000011100100000011010011111011110111110,GYMBQKVWMQNFFX-QPQMHHNLSA-N
N4CC1=C(C=C(C=C1)NC2=CC(=C(C=C2)N3CCCCCCC3)F)C4,6A986EA5C8AA591F_4B3363E37FF7BA78_6041_DP,7.752439,00000000000000000000000000000000000000000010000000000000000000100000000000010000001101110001000010001100010100010000001011100100110101110110001011011011010010100111010,DXBUWQDCPUOIOM-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(C3=C(C)C4=C([NH]3)C=C(C=C4)F)=O,225094CE82825D25_9FF222918FF6A55F_6038_UN,8.078755,00000000000000000000000000000000000000000010000000000010000000000100000000000001001100010011100110011100010100100000011001000100110100100100001011010011011110101111110,BTUXDVMTSIZADK-UHFFFAOYSA-N
COC(CNC(=O)C1C4C2CC5C3CC(C1C23)C45)C6=CC=C(C=C6)F,3559929524DEA61E_C29A8A0534C0269B_6038_UN,7.881092,00000000000000000001000000000000000000000010000000000000000000000000000000000000001000010000110110001100010100100000110000000010110010100000000001000001111111111111110,RXSLLNTXFJLHBH-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)N[C@H]3[C@H](C2=C[N](N=C2C)C)OCC3,8AFCB86C79B84AFC_B01A7A1329AD7A26_7022_UN,7.6096277,00000000000000000000000000000000000000000110000000001000010000100100000000010000100100010011011111000001100101010000001011101100000011110100001010011111110011101111110,DKGZZFPGTQFLDD-ZBFHGGJFSA-N
FC2=C(C=C1C(CCC1=C2)=O)NC3=CC=C(C=C3)N4CC5CCC(C4)O5,F3A2EE87B596EF64_20EED60080F8295B_6041_UN,7.725616,00000000000000000001000000000000000000000010000000000000010000100000000000010000000101110000000110101100010100000000001011100101110011110110001111011011111011110111110,BQKXYNHBKSOYQX-UHFFFAOYSA-N
C(CCC1CCOCC1)=CC3=CC(=C(N2CCN(C)CC2)C=C3)F,CFD17364A5A2DF05_BB2A13B49B234769_7019_UN,6.97188,00000000000000000000000000000000000000000010000000000000010000100000000000010001000001110000010000111000000101010001101011100000110011110110001011011010010111101111110,RBHQYWWAROKRSO-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCN2CC3=CC=CC=C3)Cl)C4CC4,5D7531C507A6B16D_63D4934A7164F031_7022_UN,8.24165,00000000100100000000001000000000000000000000000000000000000000100000000000010001001001110011000000001001000110010000001001100100110001110110001011011011010110101111010,POFOUCFWOPEWPI-UHFFFAOYSA-N
CC2=CC(=C1OCC(C1=C2)OC4=C3N=CC=CC3=C(CN(CC)CC)C=C4)Br,4B7329D6BDB92C9C_49263C5657EB73F6_6035_UN,7.995201,00000000000000000000000000000000000000000000001000000000010000000100000010000000000101110100000110101100010101000110100011100111000010100110011111001100110111111111110,GCRFGWCFHOGZJP-UHFFFAOYSA-N
O[C@H](CCl)C1=CC=C(C=C1)NCC(C)(C)N2CCSCC2,BFE31CD82BB69E18_7C354C3441C2EC4D_6041_UN,8.496031,00000000000000000000000000000000000010000000000000000000000000000010000000110001001001101001000000101001100010011001101011100000110111110111001001011101110111101111110,BEDLYSGADDGVHC-OAHLLOKOSA-N
CC1(C)O[C@@H]2CC[C@H]1C[C@H]2OCC4=NC=C(C3=C(F)C=CC=C3)O4,67FDE1D19C54AECD_979DC6AF154641F4_6039_UN,8.094687,00000000000000000000000000000000000000000010000000000000010000100110000010100000000100010000100110100000010111111000111011000111110010100100000111110110110111011111110,OLMZJXWWYGWACY-APHBMKBZSA-N
FC2=C1[NH]C=CC1=CC=C2NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,29061FB430E1D889_C28F74B26450DD8C_6041_UN,8.768589,00000000000000000000000000000000000000000010000000000100000000100100000000010000101101110011010010101100010110010001101011100100110101110110001011011011010110101111010,ZVJLVEFVAUNFJZ-KXBFYZLASA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=CC(=C(C=C1F)Cl)C)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,45472C379F6C4CD7_3B9C4169E8B0ED48_6035_UN,8.916222,00000000000000000000000000100000000000000010000000100000000000100110000000001000000000010000000010110101010110001101101001000111110010100100010111010110100001001111110,PAMDJVAGCSWTDD-OJSVXTFUSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=CC(=C(C=C1F)F)C)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,846105BF0DBF6D2A_D1760A3671D4CA65_6035_UN,8.916216,00000000000000000000000000100000000000000010000000100000000000100110000000001000000000010000000010110100010110001101101001000111110010100100010111010110100001001111110,ZZVNEGSIXCNURS-OJSVXTFUSA-N
FC1=C(C2=C(C=C1)CCC2)NC[C@@H]3O[C@H](C(C)(C)C)CC3,BCB4E1BCC12840D8_1294BFD11DFDAC34_6041_UN,7.525029,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010011000110001100010110001000101000000000110011110100010010010111110111101111110,UBMLREXTNLFYCZ-CJNGLKHVSA-N
CC1=CC(=C(C(=C1)N[C@@H]2CNC[C@@H]2CC3=CC=CC=C3)F)C#N,C106B6C785DEA21F_DFE705A78D309753_6041_DP,7.4780574,00000000000000000000000000000000000000000110000000000110000000000000000000000001101100110011000010001000100100010000000001000100110101110110001011000011010110101111010,OJVVWWLGTJKYFE-FUHWJXTLSA-N
CN(C)CC1=C(C=CC(=C1)NC2=CC(=NO2)C3CCCC3)F,BB4289B706E827A7_257704BD57CDFF66_7022_UN,7.8565297,00000000000000000000000000000000000000000010000000000000010000100100000100100001100101110001111011001010000100100001011011101100010001110100001010011111010110101111110,YJKNHXZSTJZAET-UHFFFAOYSA-N
O=C1N(C4=C(N1C[C@H]2[C@@H](CNC2)C3=CC=C(C=C3)Cl)C=CC=N4)C5CCNCC5,F03A8ECDDB56ACD6_955D95C7A1E24B4F_6034_UN,8.644362,00000000000000000000000000000000000001100000000000000000000000100100000000010101101101110011000011101101111100110100011011100101110101100110001111011011011110100111110,YDYBEUPZQAOYRP-LPHOPBHVSA-N
N1CCC5(CC1)CCC2=C(C=CC(=C2)NC4=CC(=C(N(C)C3CCCCC3)C=C4)F)O5,9262A7C3D1503D2C_612C280A554C5DEA_6041_DP,7.8524036,00000000000000000000000000000000000000000010000000000000010000000010000000000000001001110001010001101100110110011100101011100100110111110110001011011011110011101111110,OJSJAYFINJGMJH-UHFFFAOYSA-N
FC2=C1C(=C[NH]C1=CC=C2)NC(CC)C3CCOCC3,53EA7484AD9579E6_5A7FD5812C54EFD3_6041_UN,8.259441,00000000000000000000000000000000000000000010000000000110010000000100000000000001100100110011000010100100110111010010001011000100110111110110001001010001010111101111110,CYVIHDDCDBQPEF-UHFFFAOYSA-N
CN1C(=O)CCOC2=C1C=CC(=C2)NC4=CC3=C(NCCC3)C=C4,AC73BF6113028C90_A56F84E7BEAED265_6041_DP,8.707508,00000000000000000001000000000000000000000000000000000000010000000000000000010000001001000111110101101100110011110100111011100101100111010110001111011011111011111111110,ITSUSERPUZMYJK-UHFFFAOYSA-N
C(C1(CC1)C2CCCCO2)=CC3=C[N](N=C3C)C4=CC(=CC=C4)F,22F0CA34FA9F64B2_904EB74D7F512CCE_7019_UN,8.201811,00000000000000000000001000000000000000000010000000001000010000100110000000010000100100010000001010110000000101001000001011101100110011110100001011011010110011101111110,WYHUAGLMEUNHCB-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2C[C@H]3[C@@H](CNC3)C4CC4,F1D8C946B700B7EA_D6E34088A2D65BDF_6034_UN,9.106951,00000000000000000000001000000000000000000000001000000000000000100100000000010000101101110011000010001100010100000000100011100100110000100110001010011111010110101111010,BHYOYUYZTYTXAZ-YOEHRIQHSA-N
N(C(CF)C1=CC=C(C=C1)F)C([C@@H]2CC(CN2)C34CC(C3)C4)=O,569E131D7AEE9E6F_AE0DD49CAD901FF6_6038_DP,7.7046294,00000000000100000000000000000000000000000010000000000010000000100010000000000001001100010011100110001000110100111000010001000000010100100110001000000001011110100111110,SZPBBBNLVBOEHZ-CWAXFYHBSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F)F,A3C900E5C73419AD_B096188A72715DF8_6041_UN,7.6509094,00000000000000000000000000000000000000000010000000000000000000100100000000010001100101110011010010101100110110010001101011100100110001110100001011011111010010101111010,BLVQCCUESFKTMU-RDGATRHJSA-N
CC1=C(C=NC(=N1)C2CC2)C3=CC=C(C=C3)NCC45CC(CC)(C4)CO5,691413AF500B3F6A_DE13B1C220FCC60F_6041_UN,7.9448404,00000000000100000000001000000000000000100000000000000000010000100110000000000100101100000011000110101000010001001010100011000100110011010110001011010111110111101111110,PPZFWASZZCPUSG-UHFFFAOYSA-N
CN(C1CCCNCC1)C2=NC=C(N=C2)N[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,26279D0BE56C92EB_8769D5FA21A43ADF_6041_DP,8.556784,00000000000000000001000000000000000000100010000000000000010000100100000000000101101101110011010111101000100111010000101011100100110111110110001011011011110011101111110,WMASHPMYNQOTDP-BAMDKVGYSA-N
CC1=C(C(=CC(=C1)NCC2CNCC(O2)(C)C)F)C#N,CC304C2DA3FD8273_3A27C0422A1F0AF5_6041_DP,7.7221727,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110011011000111110111101111110,LXPQOIUABPGECW-UHFFFAOYSA-N
OC(CBr)C1=CC=C(C=C1)NC23CC(C)(C2)OC34CCC4,F26C3910D595FE6B_3CD942F9F74D5202_6041_UN,8.078606,00000000000100000000000000000000000000000000001000000000010000000010000000000000000100000011000111000000110010011001001000000000110111110101000000010001110111111111110,HKQJLNKISFHMTI-UHFFFAOYSA-N
OC(CF)C1=CC=C(C=C1)NC23CC(C)(C2)OC34CCC4,E99B20898C067436_4B07217E55C68569_6041_UN,8.078602,00000000000100000000000000000000000000000010000000000000010000000010000000000000000100000011000111000000110010011001001000000000110111110101000000010001110111111111110,BPLBCHOBHODQIY-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CCC3CC(C)(C)OC3)C4=CCNCC4,6AE3B5D377202C40_72E3EA7B9FC526D7_6034_UN,8.481671,00000000000000000000000000000000000000000010000000100000010000100110000000111000001101110001000010111100110111011001101011100100110010100110001001011101110111101111110,JQGISLXRENPHBK-UHFFFAOYSA-N
C[N]1N=C(C=C1NCC(N2CCN(C)CC2)C3=CC=C(C=C3)F)C4CCCC4,6964656D2C1E798D_FE90CD8259321C92_6041_UN,7.6495285,00000000000000000000000000000000000000100010000000001000000000100100000000010101101101110001011010101000000110010001101011101100110001110110001011011111010110101111010,PWQOOKOQAAFFHW-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=NC=C1)NCC2N(C)CC3(CC2)CC3,CC3137D14ADE511D_BA66E6AF437F78B4_6041_UN,8.170188,00000000000000000100101000000010000000100000000000000000000000000110000000110101001001100011010000101000010010011001101011100000110001010110011001011111010110101111010,DSEWHRWGEWMHBS-UHFFFAOYSA-N
CCOC(OCC)C4=NC1=C(N=CC(=C1)NCC(N2CCN(C)CC2)C3=CC=C(C=C3)F)[NH]4,A971AD6AB1494ECB_FCA3D8E4FA08EA14_6041_UN,9.028477,00000000000000000000000000000000000000100010000000000000000000000100000000010101101101110001010110101100010101010011101011110110110101110110011001011101010111111111110,SVTDGNAJVDYUQJ-UHFFFAOYSA-N
N(CC12CCC(CC1)O2)C(=O)C3CCCCN3CC4=CC=C(C=C4)F,9FD3042ADE7713D1_5D6062813BF300B6_6038_UN,7.9238796,00000000000000000000000000000000000000000010000000000000010000000010000000010001001101110011100110101000010100111000011011100000110010100110001001011011111111110111110,WENDELNTUAGMCR-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N(C=C2C3CCNCC3)CC4C[C@H](C)O[C@@H](C4)C,9A912E54F95CE0C5_DB2D392C048426BF_6034_UN,8.463548,00000000000000000000000000000000000000000010000000000000010000100100000000010000001101110001000010101100110110010001001011100100110010100110001001011101110111101111110,XCLCMFFEVVHJFD-XYPWUTKMSA-N
FC2=C(C=C1C=CN=CC1=C2)NCC3CCN(C(CC)C)C3,879F9EF787C021A3_3F891B152AE273F0_6041_UN,8.473689,00000000000000000000000000000000000000000010000000000000000000000100000000010000101101110011000010101100010110010011101011100100110001110110001011011111010110101111010,CVCQDRYVKLZTOB-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CCC2(C)CC2)C=CC(=C3)C)C4,AB9B9F130F2D8955_045FCD38D3BB2706_6034_UN,8.071115,00000000000000000000001000000000000000000000000000000000000000000110000000010000000101000000000010001100010010011011101001100100110000000100010011011100010110101111010,CSLFAVVMRPRQDK-UHFFFAOYSA-N
NCC(COC1=C(C=CC(=C1)C2CNCCC2)F)C3CCOC3,5765450BE456EAC3_A2EF18A8381C9ADB_6035_UN,8.222923,00000000000000000000000000000000000000000010000000000000010000100000000000000000001110110011000011101000100101010100001011000011110110100110001111010011110101110111110,RRCHUKOUSFEKIW-UHFFFAOYSA-N
NCC(COC1=C(C=C2C(=C1)CNCC2)F)C3CCCCC3,F1F62B2841A6AC93_AE89C85DB582FE57_6035_UN,8.076574,00000000000000000000000000000000000000000010000000000000000000000000000000000000001010110011000001101100110101010100001001000011110100100110001111010011110101100111110,RQLKCIZFELSTER-UHFFFAOYSA-N
C[N]1N=C(C=C1NCC(N2CCOCC2)C3=C(C=CC=C3)F)C4CCCC4,DF2848E923A01814_9631767017786F11_6041_UN,8.054198,00000000000000000000000000000000000000100010000000001000010000100100000000010101101101110001011110101000000111010000001011101100110011110110001011011011010111101111110,SPIODVLFBNYHNY-UHFFFAOYSA-N
C(C1CCNCC1)C2=NC=CN2CC4=CC(=C(N3CCN(C)CC3)C=C4)F,04BFEC269DEEDB9C_790830ABB291E3B7_6034_UN,8.106151,00000000000000000000000000000000000000100010000000000000000000100100000000010101001101110001010010101000100100010001101011100100110001110110001011011011010110101111010,DAPRBTYYCHWRHZ-UHFFFAOYSA-N
C1(=CC(=CC=C1)C2CCCCC2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,EFC5A0298FD2B97D_C59B5E32D61B9743_6041_UN,7.8250203,00000000000000000000000000000000000000000010000000000000000000100000000000010001000001110000010000101000000100010001101011100100110001110110001011011011010110101111010,HRLLDIUJORRTQS-UHFFFAOYSA-N
C2(=C1[NH]C3=C(C1=CC=C2)CSCC3)NC4=C(ON=C4C)C=CC5=CC=C(C=C5)F,B3A8668950C30D09_0C07CE18656B392A_6041_UN,8.342825,00000000000000000000000000000000000010000010000000000010010000000100000100000001100100111011001111110110110100010000001011001100110101110110001011010011110010101111110,YDSCMZKLSOPKFV-UHFFFAOYSA-N
N1CCC4(CC1)OC5(COC2=C(C=C(C=C2)Cl)C3CC3)CC4(N)C5,D62B30C7B595D9BB_89A243F77E6704BE_6035_DP,8.277982,00000000000100000000001000000000000000000000000000000000010000100010000010000000001110110011000111101001110101011100001011000011110111100110001111010011110111110111110,YXOGPNAUZVMEPL-UHFFFAOYSA-N
CC3=NC1=C(C=CC2=C1CCCN2)N3CC4CNCC(C)C4,F38A2503DDCDC6F4_1C3AB15472CA7299_6034_UN,7.966256,00000000000000000000000000000000000000100000000000000000000000000100000000010101101101100011000010101100110010010001101011100100100100010110001011011111010110101111010,KNEUFPVPRPSUNY-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3CC(CC(C)C)OCC3,C1FA1F525FED22FA_8550DE863A65A186_6041_UN,8.540085,00000000000000000000000000000000000000000010000000001000010000000100000000110000100100010011011011100100110111010001001011101100110011110100011001011101110111101111110,UIURDSZAOCBRST-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(C3=C(C)C=NC(=C3)F)=O,17F5BFC2FB86D708_0988E2FDC9EBC8B5_6038_UN,8.194478,00000000000000000001000000000000000000000010000000000000010000000100000000000000001100010010100010101000010100100000011011000000110010100100001011010011111111111111110,SPCWDZOQLWAVPE-UHFFFAOYSA-N
FC2=C(C=C1C(=NC=CC1=C2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4)F,894DDFA4C412229B_1A32EFF93A7333C0_6041_UN,8.349602,00000000000000000000000000000000000000100010000000000000010000100100000000010100101001110001010100101100010111010001101011100100110011110110001011011011110111101111110,OGJCSJVEHXOFFA-PMACEKPBSA-N
CN(CC1CCNC1)CC2=NC=C(N=C2)NC3C(C)CC4=C3C=C(C=C4)F,8EBEB24884F6FD2E_8580A35D576DFDF1_6041_DP,7.9163885,00000000000000000000000000000000000000100010000000000000000000000100000000000101101101110011010010101100110110010001001011100100110101110110001011011111010110101111010,CPUSGDWIGZENPV-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC23CCC(C)(CC2)OC3)F)CC4,4E746015FC4A8924_9761F3A7DED610A1_6041_UN,6.817922,00000000000000000001000000000000000000000010000000000000010000000010000000010001101001110011010001101000010111011001101011100000110011110110001011011111110111101111110,BCILDNLNNOPGPK-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)F)NCCN(C)CC2COCCC2)F,2368F83A56247531_559E8136A02AAA2D_6041_UN,7.5774145,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001011011011010111101111110,UGROGOSQMDVTSY-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CC(=N2)NCC(N(C)C)C3CCCCC3,AC3BFE2C0064FB32_7773EDC87C192D1D_6041_UN,7.7163854,00000000000000000000000000000000000000100010000000000000000000000100000000100101001001110001010000101100010110010000101001100100110001110100001001011101010110101111010,WPCORDPLGQXJQI-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2(CCC2)C3=CC(=CC=C3)F)C4CCCC4,70C9F76DD525AF1D_180F0628C7129E57_6041_UN,7.925122,00000000000100000000000000000000000000100010000000001000000000100110000000010101100100010011011010000000100100011000001011101100010001110100001010011011000010101111010,RMZQIXFNKOVCPZ-UHFFFAOYSA-N
C1(=CC(=CC=C1)C2=CC=C(C=C2)Cl)NC[C@@H]3CNC[C@H]3C4=CN=C[N]4C,2D3479323BD7C47C_9F164490F7A51C39_7022_DP,7.106746,00000000000000000000000000000000000000000000000000000100000000100100000000010101101101110011010010001001000110000000000011100100110101110110001011001011010110101111010,KIXQTZJSPYXOCY-FXAWDEMLSA-N
CC45CCC(C=CC1=C[N](N=C1C2=CC=CC(=C2)C)C3=CC=C(C=C3)F)(CC4)CO5,54E1BF55EDD863C9_245C5F2D4A2142B3_7019_UN,8.118552,00000000000000000000000000000000000000000010000000001000010000100110000000010000100100010000001010110000010101001001101011101100110011110100001011011110110011101111110,WIJFKMAXWCTBKI-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)C4=CC(=CC=C4)C=C(F)F,EBA56F67877A0115_3C85BA12DC2B0597_6038_UN,7.477265,00000000000100000000010000000000000000000010000000000000000000000010000000001000001000000010100010011000010100101000011000000000110000100000000001010001011110100111110,FXKIHRHNNLFNNC-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4(CCC4)C5=C(C=C(C=C5)F)F,80603B8711DF0F98_F2F529C6872D26C0_6041_DP,8.176939,00000000000100000001000000000000000000100010000000000000000000100110000000000101100101010011010010100000110100011000101011100100110101110100001011011011000010101111010,TWEZBIMIQJHKDH-BJWYYQGGSA-N
C[N]1C=NC2=C1C=CC(=C2)NC35CC(OC34CNC4)(C)C5,CABB351695F98741_2812D30D1B4837F2_6041_DP,7.2394013,00000000100100000000000000000000000000000000000000000100010000000110000000010101101101100011010111001100110010011001000011100100110111010110001000001101110011101111110,MOIKSPLRZGJZJH-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NCC23CC(C)(CO2)CCC3)F)F,D4B7052208A5C047_894E0ABD8DD300EB_7022_UN,7.189687,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100010011000110001000010111001001101000000000110011110110000011010111110111101111110,DPHUWSXDFFRYSW-UHFFFAOYSA-N
C1(=CC2=C(C=C1)OCCC2=O)NC4=CC3=C([N](C)C=C3)C=C4,B6408524F1AE9E57_CB275650DE080A73_6041_UN,9.101496,00000000000000000000000000000000000000000000000000000000010000000100000000010000000101000100010010100100010001000100001011100101000011010100001111011001111011111111110,VQYBRLZHMHJFJH-UHFFFAOYSA-N
NC1=C(C=CC(=C1)C3=NC2=C(C=C(C=C2)Br)N3CC4(CCC)CNCC4)Cl,C6B6B3929C150CD5_FC4A8C2F970FF532_6034_UN,7.9724245,00000000000000000000000000000000000000100000001000000000000000100110000000010101101111110011000010001101110110011011001011100100110101110110001011011011010110101111010,YFLNZFVZHULUPH-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCC2(CNC2)C3=NC=C(C=C3)F,F1622148AC93428C_4F8D015B774888A4_6041_DP,7.7979136,00000000100100000000100000000010000010000010000000000100000000100110000000100000111100111010010010101000000100001000000011000100100101110110011010001111010110101111010,HLVGYQZFINECJG-UHFFFAOYSA-N
N(CCC1C3CC2CC(CC1C2)C3)[S](C5=CC4=C(N=C(Cl)C=C4)C(=C5)Cl)(=O)=O,ABD4D316A67C6857_99098F460D41FA78_6029_UN,7.979809,00000000000000000000000000000000110000000000000000010001001111001101010001000000011000011000001000101111111100011000011001001100111000101100001001011001010110110111110,ZSEJRKVVUNPUFF-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC2CNCC(O2)(C)C,25269E741678E528_CAF4B039974959BE_6041_DP,7.453734,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110011011000111110111101111110,FNVFPDXSQFENPC-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC(C=C)C2CCOCC2)F)CC3,5D391BE4774552A5_D761C7F0B01E2B3D_6041_UN,7.498011,00000000000000000001000000000000001000000010000000000000010000000000000000010001100001110011010000111000000111010001101011100000110011110110001011011011010111101111110,QCAQRIDKYIZPMX-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2CCO2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,A56BF2D4BE51673D_71F5C2A8C62BE46E_6041_UN,8.667908,00000000100100000000000000000000000000000010000000000000010000100000000000010001100101110011010010001000100111010001101011100100000011110110001011011011110011101111110,YMCDJTSFNUSZHR-ITIDOPETSA-N
N1CCC5(CC1)CC(OCC2=CC3=C(C=C2)NC(=O)O3)C4=C(C=CC=C4)O5,5BEE4428E368690E_45746D32F142C103_6039_DP,8.796235,00000000000000000000000100000000000000000000000000000000010000000110000000000000001100100101000111101100111001111100011011010111110110000110101111110001111111110111110,SCNPCZVDTCHHLF-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NCCN(C)C2CCCCC2)C3CC3,68D776710726496F_140666B981575235_6041_UN,7.5069613,00000000000000000000001000000000000000000010000000000000000000100000000000000001001001110001010000001000100110010001101000100000110001110010001011011011010110101111010,LETBQKWJVSVUKC-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3C4(CC3)CCOCC4,2F2B11D7CB541E7B_D6BFBA9638FE1CB7_6041_UN,7.0221114,00000000000100000000000000000000000000100010000000000000010000000110000000000100001000110011000000101100010111001000001011000100110011110110001011010111010111101111110,NCSOKEDKBDQDBV-UHFFFAOYSA-N
C(NCC1=CC2=C(C=C1)N(C=C2)CC4CCN(C3=CC(=C(C=C3)F)C)C4)C5=CC=CS5,14962BFACEE47738_F596EB4133530999_6034_UN,8.63077,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111000000010001100010100010000001011100100110001110110001011011011010110101111010,XWNCZRUFNKAGNJ-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3CNC4(CO3)CCC4,73276B6DBB365D76_BB88A7FC8EBDA053_6041_DP,7.294614,00000000000100000000000000000000000000100000000000001100010000100110000000010101101101000011011110101000110011011000001011101100110111010110001011011111110111101111110,NCVISVNWIUBEGR-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CN=C2)NCC3(C)CCC4(CC3)CC4,08D87ADCD74AE1C3_C07D643DC4451870_6041_UN,7.47817,00000000000000000000001000000000000000000000000000000000000000000110000000010001101101000011010010101100010000001001101011100100110001010100001001011101010110101111010,KECKPSHXLKZTAN-UHFFFAOYSA-N
CC1=C(N=C(O1)C2=CC3=C(C=C2)C=CC=C3)C=CC4CC45CCC(F)(F)CC5,ACB639FA95813592_483838D975BFDA55_7019_UN,8.657403,00000000000000000000001000000000000000000010000000000000010000100110000000000000000100010000100110010100010100101000011011000100110000100100000011010010100010001111110,QQRYSFMWVIFLPF-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2(C)CCC3(CC2)OCCO3)F,B1D79F839AE7E289_5F04FDC7DAB6CF33_7022_UN,7.457189,00000000000000000000000000000000000000000010000000000000010000000010000010100000001101110011010010001000010101001001101010110000110011110110011011011111110111111111110,BTEDYWXKLVKJEU-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NCC2N(C)CC3(CC2)CCC3,8EC134F82B81AC24_505AF247A9F3762A_7022_UN,7.6823945,00000000000100000000100000000010000000000000000000000000000000000010000000110001001001100011010000101000010010011001101001100000110001010110011001011111010110101111010,NYHSTINBLWXQOU-UHFFFAOYSA-N
C1(=C[N](N=C1)CC2CCOC2)NC3C(C)(C3)C4=CC(=C(C=C4)F)F,399D06BA540A0EAB_8E19B1F0466492E8_6041_UN,8.349049,00000000000000000000001000000000000000000010000000001000010000100110000000010001100100110011001011001000100101011001101011101100110011110110001010011011010111101111110,YXZQVDUCSNYTPR-UHFFFAOYSA-N
CC1(CCO1)C2=CC=C(S2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,44D29B96765548FF_66E01328518B3B3C_6041_UN,7.6440554,00000000100100000000000000000000000010000010000100000000010000100010000000010001110101111011010010001000100111011001101011100100000011110110001000011111110011101111110,FTAKBGXXFHVELH-XSFKQQOJSA-N
CC1=C(C(=CC(=C1)F)N[C@@H]2CNC[C@@H]2CC3=CC=CC=C3)C#N,3709FBE1FD487AF5_BF415D1B615C9850_6041_DP,7.2294626,00000000000000000000000000000000000000000110000000000110000000000000000000000001101100110011000010001000100100010000000001000100110101110110001011000011010110101111010,NNQVVAZJESUWQB-HNAYVOBHSA-N
N(CCC1CC2CCC1O2)C(C3=C(C)C4=C([NH]3)C=CC(=C4)F)=O,7BFDC7A67546C715_1AF044E85AD70EA5_6038_UN,7.663167,00000000000000000000000000000000000000000010000000000010010000000100000000000001001100010001100110001100110100110000011011000100110110100100001011010011111111111111110,QBDINNVGXXKPAQ-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC(=C2)NCC3CCN(C(CC)C)CC3,EA6FA6A6AB1E4FAD_C1CED9ADA65AA9CA_6041_UN,8.19427,00000000000000000000000000000000000000000010000000000000000000000100000000010000001101110011000010101100010110010011101011100100110101110110001001011101010110101111010,ZCGAYGMDFFGTQP-UHFFFAOYSA-N
C1(=CC=C(C=C1)CCN2CCCCC2)NCC3N(C)CC(CC3)(C)C,000C96280EE3DF57_669D7972D0613494_7022_UN,8.155074,00000000000000000000000000000000000000000000000000000000000000000010000000110001001001100011010000101000000010011001101011100000110001010110011001011111010110101111010,TZZRKLJZOIAQBF-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[NH]C=C2C3CC3)NC4CCCC5=C4C=C(C)[N]5C,51CC5F50EB7C1532_1D0E7F41BAD1EEAF_6041_UN,8.285277,00000000000000000000001000000000000000000000000000000000000000100100000000010000100101000011010010000100110010010000101011100100100101010100001011011111000010101111010,AFTPASANDRTNKZ-UHFFFAOYSA-N
N(CC1CC2CCC(C1)S2)C(C3=C[N](C)C4=C3C=C(C=C4)F)=O,9552DDFFADCC598E_38C0A2662951F078_6038_UN,7.631716,00000000000000000001000000000000000010000010000000000000000000000100000000010000111101011010110011101100010100100000011011100100110000100100001001011001011110101111110,GAFAVANAFZPVBV-UHFFFAOYSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NCC2=CC=CC3=C2CCCN3,751560C52071AE3C_E014EDD1FA77FD43_6041_DP,7.573051,00000000000000000000100000000010000000000000000000000000000000000000000000100000001000100011010000101100110000011001001001000100110101010110011011011111010110101111010,RTZOAKFFRXTNOI-UHFFFAOYSA-N
CO[C@@H]1C[C@H](NC1)C2=NC=CN2CC(CC3=C(C=CC=C3)Br)C#N,CD44369B5EF8722D_4CF3878DBEFFC940_6034_UN,7.6150475,00000000000000000000000000000000000000100100001000000000000000100100000000010101101101010011010111001000100100010000100011100111110010100110001110001011110111101111110,ZFEUSIIFGLFOMN-RHBCBLIFSA-N
N(C2C1C3CC4C1CC5C2C3C45)C(C6=C(N=CC(=C6)OC)F)=O,6C2AE13C3894C232_0F6F301BC5AFD2E2_6038_UN,8.230656,00000000000100000001000000000000000000000010000000000000000000000100000000000000100000010001110111100100010100100100010001000011110001100100001111000011101011111111110,FZJWYNYXZJZDJH-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NC4CC3(CCN(C)CC3)OC5=C4C=CC=C5,72517EF8BEEAB794_E7CD2ACBD328B7C5_6041_UN,7.622757,00000000000000000000000000000000000000000010000000000000010000000010000000010000000001110011010011101100110100011101101011100100110011110110001011011001110011101111110,JYXGJVKHRFITMG-UHFFFAOYSA-N
C1(=CC2=C(N=C1)[NH]C(=N2)C3CC3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,E11FEE953267E0A1_CBD9D0C818C936A8_6041_UN,8.146245,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101110011010010101100110110010001101011100100000101110100001001011011010010101111010,VNTDCXGEAXQPFI-AEFFLSMTSA-N
BrC1=CC2=C(C=C1)N(C=C2C3CC3)C[C@@H]4CCCN4CC5CC5,4FBC31D55A4C1D67_9AB59238B29A37A7_6034_UN,8.597753,00000000000000000000001000000000000000000000001000000000000000100100000000010001000101110000000010001100010100010000001011100100110000100110001000011010010110100111010,NEBVREFJFHZHFR-KRWDZBQOSA-N
N(CC1C2CCC(C1)CC2)C(C(C)(F)C3=C(C=CC=C3)F)=O,BE4CCBE57AB61D6B_F43009900350F038_6038_UN,7.9066477,00000000000000000000000000000000000000000010000000000000000000000010000000000000001000010011100000001000010110101000011000000000110000100000000011010011011110101111110,KBEZMLUSENZASD-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=NC=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,6D45E20F6FACDF20_8CF87C80F0AB0D6C_6041_DP,8.207701,00000000000000000000001001000000000000100010000000000000000000100100000000010101101101110011010010101000111110010001101011100100110101110110001001011111010010101111010,OMZLEGZTFOUUTD-ALOGGSCOSA-N
N(CC1C(CCC1)C2CC2)C(=O)C3=CC=C(C=C3)C4=CC(=C(C(=C4)F)F)F,E6BEFEC036679110_28BC0E747E29270D_6038_UN,7.704262,00000000000000000000001000000000000000000010000000000000000000100000000000000000001000010011100010001000000100100000011000000100110000100000000011010011011110100111110,XECLXJARYMJNTB-UHFFFAOYSA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CCC4=C(C(=CC=C4)Br)Cl,79CEA4D56B9321D0_91D999CE4E255D4B_6038_UN,7.0538983,00000000000000000000000000000000000000000000001000000000000000000000000000000000000000010010100000000101110100110000011000000000100011100000000011010011001110100111110,SFVKGLNTNFZZMP-UHFFFAOYSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC2=C(C)[N](C(=C2)C)C3=CC(=CC=C3)F)C4,CCAA9617CFD2EB11_7F7DFCBA90251EF7_7019_DP,8.190743,00000000000000000000000000000000000000000010000000000000000000100100000000010000000101010010000010010000110100010000001011100100110001110100001011011111000010101111010,PCTCPVGIXYOORH-POAQFYNOSA-N
FC1=C(C=C(C(=C1)N[C@@H]2CNC[C@@H]2CC3=CC=CC=C3)C#N)F,97F3F87AED45D0BA_FBBF0C35D910E673_6041_DP,7.548072,00000000000000000000000000000000000000000110000000000110000000000000000000000001101100110011000010001000100100010000000001000100110101110110001011000011010110100111010,ISECXFMDWHZYGB-KBXCAEBGSA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CCC4=C(C(=CC=C4)F)Br,1728EF17C38EBF41_5C5F53C5ACEA2666_6038_UN,7.0538907,00000000000000000000000000000000000000000010001000000000000000000000000000000000000000010010100000000100110100110000011000000000100011100000000011010011001110100111110,VLJBGFLJWVDQHE-UHFFFAOYSA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CCC4=C(C(=CC=C4)Cl)Cl,CE03642A5CD13459_D63A52EE0195EA46_6038_UN,7.053891,00000000000000000000000000000000000000000000000000000000000000000000000000000000000000010010100000000101110100110000011000000000100011100000000011010011001110100111110,XEXGAKOMJZHTAN-UHFFFAOYSA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CCC4=C(C(=CC=C4)F)F,B57792AD7AE09087_E0AEF613E05F146A_6038_UN,7.053882,00000000000000000000000000000000000000000010000000000000000000000000000000000000000000010010100000000100110100110000011000000000100011100000000011010011001110100111110,SCDVLCLZQGUVKJ-UHFFFAOYSA-N
N1[C@@H]4CC[C@H]1[C@H](C=CC2=C(C)[N](C(=C2)C)C3=CC(=CC=C3)Cl)C4,5BB0CD1004A06EBA_15ECFDDD70915755_7019_DP,8.190726,00000000000000000000000000000000000000000000000000000000000000100100000000010000000101010010000010010001110100010000001011100100110001110100001011011111000010101111010,ULPHHBGNTOAFCT-POAQFYNOSA-N
N(C1C3CC2CC(CC1C2)C3)C(=O)CCC4=C(C(=CC=C4)Br)F,7DDD786B3A530EF2_742110550C62671D_6038_UN,7.0538783,00000000000000000000000000000000000000000010001000000000000000000000000000000000000000010010100000000100110100110000011000000000100011100000000011010011001110100111110,GKZUHVXYAKWWBA-UHFFFAOYSA-N
FC2=C(C=C1C(=CC=NC1=C2)N[C@H]3[C@H](C(C)(C3)C)OCC4=CC=CC=C4)F,61AEF785580EEB96_879D9EE7197BFDC6_6041_UN,8.1141,00000000000100000000000000000000000000000010000000000000000000000110000000100000100000010001000100100100110111011001000001000111100001110100001111000111110111101111110,VALWNZZYMXQFEN-NHCUHLMSSA-N
CC3=C2N=C1CCCCC1=C(C2=CC=C3)NC4=CC=C(CO[Si](C)(C)C)C=C4,E0CF3E5AFA1CB24D_804214D245C6DC6A_6041_UN,8.008914,00000000000000000000100000000010000000000000000000000000000000000100000000100000100000100011010000100110010001011000101001001110110001010100011011011101010111101111110,BJYBPIUKZSAWGD-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2C3(C(O)C2)CCOCC3)F)CC4,F2FEA6E043B3ADF9_1B89A1394A5816AE_6041_DP,6.805148,00000000000100000001000000000000000000000010000000000100010000000010000000010001100001110011010001101000110111011001101011100001110111110111001111011011110111111111110,CITRYFFETCTXKS-UHFFFAOYSA-N
N3CCC1(CCCC1C=CC2=C(N)C=CC(=C2)F)CC3,2CC9F643780A0EDB_80333C499C9E8467_7019_DP,8.51963,00000000000000000000000000000000000000000010000000000000000000000010000000000000001010110001000010111000110100011000001001000000110101110110001011010011010010100111010,ZGVYVDCYSLPBDM-UHFFFAOYSA-N
N3CCC1(CCCC1C=CC2=C(N)C=CC(=C2)Cl)CC3,3693E7CED3887134_2D34F82DF81F7525_7019_DP,8.5196295,00000000000000000000000000000000000000000000000000000000000000000010000000000000001010110001000010111001110100011000001001000000110101110110001011010011010010100111010,UBBSLYBOBFSWNB-UHFFFAOYSA-N
FC2=C1C=CN=CC1=C(C=C2)NC4=C(C=C3OCCOC3=C4)[N](=O)=O,6D8DCB6001E841DB_08996D602C162193_6041_UN,8.537943,00000000000000000000000010000000000000000010000001000000110000010100001110000001100000010000001001100110010101000100001111101100001011110110101011111011110011110111110,SZENDRGFAGVAPQ-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3C5CCC(C3C4=CC=CC=C4)C5,7004F15AF251047B_5A56ED77516FEDF2_6041_UN,8.383395,00000000000000000000000001000000000000000010000000000000000000100100000000010101000101010011010010000100011100000000001011100100010001110100001011011011000010101111010,CNKXUIMGRHLHNW-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3OCC4(CC3)CCC4,D0017845FF84A47C_F899291358B94518_6041_UN,7.3069115,00000000000100000000000000000000000000000010000000001000010000000110000000010000101100010011011110101100010101001000001011101100110011110110001001011001110111101111110,XBGJMIQXRMQOLK-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[C@@H]3CC[C@@H](O3)C4CC4,0C4B5EC346F2CE07_E82A664B9F816D26_6041_UN,8.292618,00000000000000000000001000000000000000000010000000000000010000100100000000000001001100010011000110101100010110000000001011000100110011110100001011010011110111101111110,MZCZMDXIXNXYDI-WMLDXEAASA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)C[C@]45[C@](C)(C4)CNC5,4059B943738320FD_FBD1D6653C0E04CF_6034_UN,7.9254785,00000000000000000000001000000000000000000000000000000000010000000110000000010000101101100011000110101100110011011001101011100100110110000110001001011011010111101111110,COZHDQDSNBJBEA-OHAXFNJZSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC34COC(C)(C3)CCC4,43B3E8131AB12011_0B4B51BD07359674_6041_UN,7.913716,00000000000000000001000000000000000000100010000000001000010000100110000000010101101100010011011011101000010111001001101011101100110011110110001011011111110111101111110,DMLVVFXAZSZJIJ-UHFFFAOYSA-N
CN(C)CC1=CN=C(C=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,C5DEA4A15675F63F_BF906C078DF4C755_6041_DP,7.4451466,00000000000000000000000000000000000000100010000000000100000000100100000000100100101001110011010000101000100100010001001011100100110101110110001001011111010110101111010,FTSZTYYOYVMLPO-PKOBYXMFSA-N
CN4CC(C1=NN=C(C)N1CCC2CCCCO2)C3(CNC3)C4,D4CE7379E3911FC5_12D9D9F9A181E6FA_6034_UN,7.022141,00000000100100000000000000000000000000100000000000001000010000100110000000010101101101100011011011101000010011011001101011101000110010000110001010011111110111101111110,VVMYLLNYUBESLN-UHFFFAOYSA-N
C(C2COC1(CCCCC1)O2)=CC4=CC(=C(N3CCN(C)CC3)C=C4)F,47EABDEF8DBCCFE1_F455AE968261FCEB_7019_UN,6.88595,00000000000000000000000000000000000000000010000000000000010000100000000010010001000101110000010010111000010101011001101011110000110011110110001011011010110011111111110,MOQAQANYYPSWFP-UHFFFAOYSA-N
C1(=C(C(=CC=C1)Cl)Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,907AF02B0BC7F776_1F401600367C8CF4_7022_UN,8.015909,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101010011011010101001000100010000001011101100110001110110001011011011010110101111010,UXQXEOPXRROGEV-YJYMSZOUSA-N
C1(=C(C(=CC=C1)Br)Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,4B3A8B87C13FF925_0A4070BE4760B3C9_7022_UN,8.015905,00000000000000000000001000000000000000000000001000001000000000100100000000010001101101010011011010101001000100010000001011101100110001110110001011011011010110101111010,FMPABOLENBHCBF-YJYMSZOUSA-N
C1(=C(C(=CC=C1)F)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,BAC3F2AB9FD7037E_84D9DA9E4D4B5154_7022_UN,8.0159,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,DSFITOYPXXGMGL-YJYMSZOUSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)CC4CCC3(CCN3)CC4,E2196ED5017B7F84_2CB630C47D9845BD_6034_UN,8.474754,00000000100100000000000000000000000010000000000100000000000000100110000000010110011101011011000010001001111100011011001111100100110001110110001011011111010110101111010,ZMFUVVBGPZPMIH-UHFFFAOYSA-N
C1(=C(C(=CC=C1)Br)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,FC4E6D20B7351840_5AFCEC22EEFA6508_7022_UN,8.015888,00000000000000000000001000000000000000000010001000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,BMNFEDRWNVYJKK-YJYMSZOUSA-N
C1(=C(C(=CC=C1)Cl)F)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,DECDF68275EF4429_45B86FF0A63D81F2_7022_UN,8.01588,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101001000100010000001011101100110001110110001011011011010110101111010,ANNKWHDJBDVDIR-YJYMSZOUSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3OCC4(C3)CCC4,1F0FBA7C4BB7413F_FDD19449642A73F2_6041_UN,7.050913,00000000000100000000000000000000000000100000000000001000010000100110000000010101101101000011011110001000010011001000001011101100110011010110001010011111110111101111110,KNBXOCXGOPBPTL-UHFFFAOYSA-N
N1CC2(C1)CCCN(C2)C3=NC(=NC=N3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,B09CEDACF3B7BE13_19B1E4AA4732CBCF_6041_DP,8.128499,00000000100100000000000001000000000000000010000000000000000000100110000000010101101101110011010010101000111110011001101011100100110101110110001001011011010010101111010,BCTOUJGVFHZMBD-MSOLQXFVSA-N
FC1=C(C(=CC=C1)C2CC2)NCC3=C(C=N[N]3C)C4CC4,92E2A3C13291B252_0ED07473B866B480_6041_UN,8.23764,00000000000000000000001000000000000000000010000000001000000000100100000000010001101100010001011010001000000100010000101011101100100001110100001010011011010110101111010,XAESJWRBHHLVOZ-UHFFFAOYSA-N
C[N]1N=C(N=C1NC2=CC(=C(C=C2)N3CCCCCCC3)F)C4CCC4,707883CC56EF7E6C_2E305F805377CAED_6041_UN,8.143418,00000000000100000000000001000000000000100010000000001000000000100100000000010101100101110000011010001100001100010000001011101100110001110110001010011011010010101111010,YXVRMKVWKAQTLL-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2(CCOCC2)C#N)N[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,D8897885197EF00A_C68A9E9917FA663E_6041_UN,7.437755,00000000000000000000001000000000000000000110000000000000010000100010000000000000000000110010000000100000100101011000001000000100110011110110001011010011010011100111110,VIFSJISZHSOLOF-VQIMIIECSA-N
FC1=CC2=C(C=C1)C(=NO2)NC4C[C@H]3CCC[C@H](N3C)C4,9203008394700C77_8FB526DDA933EF4C_6041_UN,8.233498,00000000000000000000000000000000000000100010000000000000010000000100000100010100100101010001011111100110110110010000101011101100110001110100001001011001100010101111110,JOOWRMRAUDMWQC-YHWZYXNKSA-N
FC2=C1CCCC1=C(C=C2)NC4CC(C3=NC=C[N]3C)OCC4,B630FC762CB8DECF_D652CB342354F45C_6041_UN,7.3409324,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010011010111100100110111010000001011100100110011110100001011011011110011101111110,XAPADNWJNCMLDE-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)NCC2OC3(CCC2)CCC3,DDAA82CB7B694F35_0C1BBFD1DEAA7AB7_6041_UN,7.407764,00000000000100000000000000000000000000000110000000000000010000000010000000000000001000010011000100101000010110001000001000000000110011110100001011010011110111101111110,OHUFCIKEXAZCKC-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)C#N)N[C@H]2[C@@H](OCC2)C3=CC=NC=C3,812930EFFFFA1025_83CC5744EA54FEC8_6041_UN,7.385194,00000000000000000000000000000000000000000110000000000000010000100100000000000000000100010011000111100000100101010000001011000100000011110100001011010011110011101111110,HIHRKDAPELUMSM-WBVHZDCISA-N
CC2=C(C=C1C=N[NH]C1=C2)NC4C[C@H]3CCC[C@H](N3C)C4,3479376A9399D0E5_E2F6D27A31B023EE_6041_UN,7.842716,00000000000000000000000000000000000000000000000000001000000000000100010000010000100101000001011010100100110010010000101011101100110101010100001011011111000010101111010,DWVKMYLRSSUCPT-GOOCMWNKSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3C(C(C)C)OCCC3,C23C8EAFEA23E7E4_0300FB31912F81B6_6041_UN,7.9955635,00000000000000000000000000000000000000100000000000000000010000000100000000100100001000000011000001101100010011000000001011000100110011010110011011010111110111101111110,BTYIHQTVFICVGF-UHFFFAOYSA-N
N(C1C4C2CC5C3CC(C1C23)C45)C(C6=C(C=CC(=C6)C7=C[NH]N=C7C)F)=O,56C620300C064FF3_663065546E95A27A_6038_UN,8.330254,00000000000000000001000000000000000000000010000000001000000000100100010000000000100100010001101010000100010100100000010011001100110101100100001011000011001010101111110,RATUVPVBJGNHMH-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2CCC3(CC2)OCCO3)F,37DC2F6577067B92_1B4F181C91B5441B_7022_UN,7.618625,00000000000000000000000000000000000000000010000000000000010000000000000010100000000101110010010010001000110101011001001010110000110011110110001011011111110111111111110,KFSCJSYZEGWVMC-UHFFFAOYSA-N
BrC1=CC2=C(N=C1)N(C(=N2)C3CC3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,FBB203C92DC03009_5246EAAE7854612A_6034_UN,8.657545,00000000000000000000001000000000000000100000001000000000000000100100000000010101100101010000010010101100010100010000001011100100110001100110001011011010010110101111010,BITUWUALLRHBHZ-QRWLVFNGSA-N
CC3(C)CCCC(C=CC2=C1OC=CC1=C(F)C=C2)C3,2DA68A07F3AAAC6E_FF12F22369028EE3_7019_UN,8.231734,00000000000000000000000000000000000000000010000000000000010000000010000000100000000100010000000010010100010110001001101000000100110000100100000001010100100000001011110,OXBIRKOCRJWANU-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Br)NC3=CC(=N[N]3C)C4CCCOC4,297758B68A083FA7_D92B974815086A87_7022_UN,7.7329016,00000000000000000000000000000000000000100000001000001000010000100100000000010101100100110000011011100100010101000000001011101100110011110110001011011011010011101111110,BXCZGAQVLDZBPN-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NC3=CC(=N[N]3C)C4CCCOC4,33DF89AEEC3BEE72_89CBDF7EFE830EF1_7022_UN,7.7328978,00000000000000000000000000000000000000100000000000001000010000100100000000010101100100110000011011100101010101000000001011101100110011110110001011011011010011101111110,AOTAHHXDRNDIKY-UHFFFAOYSA-N
C(CC1CCOCC1)=CC2=C[N](C)N=C2C3=C(C=C(C=C3)F)F,3306B8BC80D5DF4A_AC8EB2C77D26D856_7019_UN,7.997735,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100110000011010110000000101000000001011101100110010100110001011011010010111101111110,QIUSKOPJUMRAGA-UHFFFAOYSA-N
CC1=NC3=C(C(=N1)NCC2C[Si](C)(CC2)C)C(=CS3)C4=CC=CS4,215603DEAFB442F0_A4EF622E4F408AD5_6041_UN,8.524374,00000000000000000000100000000010000010100000000100000000000000100100000000100100111100101011010010101100010010001001101011000100110001010110011000011101010110101111010,INJLVVYFLMNGEG-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N(C=C2C3=CCNCC3)CC4[C@@H]5CNC[C@H]45,27B3DFA414FE684C_FD013F5C62F649E0_6034_UN,8.899188,00000000000000000000001000000000000000000010000000100000000000100100000000011000001101110001000010111100110100010000001011100100110100100110001001011001010110100111010,SLNMJNBPFYAERY-BYICEURKSA-N
FC1=CC2=C(C=C1)[N](C=C2C3=CCNCC3)CC4[C@@H]5CNC[C@H]45,27B3DFA414FE684C_078C225CCA62D327_6034_DP,8.899178,00000000000000000000001000000000000000000010000000100000000000100100000000011000001101110001000010111100110100010000001011100100110100100110001001011001010110100111010,SLNMJNBPFYAERY-BYICEURKSA-N
CC1=CC(=C(C=C1)C)[C@@H]2CCCC[C@H]2OCC3OCCC34CCNCC4,FB26F76663BF5295_115D9AE9919DC056_6039_DP,8.254574,00000000000000000000000000000000000000000000000000000000010000100010000010000000001100100001000010101000110011011000001011000011110010000110000111010111110101111111110,UZZUWKLYEZMEPP-BMHUVXDISA-N
FC1=C(C(=CC=C1)C2CC2)NCC3(C)C(OCC3)C4CC4,2695A32735905576_FF33BA266B8BA886_6041_UN,7.617643,00000000000000000000001000000000000000000010000000000000010000100010000000000000001100010011000011001000000111001001101000000000110011110110000010010011110111101111110,OIONRXBBZOUTPT-UHFFFAOYSA-N
CC1=C(N=C(S1)NC[C@@H]2CNCC(O2)(C)C)C3=CC=C(C=C3)F,0071B6DBF9E9524B_7D62A81AF4B4C35D_6041_DP,7.9763365,00000000000000000000000000000000000010000010000100000100010000100110000000100100111100111010000110101000001110001001000011000100100111110110011011000111110111101111110,DDNILZGGAIYESE-AWEZNQCLSA-N
CCC1=CC(=NO1)C=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,A0F9F1B61D2EFB35_71C3D0C027DFDFCF_7019_UN,8.121743,00000000000000000000000000000000000000000010000000000000010000000100000100000000000101010000011011010010000110010010101011101100010011110100001010011110100110101111110,QEGHTQIZLOEEEB-UHFFFAOYSA-N
CC(OCCC2COC1(CCCC1)O2)C3CN(C)CCO3,1751D62B4259A825_19DA1C6C6A8C6962_6039_UN,7.030363,00000000000000000000000000000000000000000000000000000000010000000000000010010000000101100100010111101000010011011001101011110010110010000110100000111100110101111101110,HAHPPCQQWRZYJS-UHFFFAOYSA-N
CN(CC1CCNC1)CC2=NN=C(C=C2)NCC(CC)(CC)C3=CC=C(C=C3)F,C90EBC9BBFEAD85D_7D574BA7AF182C66_6041_DP,8.18754,00000000000000000000000000000000000000100010000000001000000000000110000000000101101101110011011010101000100110011011101011101100110101110110011001011101010110101111010,DAGFVPNNLDOHJH-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(CC)CCCCCC2)Cl)C3CC3,1F03E797BF788EFB_1762D064AB750938_7022_UN,7.160657,00000000000000000001001000000000000000000000000000000000000000100010000000000000001000010011000000001001000110001010101000000000110001110000000010010111010110101111010,AHNIJBRQKCEKJM-UHFFFAOYSA-N
O[C@@H](CBr)C1=CC=C(C=C1)C2=CC=C(C=C2)NCC3CC4(C3)C5CCC(C4)C5,390236CD0594F5B7_30D28F5AE3842588_6041_UN,8.009078,00000000000100000000000000000000000000000000001000000000000000100010000000000000001000000010000010001000110000001000001000000100110111110011000001010001110111100111110,VZRNDTNCNISEMN-SEEQJNJMSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4CC(OCC4)C5=CC=C(C=C5)F,34812B7C57788781_08D1E6E879ACE4C9_6041_DP,8.293352,00000000000000000001000001000000000000100010000000000000010000100100000000000100100101010011010011100000111101010000101011100100110111110100001001011001110011101111110,KODQCWATFZRURX-QLKRIMAFSA-N
N(CC12CC(C1)CO2)C(=O)C4=C3C=C(C=CC3=NC(=C4)C5CC5)F,8D0C24B4401A0F12_CF6E81360153E5E8_6038_UN,7.82252,00000000000100000000001000000000000000000010000000000000010000100110000000000000001100010011100110101100010101101000010011000100110010100110001001010001111111110111110,MDUBLJQXRYIWLS-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CC=N2)NC(C3CCCO3)C4=CC=C(C=C4)F,4EC45E8D7E999BD0_8F51A142629008C3_6041_UN,7.7785625,00000000000000000000000000000000000000000010000000000000010000000100000000010001100101010011010110100100010101000000001011100100010011110100001001011001110011101111110,YMHZWLVVPWPRKQ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)N[C@@H]2C[C@H]3CC[C@@]2(C3(C)C)C)C4OCCO4,A4339FCA817000D6_DE51F6C0D0C16E6A_6041_UN,7.5026507,00000000000000000000000000000000000000000010000000000000010000100010000010100000000100010011000010000000110111011001101010010000110011110110010011010111010011111111110,QDXJLLVTRKQCDD-FXHACXQTSA-N
N1C[C@H](CO1)[N]2C=C(C=N2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,4B1E07637006AAB7_3643F5B777E94727_6041_DP,8.708384,00000000000000000000000010000000000000000010000000001000010000100100010100010001101101110011011111001010100111010001101011101100011111110110001010011011010011101111110,IASHSWUXRPBGMC-XYPHTWIQSA-N
C[N]1C=C(Cl)C(=N1)C=CC2=CC(=C(C=C2)C3CC3)C4CC4,A9ABED6037CA01E8_D1A35147F65E368B_7019_UN,8.652314,00000000000000000000001000000000000000000000000000001000000000100100000000010000100100010000011010010001000100000000001011101100000000100100001010011010000010101111010,BUZYRHKDRGHDCU-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3=NN=C([N]3C)C4CNCCC4)Cl,8095DC2852140CF8_C54896A5F5E95955_6034_UN,8.140681,00000000000000000000000000000000000010100000000100001000000000100100000000010111111101111011011010101001101110010000101111101100110101110110001011011111010110101111010,DILISFPRYBKGHA-UHFFFAOYSA-N
O([C@@H]([C@H]1NCCC1)C2=CC=CC=C2)C3=CC(=C(C=C3Cl)C#N)C,5BC3804FACDA13B1_6E5F3A900AD3CCA6_6035_UN,7.8411174,00000000000000000000000000000000000000000100000000000000000000000000000000000000001100010011000110001001100100010100001001000111010000100100001111010011110011101111110,QRHORDNNZFMCNZ-PKOBYXMFSA-N
C[N]1N=C(C=C1NCC(N2CCOCC2)C3=CC(=CC=C3)F)C4CCCC4,DD4A426FC404F8CF_FCFB6F3B47EF7F1B_6041_UN,7.9285398,00000000000000000000000000000000000000100010000000001000010000100100000000010101101101110001011110101000000111010000001011101100110011110110001011011011010111101111110,RQONKJFSGPDUOD-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(C)CC2)F)CC3,7CDCC884BF1D3BD4_1D581DC976A5EFC5_6041_UN,7.839299,00000000000000000001001000000000000000000010000000000000000000000010000000010001101001110011010000001000000110011001101011100000110001110110001010011111010110101111010,YYBPMYVCBNNYQS-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4)C5CC5,8D3148D43582308D_DBCD3C7FA503F62A_6041_UN,7.9555516,00000000000000000000001000000000000000000010000000000000000000100010000000100000001000010011000000001100010100001001101000000100110001110000000011010111010110101111010,HHXFYWPRHLXWFD-UHFFFAOYSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(=O)CC4=C(C=C(C=C4)F)F,3EF97F1026A7FCC1_33EA91460B2CFD2D_6038_UN,7.33154,00000000000000000000000000000000000000000010000000000000010000000000000000000000000100010001100011000100110100110000011000000100000011110100000011010011101111110111110,FEXULMMXYATJJC-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(CN(C)C)CCCCC3)C4=CCNCC4,BE59C55E257CC74B_B5F866D853589845_6034_UN,7.755475,00000000000000000000000000000000000000000010000000100000000000100110000000111000101101110001010010111100110110011001001011100100110000100110001001011101010110101111010,AXRCZOCOZISWOJ-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCC(O3)C4=CC=CC=C4,8B4B080CA9D8A519_9D3128C647BA95FF_6041_UN,7.961947,00000000000000000000000000000000000000000010000000001000010000100100000000010000101100010011011110001100010100000000001011101100110011110100001001011001110111101111110,BODIWPYDKWQDQI-UHFFFAOYSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(=O)C[N]4C=CC5=C4C=C(C=C5)F,37193E8BC90A6B78_C266333E04B8DC87_6038_UN,7.635583,00000000000000000000000000000000000000000010000000000000010000000100000000010001000101010001100111001100110100110000011011100100000011110100001011011001111111110111110,COLWIMUTVZFSHW-UHFFFAOYSA-N
FC1=CC=C(C=C1)C(CCC=C[C@@H]2CCCO[C@H]2C3=CC=N[N]3C)C4=CC=C(C=C4)F,6910385E13764E92_AB3211836B778938_7019_UN,8.184141,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010000011111110000000101000000001011101100100010100100001011011010110111101111110,IZBYTJOKQJNOCC-QFQXNSOFSA-N
CN(C)CC1=C(C=C(C=C1)NCC2CC3(OCC2)CCOCC3)F,5284CB6BEA92F285_1BD2451F66D66507_7022_UN,7.1760526,00000000000000000000000000000000000000000010000000000000010000000010000000100000001001110111010000101000010101001001001010100000110011110110001011011111110111111111110,JMLVLPWQAIMWRC-UHFFFAOYSA-N
FC2=C1C=CC=CC1=C(N=C2)NCC3CCCN(C)C3C4=CC=CS4,71A3FF5346C976DF_806AB631B8A1D4D5_6041_UN,8.273662,00000000000000000000000000000000000010100010000000000000000000100100000000010100111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,REDFHILSZMYCJI-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(CCCCCC2)C3=CC=C(C=C3)Br)Cl)C4CC4,1B95FE31C4F9F56F_877801264C60EA40_7022_UN,7.75834,00000000000000000001001000000000000000000000001000000000000000100010000000000000001000010011000000001001000110001000001000000100110001110000000011010011010110101111010,FPFVWBPUSBQRAL-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCCSC3,BA2A75F68CDE7BDA_245B97BD36F21F6B_6041_UN,7.5850024,00000000000000000000000000000000000010100010000000000000000000000100000000000100001000111011000000101100010110000000001011000100110001110110001011010111010110101111010,IHKOTERYDQZGQB-UHFFFAOYSA-N
CN1C(COCC1)CCOCC3COC2=CSC=C2O3,37B1E86EC85AF077_FE9CAB352CED3483_6039_UN,8.1026,00000000000000000000000000000000000010000000000000000000010000000000000010010000000101101100010111101100010011010101101011100010110010000110100011111010110111111111110,KKYBOBVQQCNJDF-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(C3=CC=C([N]3C)C4=CC=C(C=C4)F)=O,1B708E0DB98D72B2_E4E97C5D14B6E192_6038_UN,7.7783556,00000000000000000000000000000000000000000010000000000000000000100100000000010001001101010010110110001100010100100000011001100100110000100100001011011011011110101111110,QHDQCAKLTMBAJO-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)C4=C(C=CC5=C4OCO5)F,C382EBDCC274CF5E_43D1ECBB16FC7EBF_6004_DP,8.298598,00000000000000000001000000001000000000100010000000000000010000100100000010000101100101010011010011100100110101010100101011110100110001110100001011011011110011111111110,WSXIMMLXDZJHBQ-CLLJXQQHSA-N
CN1CCC(CC1)[N]2N=CC3=C2N=CC(=C3)NC4(CCCC4)CC5=C(C=CC=C5)F,70329232C9BDD6AC_375D769F03133562_6041_UN,7.7816296,00000000000000000000000000000000000000100010000000001000000000100110000000010101100101110011011010101100110100011001101011101100110001110110001011011011010110101111010,UKWFVMSAWPXJLT-UHFFFAOYSA-N
CC1=C(N=C(N1CC2C(F)(F)C23CCC3)C4CCCN4)C5=CC=CC=C5,C9191A81A16CEDC9_EA645E594333B11A_6034_UN,8.184165,00000000000100000000001000000000000000100010000000000000000000100110000000010101001101010011000010001000110100011000101011100100110000100110001010011011010110101111010,HPTYOSIPGZVAQZ-UHFFFAOYSA-N
CN(C)C1=C2C(=CC=N1)C(=CC=C2)N[C@H]3C5=C(OC4(C3)CCCC4)C=CC(=C5)F,F3DBA8A549A06A99_1DB55FE717114C8C_6041_UN,8.002571,00000000000000000000000000000000000000100010000000000000010000000110000000100100000001110001010011100100110100011100001011100100110011110100001011011101100011101111110,DXRHFQXHTILDDE-OAQYLSRUSA-N
O(C(=O)[C@@H]1COC[C@H]1C(F)(F)F)CC3=CC2CCC(N2)C3,C89DCC1761E5EDC1_3B09145D36F09E97_6031_DP,7.5132384,00000000000000000001000000000000000000000010000000100000010000000000000000001000000100100111000010110000111101011000001011010010110000100110000000110011011111110101110,HGABTHABTHXZKT-KIDURHIOSA-N
FC1=C(C2=C(C=C1)C=CO2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,5D5331C45AF9693C_37D58FE6C2EDAC82_6041_UN,8.174162,00000000000000000000001000000000000000000010000000000000010000000010000000100000001100010011000110001100010100001001101000000100110001110100000011010111110110101111110,LKCCTYXPOUBTLH-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC3CN(CC2=CC=CC=C2)C4(C3)CCCCC4)Cl)C5CC5,635B55B23359B534_4B1984B6CA4DDE76_7022_UN,7.924821,00000000000000000000001000000000000000000000000000000000000000100010000000010001100101110001000010001001110110011000001001100100110001110110001011011011010110101111010,JTTYSOOVFOQQIY-UHFFFAOYSA-N
FC1=CC=C(C=C1)[N]4N=C(C=C[C@@H]2CCCO[C@H]2C3=NC=C[N]3C)C5=C4CCC5,CBB4A7BCB837FAB0_37C0424FF7DD222D_7019_UN,8.025461,00000000000000000000000000000000000000100010000000001000010000100100000000010101100101010000011110110100010101010000001011101100110011110100001011011010110011101111110,UDABLWJTYKKRNG-KSFYIVLOSA-N
C[N]1N=C(N=C1N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)C4CCOCC4,B61F24EE670A1D9C_2F6D9ED0692BB3F5_6041_DP,8.519981,00000000000000000000000001000000000000100010000000001010010000100100000000010101101100110011011010101000101101010000001011101100110111110110001011011011010011101111110,YDHBRMDPEGDSQI-RHSMWYFYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC4(CCC4)C5=C(C=C(C=C5)F)F,2B314E4F63E75FE7_94F9EF4B7FC83C5E_6041_DP,8.185539,00000000000100000001000000000000000000100010000000000000000000100110000000000101100101010011010010100000110100011000101011100100110101110100001011011011000010101111010,QTWIDWACKGVGCE-BJWYYQGGSA-N
NCC3(COC1=C(C(=CC=C1)C2CNCCC2)F)CCC3,9F047E9377397ED9_3DA4FC6D6D86A1AE_6035_UN,8.273169,00000000000100000000000000000000000000000010000000000000000000100010000000000000001010110011000001101000100101011100001001000011110100100110001111010011110101100111110,JDBSNBXGQZRVLC-UHFFFAOYSA-N
N([C@@H]1CCO[C@H]1C2=CC(=C(C=C2)F)F)C(C3CC4CNCC3C4)=O,EA5F5DCEC6C5F3CC_D39B91B16FFFE2D2_6038_DP,7.636979,00000000000000000001000000000000000000000010000000000000010000100000000000000000001100110011100111101000110101110000011011000000110111100110001011010011111011110111110,DGFQOSQZTRVVJT-DUMKKMALSA-N
N([C@@H]1CCO[C@H]1C2=CC(=C(C=C2)Cl)F)C(C3CC4CNCC3C4)=O,75C70608935E5250_E416E3067CAC79EF_6038_DP,7.636975,00000000000000000001000000000000000000000010000000000000010000100000000000000000001100110011100111101001110101110000011011000000110111100110001011010011111011110111110,ZBUGWNMMVVSLLQ-DUMKKMALSA-N
FC1=C(C=CC=C1)C2=NC(=CO2)C=CC3=C(C=N[N]3C)C4CCC4,97232F0A0B1270F0_A66612614333C2A3_7019_UN,8.574052,00000000000100000000000000000000000000000010000000001000010000100100000000010000100100010000111110010000000100100000011011101100000000100100001010011010000010101111110,IFKUVHOMVBXEDS-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2=NC=CO2)C=CC3=CC[C@@H]4C(C)(C)[C@H]3C4,87E171C22ECECA75_F0BCBA02006D6D55_7019_UN,8.210358,00000000000100000000000000000000000000000010000000100000010000100110000000101000000100010000100110010000010100101000110011000100100000100100000011000110000010001111110,IDISKGYDSDICMI-IRXDYDNUSA-N
C(C1(CC1)C2CCCO2)=CC3=C[N](N=C3C)C4=CC(=CC=C4)F,32802E531DE91420_21F6850D65929D99_7019_UN,8.241276,00000000000000000000001000000000000000000010000000001000010000100110000000010000100100010000001010010000000101001000001011101100110011110100001010011010110011101111110,URNAGTVDVAPYEY-UHFFFAOYSA-N
O([C@@H]1CN[C@H]2COC[C@@H]12)C3=C(C=C(C=C3)C(F)(F)F)C#N,472E854E145666D2_59DCEAEEE1FDEA26_6035_UN,8.696558,00000000000000000000000000000000000000000110000000000000010000000000000000000000001100100111000111001100111101011100000011000011110010100110001110000011110011110111110,QAXVLBGHCLCDHZ-NTZNESFSSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CCOCC2)N3CCCC3)F)CC4,9E58F4FB6C7CC2F5_7E8F07FF2D65843A_6041_UN,7.8268785,00000000000000000001000000000000000000000010000000000000010000100010000000010001101101110011010011101000000111011001101011100000110011110110001011011011010111101111110,DKNAJUKJPJMXJP-UHFFFAOYSA-N
CC1CNCCC1C=CC2=C([N](N=C2C)CC3=C(C=CC=C3Cl)Cl)C,5A00C63AAEBBBC63_13550B20C3A9B460_7019_DP,8.939474,00000000000000000000000000000000000000000000000000001000000000000100000000010000101100110001001010111001100110010001101011101100110000100110011011011111010110101111010,WVRPQZQPRYXPQQ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC(N(C)C)C2CCCCC2)F)F,B1F201A9B413AACB_CE8C91EDDA906FD1_6041_UN,7.8674273,00000000000000000000000000000000000000000010000000000000000000000000000000100001001001110001010000001000000110010000101000100000110001110000011011011111010110101111010,KVZZRLBNWMINKM-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)C5OCCO5,25D3E2B62D673F67_1128698D8C3465EF_6041_UN,8.049185,00000000000000000000001000000000000000000010000000000000010000100100000010010101101101010011010010101000000101010000001011110100110011110110001011011011010111111111110,HUKDZYGLUMQEFH-VFNWGFHPSA-N
CCN4CCC1=C(C(=CC(=C1)NC3(CC2=CC=C(C=C2)F)CCCC3)F)C4,738BCF4C806B90EC_CC13B7EDA5C91C8C_6041_UN,7.7133822,00000000000000000000000000000000000000000010000000000000000000000010000000010000000001110011000010101100110110011010101001100100110001110110001011011001010110101111010,NMLGXJQVULFNIP-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NCC3(CCCCC3)C4CCCCC4,11B02D68AF579164_F5C8B9E02ACF7425_6041_UN,7.6408677,00000000000000000000000001000000000000000010000000000000000000100110000000010101001101010011010010001100011110001000001011100100110001110100001011011011010110101111010,MGEQKBZJTGRNQK-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NC2=CC=CC(=C2)C3CCN(C)CC3)C4CC4,E6FD4EF5B1E530C3_A9EB78266E52411A_6041_UN,7.7777505,00000000000000000000001000000000000000000010000000000000000000100000000000010000000001110001010000101000000100010001101001100100110001110110001011011011010010101111010,LOWZOJPNSUJJBE-UHFFFAOYSA-N
FC1=C(C=CC(=C1)NC[C@@H]2CCCN(C)[C@H]2C3=CC=N[N]3C)OC4CCOCC4,2974112BD5C998EB_DF62BB4E2EF45464_6041_UN,8.034021,00000000000000000000000000000000000000000010000000001000010000100100000000010001101101110111011010101000000111010101101011101111110011110110001111011111110111111111110,VOIQTWQWZMEKMU-KSFYIVLOSA-N
FC1=C(C(=C(C=C1)C#N)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)F,82DA061A2C38FD16_F42DD104B1BC9013_6041_DP,7.587771,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110100111010,JYPWDPNKMVCGEF-GOEBONIOSA-N
N1C[C@@H]2C[C@H]1C[C@H]2OC4=C(C3=CC=N[N]3C)C=C(C=C4)F,274C6FF8204A0EB6_D5FEA910D3DF9731_6035_DP,7.739955,00000000000000000000000000000000000000000010000000001000000000100100000000010000101100010011011011101000110100010100000011101111110010100100001111001011110011101111110,DBCMZQOPBUUOAX-KNHMANMVSA-N
CC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]4[C@@H](CNC4)F,53DEEBBA0705EBBD_FD9C95A2D0BEEC13_6034_UN,8.19737,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010001000100100010000001011100100110100100110001010011011010110101111010,SPTQRBRLVFCPCH-RTKIROINSA-N
CC1=C(C=C(C(=C1)NC2CCC(CCC2)C3=CC=CC=C3)Cl)C4CC4,D30C3A56E829E4E3_B0B0BA0277928266_7022_UN,7.8071394,00000000000000000001001000000000000000000000000000000000000000100000000000000000000000010011000000000001100110010000001000000100110001110000000011010011000010101111010,QPJXDJATHVCSIT-UHFFFAOYSA-N
FC2=C1OC=CC1=C(C=C2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,15D42D5442D681F2_D92D79B1C9B87DE4_6041_UN,8.252255,00000000000000000000001000000000000000000010000000000000010000000010000000100000001100010011000011001100010100001001101000000100110001110100000011010101110110101111110,GDARUQVXGBROOW-UHFFFAOYSA-N
FC1=C(C=C(C=C1)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)CC#N,B8A12A641C228090_1CFE3CA1D1BCB1F2_6041_DP,8.012405,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,MPEHTQJCMQXSGI-DNVCBOLYSA-N
FC1=CC2=C(C=C1)N(C=C2C3=CCNCC3)C[C@H]4N(C)CCOC4,5C60EBFE5AF6BC84_A1F4768DFD70D3FB_6034_UN,8.103141,00000000000000000000000000000000000000000010000000100000010000100100000000011001001101110001010111111100110101010001101011100100110010100110001001011011010111101111110,LDLRNZNBNSMIHU-MRXNPFEDSA-N
N(CC1CC2CCC(C1)O2)C(C4=CC3=C(C)C=C(C=C3[NH]4)F)=O,FE0B3DD5C3917ABA_C370C351236997AF_6038_UN,7.9993296,00000000000000000001000000000000000000000010000000000010010000000100000000000001001100010011100110101100010100100000011011000100110110100100001001010001111111111111110,XGTRARNFRVEBSX-UHFFFAOYSA-N
C[N]1N=C(C=C1NC3(CC2=C(C=CC=C2)F)CCCCC3)C4CCCC4,67A5514C8B1716D9_6421AA4E1FDA43D9_6041_UN,7.7669954,00000000000000000000000000000000000000100010000000001000000000100110000000010101100100010011011010000000100100011000001011101100110001110100001011011011000110101111010,XLLILSUSHUMHKY-UHFFFAOYSA-N
O(CC1CCCN1CC2=CC=CO2)CC34OCC(C)(CO3)CO4,4EEC57A565AEA26F_664AD83C66A0C43E_6039_UN,7.328458,00000000000000010000000000000000000000000000000000000000010000000010000010010000000101100100000110101000011001011001001011110010110010000110100001111010110111111111110,IWAWGSCPWZHGGA-UHFFFAOYSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(=O)C=CC4=CN=C(C=C4)F,D48C5E2A48521B08_63E69D6E8EFFC51F_6038_UN,7.958371,00000000000000000000000000000000000000000010000000000000010000000100000000000000000100010001100011110100010100100000011011000100000011110100001011010001101011110111110,TTZZFHHFMLORJS-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)F)NCC[C@@H](C)OC2CCCCO2,DA2F1E0FCA7B92EF_251E8C741C4BCF73_6041_UN,7.6979723,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000010000000001101000100111010001101000010011110011110110000111010111110111111111110,NZKGFDZKVLEWTO-KEKZHRQWSA-N
FC1=C(C=C(C=C1)NCC(OC)C2CCOC2)C3OCCO3,0F216FB2C5839590_850029C8900DD5BA_6041_UN,7.2767835,00000000000000000000000000000000000000000010000000000000010000100000000010000000001100110101010110001000000111000000101010010010110011110110100010110011110111111111110,DHUNCSDVTKGPMY-UHFFFAOYSA-N
C4CC1=C(N(C=N1)CC(OCCC)C2=C(C=C(C=C2)F)C)C3(CCOCC3)N4,D8609FE46681D2DB_15855B01EB1A4F50_6034_UN,8.148664,00000000000000000000000000000000000000000010000000000000010000000110000000010101101101110011000111101100110111011011001011100110110010100110001011011111110111111111110,TYQISLVRZXQVIE-UHFFFAOYSA-N
C[N]1N=C(C=C1N[C@H](CC)C2=CC(=C(C=C2)C)F)C3CCCC3,A5DE49C6DD0DED58_F94BE8586D52D4A8_6041_UN,8.463632,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010000011010000000100100010010001011101100010001110100011010011111000110101111010,HWROOINLERXHTP-QGZVFWFLSA-N
FC1=CC(=CC(=C1)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F)CC#N,D8098951B29E678F_C5B27BF874EB8983_6041_DP,7.368591,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001001010011010110100111010,NXWBNVZEUYSJLY-RTBURBONSA-N
C2(=N[N](C1CCCCO1)C3=C2C=CC=C3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,A21FAA8C88B4D1F8_14166B8F542C64E7_6041_UN,8.315128,00000000000000000000000000000000000000100010000000001000010000100100000000010101100101110011111110101100110111110001111011101100110011110110001011011011010011101111110,QNRCPABMCOEHNC-QOMKKIOMSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)N[C@H]3[C@@H](C)CCCC3,E68FA8EAF24D8F58_0292E16E291A5547_6041_UN,8.612458,00000000000000000000000000000000000000000010000000000000000000000100000000000001000000010011000000100100110110010001101001000100110001110100001011010111000010101111010,OTFLESWJSHCUSA-XHDPSFHLSA-N
CCNC5CCC1=C(C4=C(N1CC2CSCC(N2)C3=CC=CC=C3)C=CC(=C4)Cl)C5,90878B77475E4767_2AC9E429702DCB7B_6034_UN,7.8255568,00000000000000000000000000000000000010000000000000000000000000100100000000010001001101111011000010101101110110010010001011100100110101100110001011011001010110101111010,IVFBBZIUMSARPL-UHFFFAOYSA-N
N4C[C@@H]3CN(CC1=NC=C(N=C1)NC(CC)C2=C(C=CC(=C2)F)F)C[C@]3(C)C4,5320A5227374E99E_8EB2AA70C29C6F1F_6041_DP,8.663311,00000000000000000000000000000000000000100010000000000000000000000110000000010101101101110011000010101100110110011011100011100100110101110110001011001111010110101111010,DDJVRYYVRLGWJW-NUOIPDLJSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(CC)CCCCCCC2)F)CC3,AD2A76F0B65BD675_4802F11F253A2211_6041_UN,7.527384,00000000000000000001000000000000000000000010000000000000000000000010000000010001101001110011010000001100000110011011101011100000110001110110001010011111010110101111010,TYZZHPJWXPWVKN-UHFFFAOYSA-N
CC[N]1C=CC2=C1C=C(C=C2)NCC(N3CCN(C)CC3)C4=CC=C(C=C4)F,130BC13C72D1EF36_96330686AD6F8785_6041_UN,7.8665504,00000000000000000000000000000000000000000010000000000000000000000100000000010001101101110001010010101100010100010011101011100100110001110110001001011101010110101111010,KGFZHZKLXYOAMW-UHFFFAOYSA-N
N(C2C1C3CC4C1CC5C2C3C45)C(C6=C(C=CC(=C6)N[S](C)=O)F)=O,B040EB34959B1A05_969271372FDFD47A_6038_UN,8.674211,00000000000100000001000000000000110000000010000000010000001011000001010001000000000000011001111010000110010100100000010000001000111101111000001011001011001010111111110,GSOWEDMQVJCSPY-UHFFFAOYSA-N
CN1CCC(CC1)OC2=CC(=NC=C2)N[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,0A121D47ECCE65F4_1AF7654A9AF7C43A_6041_UN,8.055869,00000000000000000000000000000000000000100010000000000000010000100100000000010100000101110011010111101000100101010101101011100111110011110110001111011011110011111111110,APLLORLVMYZJFY-CTNGQTDRSA-N
N3CCCC(C=CC2=C([N](CC1CCCN1CC)C(=C2)C)C)C3,80FBDE70301C11C1_335DC55BDDCD3470_7019_DP,8.693736,00000000000000000000000000000000000000000000000000000000000000000100000000010001001101100011000010111000100010010010101011100000110000000110011010011111010110101111010,NLYVHTVMSURRTN-UHFFFAOYSA-N
NCC3(OC1=C2C(=CC=C1)CNCC2)CCC4=C3C=C(C=C4)F,1BD07C40011EE335_0FBCEA2401D767BC_6035_UN,7.611367,00000000000000000000000000000000000000000010000000000000000000000010000000000000001010110011000110101100110100011100001001000111110110100110001111010001110101100111110,HUIGMNZMJCOJBB-UHFFFAOYSA-N
OC(CF)C1=CC(=CC=C1)NCC2C(CCNC2)(C)C,2F52745B4840B637_FB98C3A5D68E8075_6041_DP,8.535393,00000000000000000000000000000000000000000010000000000100000000000010000000100000101000100011000000101000100000011001101001000000110111110111001001010111110111101111110,MQFQLQPFLFNPPN-UHFFFAOYSA-N
ClC2=C1C(=CN(C1=NC=C2)CCCNCC(C)(C)C)CC3=CC=CC=C3,315301047475A06A_8695EC296EF0D133_6034_UN,8.4056015,00000000000000000000000000000000000000100000000000000000000000000110000000110100101101110010000010101101110110011001001011100100110000100110011001011101010110101111010,JSYIHFUUGIGFGU-UHFFFAOYSA-N
CN(CC1CNC1)CC2=NC=C(N=C2)NCC(C)C3=C(C=C(C=C3)F)F,1367DD4E95B4A38E_99B48F099E206E15_6041_DP,8.094653,00000000100100000000000000000000000000100010000000000000000000000100000000000101101001110010010000101000000110010001000011100100100101110110001011001111010110101111010,RBFZSPHCBBGDAC-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=CC3=C(N=C2)CCOC3,F30B51463D3A0FBD_B226C3553B32A5C2_6041_UN,7.435223,00000000000000000000100000000010000000000000000000000000010000000100000000100001000000100001010001100100010001011000001011000100110011010110011011011111010011101111110,TUWORGPPUXUCOK-UHFFFAOYSA-N
NCC3(OC2=C1N=CC=C(C1=CC=C2)Br)CCCNC3,303A0614DE0161A6_15C6E8D92885E5F9_6035_DP,7.95722,00000000000000000000000000000000000000000000001000000100000000000110000000000000101010110011000100101100110100011100001011000111110110100110001101010001110111100111110,DDOALJDIJWBCFK-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCNC3(C2)CCC3)Cl)C4CC4,43129760694BFAAD_0D293D519B0E5605_7022_DP,7.6444635,00000000000100000000001000000000000000000000000000000000000000100010000000000000001000010011000000101001110110011000001001000000110101110110001011010011010110101111010,BCNJSIGNEDMRDZ-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3(CC)CCCN3)Cl,5D2488B5429D4C80_78DD0CA54D73434D_6034_UN,8.042375,00000000000000000000000000000000000010000000000100000000000000000110000000010111011101011011000010001001101110011010101111100100110101110110001010011111010110101111010,PDKZCKZAWYQSEN-UHFFFAOYSA-N
FC2=C(C=C1C=COC1=C2)NCC4(N3CCN(C)CC3)CCCCCC4,E57E986AE0055272_9DC14BEBE1A44024_6041_UN,7.396251,00000000000000000001000000000000000000000010000000000000010000100010000000010001001101110011010010101100010100011001101011100100110001110110001011011011110110101111110,QTPZHJIJFPWRSV-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCCC2=NC(=CC=N2)C3CC3,96FD8A8FA25707B8_A71DF1330483EF30_6041_UN,7.854917,00000000000000000000101000000010000010100000000000000000000000100100000000100100111100101000010010101000100000011000001011000100000001010100011010011111010110101111010,LUMNOUKMBRUVBU-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NCC2CNCC3(O2)CCC3,93DEF326A56FF8D9_5608F632E3C4A19F_7022_DP,7.24424,00000000000100000000100000000010000000000000000000000100010000000010000000100000101000100011010100101000010000001000001011000000110111010110011001011101110111101111110,ZUOJKUKTHLOOSV-UHFFFAOYSA-N
N(CC1C3CC2CC(CC1C2)C3)C(=O)CCC4=CC(=C(C=C4)Cl)F,5FD573712ADFCE07_0623B39E9DD2A03D_6038_UN,7.5031085,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000001101110100110000011000000000110010100000000011010011011110100111110,LRILJGFYVYBSAC-UHFFFAOYSA-N
N(CC1C3CC2CC(CC1C2)C3)C(=O)CCC4=CC(=C(C=C4)Cl)Cl,8D4EE3621D686791_177E081708B8EB66_6038_UN,7.5031023,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010011100000001101110100110000011000000000110010100000000011010011011110100111110,AMYHMCAZWFOPJA-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)C[C@@H]3[C@H](C)CCCN3)CC#N)F,87669F2F0C93A0CE_DEA1BF8542714F85_6034_UN,8.080194,00000000000000000000000000000000000000000110000000000000000000000100000000010001001101010011000010101100110110010001101011100100110000100110001011011011010110101111010,AMXARFCJDYYUNX-BDJLRTHQSA-N
N(CC1C3CC2CC(CC1C2)C3)C(=O)CCC4=CC(=C(C=C4)Br)Cl,E770629E75659029_6D279502CB4BA22E_6038_UN,7.503085,00000000000000000000000000000000000000000000001000000000000000000000000000000000001000010011100000001101110100110000011000000000110010100000000011010011011110100111110,YYFRPLCLVOGPTF-UHFFFAOYSA-N
C[N]1C=CC2=C1C(=NC=C2)NCC(N3CCOCC3)C4=CC=C(C=C4)F,39C5B8B98FAA1437_75BF65FEAE545157_6041_UN,7.3464537,00000000000000000000000000000000000000100010000000000000010000000100000000010101001101110001010110101100010101010000001011100100110011110110001001011001010111101111110,RVOXOGBPOBHXLF-UHFFFAOYSA-N
C(C2=NC1=C(C=CC=C1)[N]2C35CC4CC(CC(C3)C4)C5)=CC6=C(C)[NH]C7=C6C=C(C=C7)F,F47FB5B7F21DA1EA_6AF9B7E089C1D6E7_7019_UN,8.041619,00000000000000000000000000000000000000100010000000000000000000100110000000010101000101010000000010010100010100011000000011100100100001100100001011001011000010101111010,BWEAPOYYFZMAPS-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC3(CC3)C4=C(C=CC=C4)F,52253A4F88D9A79C_A76B33BC3B6C9C5B_6041_DP,7.6773844,00000000000000000000001000000000000000100010000000000000000000100110000000010101101101010011010010101000100110011000001011100100110101110100001011011011010010101111010,RWOYSLREQPVJEA-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@H]2[C@H](C(C)C)CC[C@H](C2)C)Cl)C3CC3,EA9248ED4E50A890_499AC0EA8E747FB2_7022_UN,8.425824,00000000000000000000001000000000000000000000000000000000000000100000000000100000000000010011000000000001100110010001101000000000110001110000010011010111000010101111010,DWAQGHRNYRVVBK-ACWOFJMJSA-N
C1(=CC2=C(C=C1)C=C(Cl)C=C2)C4=CC3=C(CCCC3)NC4=O,7800FBA7DB49FFEB_D4367EE011228F5B_6008_UN,9.219786,00000000000000000000000000000000000000000000000000000000000000100100000000000000000000010011100000100101110100110100011001000101110000100100000111010011001010000111110,ZRFJUXJBNSKNQC-UHFFFAOYSA-N
N5C[C@@H]4CN(CC1=NN=C(C=C1)N[C@@H]2CCN(C)[C@H]2C3=CC=C(C=C3)F)C[C@]4(C)C5,3071D5953336756B_50E072A71E74CA9B_6041_DP,8.317472,00000000000000000000000000000000000000100010000000001000000000100110000000010101101101110011011010101100110110011001101011101100110101110110001001011111010110101111010,UBFCWKQJIIZYMC-QRRACGJLSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)N[C@H]3[C@@H](C3)C4CCCCC4)C,FB3585A336C1CFA0_013332482879E0ED_6041_UN,8.475765,00000000000000000000001000000000000000000010000000000000000000100100000000000000100000010011000000100100110100010000001001000100110001110100001011010111000010101111010,RMAOPEGSPFYRBS-FUHWJXTLSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2CC3(C4(C3)CCNCC4)C#N,FA0EBA13C769D93F_6A686F732CD8D3F6_6034_UN,7.7406774,00000000000000000000001000000000000000000100001000000000000000000110000000010000101101110001000010101100110100011000101011100100110000100110001011011111010110101111010,ABHCOWHVRICOGU-UHFFFAOYSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NCC3(CCCC3)C4=CC5=C(C=C4)OCCO5,46769DFD1AC0993E_11F16256E08B237D_6041_UN,7.9252605,00000000000000000000000001000000000000000010000000000000010000100110000010010101001101010011010010101100011111001100001011100100110011110110001011011011110111111111110,WTNDWVAAUZFGTN-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)NC(CCC)C2=C(C=CC(=C2)F)F)C3[C@@H]4CNC[C@H]34,06C150C3CB1D71B4_49EBB781A021A829_6041_DP,7.8276415,00000000000000000000001000000000000000100010000000000000000000000100000000000101101101110011010010101000110110010011001011100100110101110110001011011111010110101111010,YLTRUYGVGWGLTP-OSHAMATESA-N
CN(C)CC1=C(C=C(C=C1)NCC2(CCC3(CC2)OCCO3)C4=NC=CC=C4)F,210D19AF73A00C38_45215273BB7151FC_7022_UN,7.9250603,00000000000000000000000000000000000000000010000000000000010000100110000010100000101101110011010010101000010101001001001011110100110011110110001011011111110111111111110,ZGTPXIZEWGDRRB-UHFFFAOYSA-N
O(C(C#N)C1=C(C=CC(=C1)F)F)CC3OCC2(CCNCC2)C3,7FB5BD17E01397F0_1A2576551597ADFE_6039_DP,7.6668544,00000000000000000000000000000000000000000110000000000000010000000010000010000000001100110001000110101000110101011000001011000010110010100110001011010011110101110111110,MVNORCNOVQKUEL-UHFFFAOYSA-N
CC1=C2C(=C(C=C1)C)[C@H](CCO2)NC(=O)C45CC3(F)CC(F)(CC(F)(C3)C4)C5,BE8045AA61138322_0B83292BEE27DFAD_6038_UN,7.9744034,00000000000000000000000000000000000000000010000000000000010000000010000000000000000000010010100001100100110111111100011000000000100011100100000011010101111011111111110,FZOYSGXQRAAQTN-QITFCLPUSA-N
FC1=C(C(=CC=C1)C2CC2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=N[N]4C,E3F3EFDB27D499DD_5EB88F11BC56E95B_6041_UN,7.8699646,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101110011011010101000000110010001101011101100110001110110001011011111010110101111010,PKUVUCLVIDQTAV-MGPUTAFESA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3CNC(CO3)(C)C,2E3470C09DE505AD_F77B7762D1C7143C_6041_DP,8.129497,00000000000000000000000000000000000000000010000000000100010000000110000000100001101000010011000100101100110111011001100011000100010111110110011011000111110111101111110,ROOVSKAWPYXZGH-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC(NC)C3=CC=C(C=C3)Cl)C4CCNCC4,30C5093EDFAED087_98AF9C6F1C7BA6D0_6034_UN,8.929308,00000000000000000000000000000000000000000010000000000000000000100100000000010001001101110001010010101101110100010000101011100100110100100110001001011001010110101111010,FDHPDFBAYDJEJA-UHFFFAOYSA-N
OC3CCCC(C=CC1=C[N](C)N=C1C2=C(C=CC(=C2)F)F)C3,62E2068A7654A690_629A5FAD11EA5E61_7019_UN,8.36839,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010011011010010000100100000000001011101101110010100101001111011010100011101111110,ROAUJXWWTPPSGX-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)C2OCCO2)C)NC3C4CC(C3)C(C4)F,496FCF969238669B_8F7079DC0C4F5AE9_6041_UN,7.629526,00000000000000000000000000000000000000000010000000000000010000100000000010000000000100010011000010000000110101010000001010010000110011110110000011010111010011111111110,YGIATJZISAPRCT-UHFFFAOYSA-N
N(C1C2CC3CC1CC(C2)(F)C3)C(C4=C(CC)C=NC=C4)=O,1852F6A0669D2E28_07694FB195DEE2DC_6038_UN,7.766682,00000000000000000000000000000000000000000010000000000000000000000110000000000000000000010011100000100100010100101010010001000000100001100100001011000011001110101111110,RDFDAFNZPAZKAU-UHFFFAOYSA-N
CCOC(OCC)C2=NC1=C(N=CC(=C1)Br)N2CC4(CC3=CC=C(C=C3)F)CCNC4,20B0A2A352042227_184243F3A48F6B9E_6034_UN,8.564957,00000000000000000000000000000000000000100010001000000000000000000110000000010101101101110011000110101100110101011010001011110110110000100110001011011111010111111111110,ONQBEYYBSZHEKQ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC3CC4(SCC3)CCC4,94BB37BAB1ED462A_2728DFC399FAC8B3_6041_UN,7.3288045,00000000000100000000000000000000000010100010000000000000000000000110000000000100010000011011000000100100110100011000001011000100110001110100001011010111010010101111010,RASVSIRVDLIGGI-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C3CCC2O3)N[C@H]4[C@H](CCNC4)C5=CC(=C(C=C5)F)F,5EEDCCD416EBA296_E9568DF7DFC1C999_6041_DP,8.538414,00000000000000000000000000000000000000000010000000000010010000100000000000000001001100110011000010101100110100010000001011000100110111110110001011010011110011100111110,ITSNFGGNXHIKJS-VMVSDCNISA-N
C1(=CC=C(C=C1)C[N]2C=NC3=C2CCCC3)NCCN4CC[Si](C)(C)CC4,7E17E2804642917C_C2C83CF8B81EB008_6041_UN,7.4353657,00000000000000000000100000000010000000000000000000000000000000000100000000110101001101100001010010101100110000011001101011100100110001010110001011011101010110101111010,VLVRFXCAFRCKHK-UHFFFAOYSA-N
CC1=C(C=CC=C1N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)C#N,67BC0C19B9A26D51_9EC97B68DDBA31E1_6041_DP,7.847785,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010101111010,QOKDFUZEHLBIPO-DNVCBOLYSA-N
CC5(C)CCC1=C(C4=C(N1CC3(CC2=CC=CC=C2)CCCN3)C(=CC(=C4)F)F)C5,7A06FFFE5E9B2ED6_C0727A2FF06E99CD_6034_UN,7.895469,00000000000000000000000000000000000000000010000000000000000000000110000000110001001101010011000010001100110100011001101011100100110000100110001011011101010110101111010,ZWMIWWIHZWEYKD-UHFFFAOYSA-N
CC1=C(C3=C(N1CC(CC2=C(C=CC(=C2)Br)F)C#N)C=CC=C3)C4CCNCC4,F5F7F36DE8E9A338_AF6E5D45E391CD0C_6034_UN,8.12237,00000000000000000000000000000000000000000110001000000000000000100100000000010000101101110001000010101100110110010000101011100100110000100110001011011011010110101111010,LKBACFIBKYSYPZ-UHFFFAOYSA-N
CC1=C(N=C(N1CC2CNCCC23CN(C)C3)C4CCCN4)C5=CC=CC=C5,111A41FDB27D5ED4_C48D24C66FC3FE62_6034_UN,7.77647,00000000100100000000000000000000000000100000000000000000000000100110000000010101101101100011010010101000110010011001101011100100110100000110001011011111010110101111010,NZDDCLLAYMWSTE-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2=CC(=NC=C2)OC3CCOC3)F,210BB03488A6E724_3179DD08CBD2AF07_6041_UN,7.9454947,00000000000000000000000000000000000000000010000000000000010000000100000010100000001101110101110010101000000101100101011011100111010011110110001111011111110111111111110,OXTFPJNRSXAONJ-UHFFFAOYSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NCC4(CC3CC3)CCCC4,9C8CB68109437FDE_A39CB805B4F6198B_6041_UN,7.9040465,00000000000000000000001001000000000000000010000000000000000000000110000000010101001101010011010010001100011110001000001011100100110001110100001010011011010110101111010,PCHFFAYTRASDOD-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NC[C@@H]3CNC[C@H]3C4=CN=C[N]4C,99442FBB49559FCC_A1E5D972851518BB_6041_DP,7.599207,00000000000000000000000000000000000000000010000000000100010000100100000010010101101101110011010010001000000111000000001011110100110111110110001010011011010111111111110,HYXDWYTUXZNJSC-UONOGXRCSA-N
CC1=CC2=C(C=C1)[N](C(=N2)C3NCCC3)C[C@@]45CCN(C)C[C@H]4CNC5,5930D067EFA1D83C_CFDC2481FF942EF8_6034_DP,8.0665,00000000000000000000000000000000000000100000000000000000000000100110000000010101101101100011010010101100110010011001101011100100110100000110001011011111010110101111010,XVOIRNQLRKKRPM-PQLKOCLTSA-N
N4CC(OC1=CC3=C(C=C1)NC2=C(C=CC=C2)C3=O)(C4)C#N,2B349F44D390EBE4_9529DC5A5A7ACF91_6035_DP,8.437355,00000000100100000000000000000000000000000100000000000000000000000110000000000000101000100010000101101100010000001100000011000111000110000110001101000001111011110111110,YWJLUPDQFSREPP-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=NC=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,FA262835BED90262_AACFA1D233DEEADF_6041_UN,8.198185,00000000000000000000001000000000000000100010000000001000000000100100000000010101101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,GTUPTHGVBWJPEB-IERDGZPVSA-N
N1CCC3(CC1)OC4(COC2=C(C(C)C)C=C(C=C2)Br)CC3(N)C4,F1BAAB09A25CCD77_7DF20379A7A47042_6035_DP,8.14051,00000000000100000000000000000000000000000000001000000000010000000010000010100000001110110011000111101000110101011100001011000011110111100110001111010111110111111111110,IQOVCFIXYLVMJI-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3CC3)C=CC(=C4)Br)C5,DB888F5BA5D89916_B0BC297A5249573F_6034_UN,7.812605,00000000000000000000001000000000000000000000001000000000000000100110000000110000101101110011000010001100010100011001101011100100110000100110001011011111010110101111010,QALQSTFPHWKQIU-KXBFYZLASA-N
CCNCC1=CN(C2=C1C=CC=C2)CC(N3CCNCC3)C4=CC(=CC=C4)Cl,04AE9CC9BA40CBD0_5FE11DE1DED70791_6034_UN,8.349875,00000000000000000000000000000000000000000000000000000000000000000100000000010001101101110001000010101101110100010010101011100100110100100110001001011001010110101111010,QKIDLEGWHYXPRG-UHFFFAOYSA-N
C2(=C1C=CC=CC1=C(C=C2)Cl)NC[C@@H]3CNCC(O3)(C)C,B82B9290A8B32ABF_CE71F3D5398122F0_7022_DP,7.58759,00000000000000000000000000000000000000000000000000000100010000000010000000100000101000110010000100101101010110001001000011000100100111110110001001000101110111101111110,MTMSTUFMYWRVFB-LBPRGKRZSA-N
CC2=C1N(C(C=CC1=CC=C2Cl)=O)CC3(CC34CCNCC4)C#N,9EA5687E779277BE_2F352854E9C085D9_6034_DP,8.298786,00000000000000000000001000000000000000000100000000000000000000000110000000010000101001110001100000101101110110111100011011100101110000100110001111011011011110101111110,YMDKVKXVRNVABM-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NCC3=CN=C(N2CCN(C)CC2)C=C3)C4OCCO4,E4EF12331668060D_9F9290AF5A7D1C9F_6041_UN,7.641461,00000000000000000000000000000000000000100010000000000000010000100100000010010101101101110000010010101000000101010001101011110100110011110110001011011011010111111111110,RNLFSHPSYFMIOK-UHFFFAOYSA-N
FC1=CC(=CC(=C1)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)CC#N,525F24F09EAE5785_28762BADFC189308_6041_DP,7.8864093,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010110100111010,QDAAOTUQMLQZKR-VQIMIIECSA-N
O(C2CN(CC1=CC=C(C=C1)F)C2)CCC3CC(C)(C)OC3,62F1675B82F4CABE_4C50BAB76CC81CA8_6039_UN,8.344912,00000000100100000000000000000000000000000010000000000000010000000010000000110000000101110000000110001000000111001001101011100011110010100110000100011100110101111111110,LAPSKHQZEGQAOZ-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC23N(CCC2)CCC3)F,2D7411970E4DBDE0_6A754448F5D6CCF3_6041_UN,7.5321217,00000000000000000000000000000000000000000010000000000000000000000010000000100001001101110011010010001100010100011001001001100000110001110110001010011111010110101111010,REMMOYBELYYICL-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC3CCN(CC3)C4=C(C=CC=C4)F)C5CCNCC5,F8BDD77BCB216F5D_1CCDE9EB9975873F_6034_UN,8.164734,00000000000000000000000000000000000000000010000000000000000000100100000000010000001101110001000010101100110100010000001011100100110001110110001011011011010110101111010,JHACDVZJGPKNFV-UHFFFAOYSA-N
ClC1=CC2=C(N=C1)N(C(=O)C=C2)CC3(N)CCOC4=C3C=CC=C4,A736F8922DDBFEDC_0220A23E314571AB_6034_UN,8.518045,00000000000000000000000000000000000000100000000000000000010000000110000000010101000011010010100001101101110101111100011011100101010011100110001111011011111111110111110,KLNTZTUFBXEMIY-UHFFFAOYSA-N
O(C1(CCNCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Br)Br)C#N,0021CCAFFE985887_CA521CC52E1094B6_6035_UN,7.4858713,00000000000000000000000000000000000000000100001000000000000000100010000000000000001000110001000001101000100100011100001001000111110010100110001111010011110001100111110,BLQPXTGEVBRWSP-UHFFFAOYSA-N
O(C1(CCNCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Cl)F)C#N,284F10DFB2456861_47CAE5EB2D59454A_6035_UN,7.4858546,00000000000000000000000000000000000000000110000000000000000000100010000000000000001000110001000001101001100100011100001001000111110010100110001111010011110001100111110,DHCVATHLVHWENS-UHFFFAOYSA-N
CC1=CC(=C(C=C1)C)[C@@H]2CCCC[C@H]2OCC4OCC3(CNC3)C4,B4332070CEAC4EA9_11E2CD5648CB04EF_6039_DP,8.159507,00000000100100000000000000000000000000000000000000000000010000100010000010000000001100100010000011001000010011001000001011000011110010000110000111010111110101111111110,KUUYILAEJSVOGI-AQCCAAQSSA-N
C1(=C[N](N=C1)CC=C)N[C@@H]2CCN(C)[C@H]2C3=CC(=C(C=C3)F)F,9E5E72CF9848DB1E_BE1EA0B000F83592_6041_UN,8.584045,00000000000000000000000000000000001000000010000000001000000000100100000000010001100101110011011010011000100110010001101011101100000001110110001010011011010110101111010,BCBNSRWZPYUYIG-SJORKVTESA-N
FC1=C(C2=C(C=C1)CCC2)NCC(OC)C3CCCO3,2808E9904BC9F200_BE8B46FC33029B55_6041_UN,7.5610294,00000000000000000000000000000000000000000010000000000000010000000000000010000000001100010011010111001100010111000000101000000010110011110110000010010011110111111111110,XHJILOXZTNLORL-UHFFFAOYSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC3=CC=C(C=C3)C4CCNCC4,70608326F83E2F88_4F4102A6D1A4C006_6035_UN,8.245777,00000000000000000000001000000000000000000010000000000000000000100010000000000000001010110011000001101000100101011100001001000111110100100110001101010011110101100111110,MSECZIUYLBTFAI-UHFFFAOYSA-N
C(CN1CCN(CC1)C2CC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,207E7B2D96FBFF43_C10CA3DD9F9A3A00_7019_UN,8.3425255,00000000000000000000001000000000000000000010000000000000000000100000000000010001000001110000010010111000000110010000101011100000110001110110001011011010010110101111010,NKBOUZSRPSBCET-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(=O)CC3=C(C=C(C=C3)F)F,160C982819349A9E_37307D796FFF648A_6038_UN,7.171159,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010001100010001000110100110000011000000000110010100000000011010011011110100111110,XGBIAHNHGJJBMS-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3CC(C)(CO3)C,39A0C34B34EB05F3_67378E23C9DF5328_6041_UN,8.156649,00000000000000000000000000000000000000000010000000000000010000000110000000100001001100010011000110101100010111001001000011000100110011110110011011000111110111101111110,BIDCOEHESNBNBS-UHFFFAOYSA-N
N(CC1CC2CCC(C1)S2)C(=O)CC3=COC4=C3C=CC(=C4Cl)Cl,480D64F483022DE1_424763453A5FD0CC_6038_UN,7.9101143,00000000000000000001000000000000000010000000000000000000010000000000000000000000011100011010100010101101110100110000011010000100110010100100000011010011111110110111110,ZCZBXZDMHDSMQK-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2=C[N](C(=N2)C3CCCN3)C[C@@]45CCCN[C@H]4CCCC5,3F4BEBF427DF5475_2F222A34CA2A4FFA_6034_DP,8.32211,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101010011000010101100110100011000001011100100110100100110001011011011010110100111010,WUEWOHOGBKKERW-YTVKWDEWSA-N
N(CC1CC2CCC(C1)S2)C(=O)CC3=COC4=C3C=CC(=C4F)F,01C1E28BF5CE5E21_0460D134C8379384_6038_UN,7.910122,00000000000000000001000000000000000010000010000000000000010000000000000000000000011100011010100010101100110100110000011010000100110010100100000011010011111110110111110,HOGRVZXIPGVSRB-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC23CC2COC3)C=CC(=C4)Cl)C5,E7AFCE8141CDD351_E690A14F1EB9DA9C_6034_UN,7.2299604,00000000000000000000001000000000000000000000000000000000010000000110000000010000100101110000010011101101010101011001101011100100110000100110001011011000010111101111110,KNJZIHVIHULZQK-UHFFFAOYSA-N
C1(=NC=NC(=C1)CC2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,B1B96ED997D95DCC_41AC12A45517D6F4_6041_UN,8.123966,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101110011010010101000100110010001101011100100010001110100001001011011010110101111010,HSJDTOMHQNVQBC-MJGOQNOKSA-N
CC1=C(N=C(S1)NCCC2CCC(C)(C)CO2)C3=CC=C(C=C3)F,3C2A8BF0370DF01F_CFAB4C89907B7DD5_6041_UN,8.181806,00000000000000000000000000000000000010000010000100000000010000100110000000100100011100011001000011101000101101011001101011000100110011110110011011010111110111101111110,NOLVOVXRVXRXJW-UHFFFAOYSA-N
N(CC2=CC=C(CN1CCOCC1)O2)C(CC4CC3CCC(N3C)C4)=O,CE1905F8D4F4B159_85AB34123D3418CA_6038_UN,7.440897,00000000000000000001000000000000000000000000000000000000010000000000000000010000001101100001110110101000110011110000111011100000110010000110001001111001111111111111110,PHXKCELBEOTUEI-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4=C(C(=CC(=C4)F)F)F,4D3FBAC60CF57D42_4E6EF8A9094A37C8_6041_DP,8.358504,00000000000000000001000000000000000000100010000000000000000000000100000000000101100101010011010010100000110100010000101011100100110101110100001011011011000010101111010,CGHPULLREDWFOT-CLLJXQQHSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NC[C@H]4[C@H]3CCOC[C@H]3CO4)C,D07949F8EF291EDD_5253106229C9BF7F_6041_UN,7.8607397,00000000000000000000000000000000000000000010000000000000010000000100000000000000101100110101000110101100010111000000001011000100110011110110001011010111110111111111110,JBAZUEYOOIWHBU-YEWWUXTCSA-N
CC1=CC2=C(C=C1)C(=CN2CCCC3(C)CCCN3)C4=CCNCC4,7DD0992AE92A13EB_1B020DDF5B93B571_6034_UN,8.1455,00000000000000000000000000000000000000000000000000100000000000100110000000011000001101100011000010111100110010011001101011100100110100000110001001011101010110101111010,KVAXFCFIKGRIDR-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C4NC3=CC=CC(=C3C4)F)=O,5F929E7811F20B2E_3CFD6931C69D72BF_6038_DP,7.269849,00000000000000000000000000000000000000000010000000000010010000000000000000000001001100010011100110001100110100110000011011000000110110110100001011010001111111110111110,ZEJXVEANZKMFNI-UHFFFAOYSA-N
FC2=C(C=C1C=C[NH]C1=C2)NC3=CC=CC(=C3)CC4CCCN(C)C4,E46D21228EE2E8FA_9DE0DCCDEBF898D0_6041_UN,7.7629356,00000000000000000000000000000000000000000010000000000000000000000100000000010000000101110001010010101100010110010001101011100100110101110110001011011011010110101111010,FJBJOSRYVOBPMN-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2(CCOCC2)C#N)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,7A4D875920B100E3_595BB1C99BBC12BF_6041_UN,8.1748085,00000000000000000000000000000000000000000110000000000000010000100010000000010001100101110011010010101000100111011001101011100100110011110110001011011011010011101111110,VJLGCBVZTVFUSU-YADHBBJMSA-N
CC(C)(C)C2=CC1=C(C=CC(=C1)F)N2C[C@H]4[C@H]3CNC[C@H]3OC4,7950D7B364B2A9AC_1C20ADE6930B14F5_6034_UN,8.4410925,00000000000000000000000000000000000000000010000000000000010000000110000000110000001101110001000111001100010111001000000011100100110010100110011010001111110111101111110,NKHWMWMRRSFANX-FRFSOERESA-N
FC1=C(C(=CC=C1)NCC2CCCC(CC)CC2)C3CC3,803D60D559B89229_545B7B8463C9E0F9_6041_UN,7.54883,00000000000000000001001000000000000000000010000000000000000000100000000000000000001000010011000000001000000110000010101000000000110001110000000010010011010110101111010,KWZRWJHQYPGGML-UHFFFAOYSA-N
CN(C)CC1=CN(C2=C1C=CC(=C2)F)C[C@]34CCCC[C@@H]3NCCC4,0B30E6F2AF027FF0_09812DF53CD6C4CA_6034_UN,7.4716473,00000000000000000000000000000000000000000010000000000000000000000110000000110000101101110011010010101100110100011001001011100100110000100110001001011101010110101111010,QZAIPCYMKKEEDS-LEWJYISDSA-N
C1(=CC=C(C=C1)C(F)F)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,9CC9F193B2D5EA81_B3F0C76C64F8DC3A_7022_DP,7.8317175,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101100011010010001000000110000000000011100100110101110110001010001011010110101111010,OFDPTEIFZPKGAW-GXTWGEPZSA-N
NCCC(OC1=CC2=C(C=C1)CCNCC2)C3=CC=C(C=C3)Br,7A65D4087E1DF5E4_B87777D9C73BAF39_6035_UN,8.099338,00000000000000000001000000000000000000000000001000000000000000000000000000000000001010110000000001001100110100010100001001000111110110100110001111010001110101100111110,LAVZKJPBVRCTQJ-UHFFFAOYSA-N
CN(C)CCC1=CC=C(C=C1)NC3=C2OCCCC2=CC(=C3)F,0A8BA07E815E2C9A_945AEF67F72E0C10_7022_UN,7.1203403,00000000000000000000000000000000000000000010000000000000010000000000000000100000000001110001010100101100010101010101101000100100100011110110001011011101110111101111110,XCLUNINAZSIEJD-UHFFFAOYSA-N
N2CCC(OC1=CC(=CC(=C1C#N)Cl)Cl)CC2C3=CC=CC=C3,BD09BF578E961528_81394F28556D28B2_6003_DP,8.013618,00000000000000000000000000000000000000000100000000000000000000100000000000000000001000010001000001101001100100010100001001000111110010100100001111010011110011100111110,HWNORGKWEWESBF-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NCC3=CC=CC(=C3)CN4CCN(C)CC4,CFCBEF17C0EFB797_42E1BDB1E61D538E_6041_DP,7.982828,00000000000000000000000000000000000000100000000000000000000000100100000000010101101101100011010010101000100010010001101011100100110101010110001011011111010110101111010,GTJZPUOVTKGZAN-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C3CCC2O3)NC[C@@H]4[C@H](N(C)C(C4)=O)C5=C[N](N=C5)C6=CC=C(C=C6)F,8D771E0787DEE143_8F87E321B64154DD_6041_UN,7.7399235,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101010010111010001100010110110000111011101101000011110100001111011011111111111111110,ITGAMDNFVNEVED-KVDYYUGASA-N
O(C(CC1=C(C=C(C=C1)F)F)C#N)CC2OCCC23CCNCC3,1DC43660182F26E1_A5C9C1DB1715DF2B_6039_DP,8.228671,00000000000000000000000000000000000000000110000000000000010000000010000010000000001100110001000110101000110101011000001011000010110010100110001011010011110101110111110,WDYWMFYONKOVPT-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3(C)C4CCC(C3)O4,1DC76538FD26D917_2AB7E7CED18AE2DA_6041_UN,7.553292,00000000000000000000000000000000000000100010000000000000010000000110000000000100001100010011000011101100010110001001101011000100110011110100011011010111110111101111110,PFJQUUZIFXFPJT-UHFFFAOYSA-N
CN(C)C5CCN(CC1=CC=C(C=C1)NC3CCC2=NC(=C[N]2C3)C4=C(C=CC(=C4)F)F)C5,49735FEA015E2592_95F0ACE0EFD4779C_6041_UN,7.996894,00000000000000000000000000000000000000100010000000000000000000100100000000110101100101110010010010101100110110010000101011100100110001110110001011011111010110101111010,UAZXUCXZKFNCOQ-UHFFFAOYSA-N
FC2=C(C=C1C=CN=CC1=C2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,19C78C0B7AD22E6D_BC75CD6B55A7EAC6_6041_UN,8.450245,00000000000000000000000000000000000000000010000000000000010000100100000000010000101001110001010100101100010111010001101011100100110011110110001011011011110111101111110,KIYLWWBKWUPLIB-SFTDATJTSA-N
BrC1=CC2=C(N=C1)N(C=C2CC3=CC=CC=C3)C[C@@]4(C)COC[C@H]5CCCN45,0682772835B80535_620B8CECC5658475_6034_UN,7.9463463,00000000000000000000000000000000000000100000001000000000010000000110000000010101000101110000000111101100010111011001101011100100110000100110001001011000010111101111110,RHDPHKPZUKAFDF-OFNKIYASSA-N
C(C2CCC1(CC1)C2)=CC3=C(Cl)[N](C(=N3)N(C)C)C4=CC=C(C=C4)C,7F14EDD0FD68C03B_E301C0C1E7406DB6_7019_UN,7.2300124,00000000000000000000001001000000000000000000000000000000000000100110000000110101000101110000010010010001011100001000001011100100110001110100011010011110000010101111010,BCWJBHZWOLAODJ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2C[C@@H]3CCO[C@H]3C4=C[N](C)N=C4)C5CCNCC5,7DE67EB08D97F48C_4ECE333245CC11B7_6034_UN,8.2608185,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011011101100110101010000001011101100110010100110001001011011110111101111110,JYTYDGBEBOUMRV-KSFYIVLOSA-N
CC(OCCC2COC1(CCCC1)O2)C3CCN(C)CC3,EE0F32F2F1777FC8_CA8F05FE19EF8974_6039_UN,6.943156,00000000000000000000000000000000000000000000000000000000010000000000000010010000000101100100010010101000010011011001101011110010110010000110000000111100110101111101110,ACJRNYCMMSRAGJ-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CCC3)C4=CC=C(C=C4)F,323CC65A32A9B1DE_11366AC06FC3A52D_6041_UN,7.6742253,00000000000100000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,DJFVUGVRMADSPT-IBGZPJMESA-N
CN4CCC1=C(C3=C(N1CC2(C(C)CNC2)C)C=CC(=C3)Cl)C4,4897E3DA20B61041_34DF91663377CC3C_6034_UN,7.9081907,00000000000000000000000000000000000000000000000000000000000000000110000000010000101101110011010010101101010110011001101011100100110000100110011011011111010110101111010,OMHGXCQKBACMJB-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC=C2NC3=CC=CC(=C3)CC4CCCN(C)C4,68C4136B42EB2A56_2859ACD5BCDA3EB9_6041_UN,7.6964126,00000000000000000000000000000000000000000010000000000100000000000100000000010000100101110001010010101100010110010001101011100100110101110110001011011011010110101111010,XTDBKASWORVWLL-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC[CH]2C[C]3(C2)CC[CH2]CC3)F)CC4,24FA83D8E80C3D1E_E34612956B7FD12F_6041_UN,7.143716,00000000000100000001000000000000000000000010000000000000000000000010000000010001101001110010010000001000010110011001101011100000110001110110001011011011010110101111010,IHHTWTHGSWKNHS-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2CCOC3=C2C=CC=C3,0647969C615D82E5_DFBCB302247511C4_6041_UN,7.659348,00000000000000000100100000000010000000000000000000000000010000000100000000100001001000100011010000101100010001001100001011000100010011010110011011011111110111101111110,AIODXWIYNLSSPY-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC4CC(OCC4)C5=CC=C(C=C5)F,73E80A5359810B49_76F84DEDAE2BB9CC_6041_DP,8.3097315,00000000000000000001000000000000000000100010000000000000010000100100000000000101100101010011010011100000110101010000101011100100110111110100001001011001110011101111110,UDIQMYFTMLFZBN-QLKRIMAFSA-N
C[Si](C)(C)C#CC1=CC(=NC=C1)NCC[C@H]2CCCN2,232F88BFEC03A5BC_180649C7BA47F4CB_6041_DP,8.095181,00000000000000000100100000000010000000100000000000000100000000000100000000100100101100100011010010101000100000011000001011000000110101010110011000011101010110101111010,QOHKXAMOBBZRFK-OAHLLOKOSA-N
CN3CCC(C)(COCCC2COC1(CCCC1)O2)CC3,73D216C4518EF3F7_18D8B7665612B2DD_6039_UN,7.349399,00000000000000000000000000000000000000000000000000000000010000000010000010010000000101100100010010101000010011011001101011110010110010000110000000111100110101111101110,KVRJZVAMZOEYOD-UHFFFAOYSA-N
N2CCC(CC=CC1=C(N(C)C)C=CC(=C1)F)(CC2)C#N,D84AD7FCD40A7043_DC745241BAB97B3C_7019_DP,7.916374,00000000000000000000000000000000000000000110000000000000000000000010000000100000001001110001010000111000100100011000001001100000110001110110001011011111010110101111010,NEQBIIJQWTVWPF-UHFFFAOYSA-N
CC(C)C1=C(C=C(C=C1)NC3CC(C2=CC=N[N]2C)OCC3)F,C08E0CC6723FF41D_FFD92A91CA0A18AC_6041_UN,8.10499,00000000000000000000000000000000000000000010000000001000010000100100000000110000100100010010011111100000100111010000001011101100110011110100011011011111110011101111110,DQFILPBWDXZZTI-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=NC=C(C=C1)NCC2CCCCCN2,1B4946631AF0C6F5_20B40E347838FD1B_6041_DP,8.235551,00000000000000000101100000000010000000000000000000000010000000000100000000100001001000100011010000101000100000011000001011000000110101010110011000011101010110101111010,KFHZHSNDDBOCAH-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NCC3N(C)CC4(CC3)CCC4)C,30F2CBF32CAB6F8F_1A2F70260282637E_6041_UN,7.4736443,00000000000100000000000000000000000000000010000000000000000000000110000000010001101001110011010000101100010110011001101011100100110001110110011011011111010110101111010,MFEGXDHLPBDGAU-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC[C@@H]2CCCN2,57F77767CABBA9CD_3D66F5C09177140B_6041_DP,7.9533825,00000000000000000100100000000010000000000000000000000100000000000100000000100001101100100011010010101000100000011000001011000000110101010110011010011111010110101111010,MGAXLCIZNIZJKD-AWEZNQCLSA-N
CN(CC1CNC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=CC(=C(C(=C4)F)F)F,44DDA178428E0BCF_2E315C23B9571CC5_6041_DP,8.650681,00000000100100000000001000000000000000100010000000000000000000100100000000000101101001110010010000101000100110010001000011100100100101110110001011001011010110101111010,JJEKNTQWVCNQEG-SWLSCSKDSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC3C(C)(CNC3)C)Cl,AE19EE631C910CDE_E50B9FB0F6203247_6034_UN,8.415187,00000000000000000000000000000000000010000000000100000000000000000110000000110110111101111011000010001001001110001001100111100100110101110110011010001111010110101111010,XSZZNQHDFKJAHP-UHFFFAOYSA-N
CC1=CC(=C(C=C1)C)[C@@H]2CCCC[C@H]2OCC4OCC3(CCNCC3)C4,A65F419FB8220BF2_67DB7BE2E92D5797_6039_DP,8.035162,00000000000000000000000000000000000000000000000000000000010000100010000010000000001100100001000010101000110011011000001011000011110010000110000111010111110101111111110,SNWCTLQDWCWHGL-VDZZXDNDSA-N
CC1=C(C=C(C(=C1)NC4CN(CC2=CC=CC=C2)C3(CCCC3)C4)Cl)C5CC5,F6B0239D481E3F95_46920B6F9872A822_7022_UN,8.073379,00000000000000000000001000000000000000000000000000000000000000100010000000010001100101110001000010001001110110011000001001100100110001110110001011011011010110101111010,PQDMHMOGVCYRPV-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NCC2CNCC3(O2)CCC3,DF1D2B8F15B4DA85_F20B26335BB3AF36_7022_DP,7.212139,00000000000100000000100000000010000000000000000000000100010000000010000000100000101000100011010100101000010000001000001011000000110111010110011001011101110111101111110,QDHBAQNBNLIXNP-UHFFFAOYSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(=O)CC4=NC=C(C=C4)F,4C07DBBB9F133BE9_A6490F27912E55DA_6038_UN,7.665828,00000000000000000000000000000000000000000010000000000000010000000100000000000000100100010001100011100100110100110000011011000100000011110100001011010001101111110111110,PWGADKWMJCEBOG-UHFFFAOYSA-N
N3CCOC(CC=CC1=C([N](N=C1C)CC2=C(C=CC=C2Cl)Cl)C)C3,195C0BE386C40376_A8FE869FCFF38DA3_7019_DP,8.169616,00000000000000000000000000000000000000000000000000001000010000000100000000010000101100110011001110111001100111010000101011101100110010100110001011011111110111101111110,PMDLNMJQKFISJI-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=N3)NC5=C4OCCCC4=CC(=C5)F,350330721E09E69A_ED9A6BDDAAFF8A57_6041_DP,7.7077894,00000000000000000001000001000000000000000010000000000000010000000100000000000100100101010011010110100100111101010100101011100100110111110100001011011001110011101111110,GXWPJUJOEQSFKH-MUJYYYPQSA-N
C1(=CC2=C(C=C1)C3CCC2O3)NC5=CC4=C(N(C)C(=O)O4)C=C5F,2D52FC4EC359AABE_3EF9249FD49B83C4_6041_UN,8.126192,00000000000000000000000100000000000000000010000000000000010000000100000000010000000101010000010111000100011100100100011011110101000011110100001111111011101011111111110,JLORVEZPJJHYOI-UHFFFAOYSA-N
N2CCC(CC=CC1=C(C)C=CCC1(C)C)(CC2)C#N,96F70465160C6077_F77C3861A59C4B79_7019_DP,8.624811,00000000000000000000000000000000000000000100000000100000000000000010000000101000001000100001000000111000100010011001001001000000110000000110011001010111010100101101010,AGAGENVJEBZQSX-UHFFFAOYSA-N
C(C1=NCCCN1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,39098B289388B6E9_F41DC3BEA765066E_7019_UN,8.023516,00000000000000000000000000000000000000100010000000000000000000000000000000000110101001010011010010111000100110010000101111100000110001110110001011011011010010101111010,CTLZMLAKRFEHES-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(C3=C(SC)C=C(C=C3)F)=O,BFAF43EEC0757D56_5CD0E9FF208DB895_6038_UN,7.863332,00000000000000000000000000000000000000000010000000000000000100001000000000000000011000011001110010001000110100110000011000000000110000100000000011010011011110101111110,UOHVSUWOCDYSJW-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NC[C@H]4[C@H](C3=NC=C[N]3C)OCCC4,369DEE907B283C98_47B488ED2C263C37_6041_UN,7.121651,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101010011010111101100010101000000001011100100110011110110001011011011110111101111110,QXVRBLGBPSBHAT-KBXCAEBGSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=NC=C3)NC4(CCCC4)C5=C(C=CC=C5F)F,B6F9AE464018C958_86F0139F2C3AC830_6041_DP,8.403414,00000000000000000000001001000000000000100010000000000000000000100110000000000100101101110011010010101000111110011000001011100100110101110110001011011011010010101111010,ZEXOCSUQCYFIIP-FSWDVZBNSA-N
FC1=C(C(=C(C=C1)Br)F)C=CC2(COC)CCCCO2,F37670E10B2D5977_21D49BF819106A96_7019_UN,7.7611523,00000000000000000000000000000000000000000010001000000000010000000010000010000000000000110000010000110000000111001001001000000010110010100110000011010010110101011011110,ZZLAOENKESHKFG-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(CCCC(C)(C)C2)C)F)CC3,CB373BC70076AB5A_3DD06B77BB0F20D7_6041_UN,7.9476285,00000000000000000001000000000000000000000010000000000000000000000010000000110001101001110011010000001000000110011001101011100000110001110110011011011111010110101111010,FJNUGWXWFVSAQO-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC[C@H]3[C@H](C2=NC=C[N]2C)OCCC3)C4CC4,54954AD5DED797BD_6D1FCEE2B384A171_6041_UN,7.824676,00000000000000000000001000000000000000100010000000000000010000100100000000010101001101010011010111101000000101000000001011100100110011110110001011011011110111101111110,BETSDVTVYXTPQS-KBXCAEBGSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)NCC(C2CCNCC2)(C)C,1B657A0757D5D363_1E7F3E9FD7C92DF7_7022_DP,8.52408,00000000000000000000000000000000000000000110000000000000000000000010000000100000001000110001000000101001100110011001101001000000110101110110001011010111010110101111010,LWTZIETZEMCQRN-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4=CC5=C(N=C4)C(=C(F)C=C5)F,90AB7154CCE29854_09FA09823A5B05F7_6041_DP,8.391314,00000000000000000001000001000000000000100010000000000000000000000100000000000101100101010011010010100100111100010000101011100100110101110100001011011011000010101111010,XZGXOWQKRUOZJD-MIFYACCESA-N
CC1=C(C=CC=C1F)NC[C@@H]2OCCN(CC)[C@H]2C3=C[N](N=C3)C,8DECF593C698C9DA_8F298EFAA38CCE32_6041_UN,8.281936,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010010101011101100110011110110011011011111110111101111110,PKVKRTILNQTGNW-ROUUACIJSA-N
COC2=C1C=CC(=NC1=C(C=C2)F)NCC4(C)CCOC3(CCC3)C4,9C1DDA95477BEDFF_8AA9E6027F03997A_6041_UN,7.7371106,00000000000100000000000000000000000000100010000000000000010000000110000000000100001000010011010001101100010111001101101011000111110011110110001101010101110111111111110,VQQXARIRYUHGIA-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NC[C@@H]2OCCN(CC)[C@H]2C3=C[N](N=C3)C,7CE0907DCBA70429_610859C8FF5DAA2A_7022_UN,8.281932,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101110001011110101001000111010010101011101100110011110110011011011111110111101111110,OHXOZTYUZCFZFU-ROUUACIJSA-N
CC1=C(C=CC=C1Br)NC[C@@H]2OCCN(CC)[C@H]2C3=C[N](N=C3)C,D81AAEDB5CEFC8ED_BD0B0BD456133E18_7022_UN,8.281917,00000000000000000000000000000000000000000000001000001000010000100100000000010000101101110001011110101000000111010010101011101100110011110110011011011111110111101111110,PVYXWVXRKKGYBT-ROUUACIJSA-N
CC1=C[N](N=C1)CC2=C(C=C(C=C2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5)F,E807FD7458EE13FE_B6080DDDEBCAE3D2_6041_UN,7.78139,00000000000000000000001000000000000000000010000000001000000000000110000000110000101100010011001010001100010110011001101011101100110001110110011011011111010110101111010,SIUKHBWGIQOJCI-UHFFFAOYSA-N
FC1=CC(=CC=C1)NCC2=NC=CN2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,CC635D403DA75945_8FF5FBA0AFFFCA1B_6034_UN,7.8572464,00000000000100000000000000000000000000100010000000000000000000000110000000110101001101010001000010001000010110011000101011100100110001110110001011011111010110101111010,DQEMSXPCPNYDBY-FRQCXROJSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCCC4CCN(C3CCN(C)CC3)CC4,683894087D2D861E_C2AA26983F8C5247_6041_UN,7.6645765,00000000000000000000000000000000000000000010000000000000000000100100000000010000101001110001010000101100110100010001101011100100110001110110001011011111010110101111010,CXDJWKQLUYKDEM-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)Cl)Cl)Cl)NCC3=C(CN(C)C2CCCCC2)C=CC=C3,2DA5E824176F9344_80428DA5AB362E51_7022_UN,7.962564,00000000000000000000000000000000000000000000000000000000000000000000000000000000001001110001010000001001000110010001101000100100110001110010001011011011010110101111010,GPBRWOVSXBGJOL-UHFFFAOYSA-N
CC2=CC1=C(C=NC=C1)N2CC3CCCN3CC4CCCN4,F5D9A6B52566956C_288DA1CD401222B4_6034_UN,8.395834,00000000000000000000000000000000000000000000000000000000000000000100000000010001001101100011000010101100110000010000101011100100110000000110001010011011010110101111010,YDQJSWJIKNZPCE-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)F)F)NCC3=C(CN(C)C2CCCCC2)C=CC=C3,20F6529A63A9A83E_7B75F7AA4B57106D_7022_UN,7.9625483,00000000000000000000000000000000000000000010000000000000000000000000000000000000001001110001010000001000000110010001101000100100110001110010001011011011010110101111010,ZBLFFPUNQCNZHB-UHFFFAOYSA-N
C1(=C(C=C(C(=C1)F)F)Cl)NCC3=C(CN(C)C2CCCCC2)C=CC=C3,8ED6E3BEDAC8AB6A_1FC54C69F524299D_7022_UN,7.9625444,00000000000000000000000000000000000000000010000000000000000000000000000000000000001001110001010000001001000110010001101000100100110001110010001011011011010110101111010,ZZSWAUWJKOVCDN-UHFFFAOYSA-N
O(CC2CCOC1(CCC1)C2)CCN3C(C)(COCC3)C,9EC88BAF6C8DB3EE_A27056DF916931AA_6039_UN,7.386278,00000000000100000000000000000000000000000000000000000000010000000010000000110000000001100000000100101000010011011001101011100010110010000110000001111110110111111101110,MYMDTMMNPKUVRP-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NC[C@@H]3[C@H](C(C)C)CCO3)C,DDEEBB431C0EA0F5_27A79FB0E0E0B1FA_6041_UN,8.4632635,00000000000000000000000000000000000000000010000000000000010000000100000000100000101100010001000110101100010111000000101011000100110011110110011011010111110111101111110,MBNXSOQHQLTOLC-WMLDXEAASA-N
ClC1=CC(=CC=C1)NCC2=NC=CN2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,61D089415F309EC7_D22A4C530FE8681A_6034_UN,7.857176,00000000000100000000000000000000000000100000000000000000000000000110000000110101001101010001000010001001010110011000101011100100110001110110001011011111010110101111010,WYASGDSOJJJUKO-FRQCXROJSA-N
CC1=C(C3=C([N]1CC[C@@H]2CCNC[C@@H]2C=C)C(=CC=C3)Br)C,84C547BFF3609AB2_81ED1BEE0E93B62B_6034_DP,8.808715,00000000000000000000000000000000001000000000001000000000000000000100000000010000001101110001000010111100110110010000101011100100110000100110001011011111010110101111010,QBMXBVNQOSNOKX-HOTGVXAUSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NCC3C(CCC3)C4CC4)C,C3ED25BCC6C1C89B_15903FD12CC73110_6041_UN,8.236979,00000000000000000000001000000000000000000010000000000000000000100100000000000000101000010011000010101100010110000000001001000100110001110100001011010111010110101111010,PCCSTNGRXJHEOT-UHFFFAOYSA-N
C1(=CC2=C(C=C1)SCCC2)NC3=C[N](C[Si](C)(C)C)N=C3,D41E7B366AB484EC_065142EABCF7BBF5_6041_UN,7.3920145,00000000000000000000100000001010000010000000000000001000000100000100000000110001110100101001011010101100010000011001001011101100100001010110011011011101010110101111010,RFCXIWRXBSWYMY-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@H]2[C@@H](C2)C3CCCCC3)Cl)C4CC4,7D85EF5794053661_4E68D790D6E43770_7022_UN,7.236486,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010011000000001001000110000000001000000000110001110000000011010011010110101111010,FVMAGWQUKHTIIQ-WMZOPIPTSA-N
FC1=CC2=C(C=C1)[NH]C=C2NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,BCE128C839B0F99A_6AFF7F66AFB18364_6041_UN,8.84202,00000000000000000000000000000000000000000010000000000110000000100100000000010001101101110011010010101100010110010001101011100100110101110110001001011011010110101111010,NAVGEIVBUVDPIG-LIRRHRJNSA-N
FC1=CC4=C(C(=C1)NC2CN(C)C3(C2)CCOCC3)N=CC=C4,030B80F64B19E9B4_0F0D22F5D5432FA0_6041_UN,7.8924723,00000000000000000000000000000000000000000010000000000000010000000110000000010001100101110001010011101100110111011001101011100100110011110110001001011001010011101111110,VFDMTSJTQHSGRG-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)N[C@H]3[C@@H](CCCC3)OC4CCCC4,155A85C48F8865EB_3EBEC0C8A584FB90_6041_UN,7.8782454,00000000000000000000000000000000000000100010000000000000000000000100000000000100000000010011000110100100110100010000001001000111110011110100001111010111100011101111110,UJKZEERGMAKPPS-WOJBJXKFSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CC4(C3)CC4,19D9792BB9FDE92F_D1CA1B09378C48C4_6041_UN,7.2924004,00000000000100000000001000000000000000100010000000000000000000000110000000000100001000010010000000101100010110001000000001000100110001110100001011010111010110101111010,HJGMDVJDBWSSMI-UHFFFAOYSA-N
FC1(F)CC15CCC(C=CC2=C[N](N=C2C3=C(C=C(C)C=C3)C)C4=CC=CC=C4)C5,8C1121C313372371_B1BF3C7BAA705F55_7019_UN,7.989215,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011110000010101111010,VVVUDVHKAGYZOQ-UHFFFAOYSA-N
C1CC(CCN1)C2=CN(C3=C2C=CC=C3)CC4(CN(C)C)CCCCC4,FCB7E5514522A377_B51AB334E99F97A5_6034_UN,7.1262503,00000000000000000000000000000000000000000000000000000000000000100110000000110000101101100001010010101100110010011001001011100100110000000110001001011101010110101111010,PCPMTPUEARSODZ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C3=C2C=CC=CC2=C(N=N3)NCC4C(C)(SCC4)C)F,1DFC924688581E98_77B73CD626F112A0_6041_UN,8.277768,00000000000000000000000000000000000010100010000000001000000000100110000000100101011100011011001010101100010110001000101011001100110001110110001011010111010110101111010,GIVWLKAQNSKWQZ-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)C=CC2=C([N](C)N=C2)C3CC3)OCOC4,A2EE5096DF0BAFEF_B7C8054F4005640D_7019_UN,7.9158864,00000000000000000000001000001000000000000010000000001000010000100100000000010000100100110100011010110100010111000100000011111100100000100110001011011010110011111111110,QAYGNQCBHUNVDC-UHFFFAOYSA-N
O[C@@H](CCl)C1=CC=C(C=C1)NCC2N(C)CC3(CC2)CC3,843760CEC393096D_B33F5F07B10A829F_6041_UN,8.2457075,00000000000000000000001000000000000000000000000000000000000000000010000000010001001001100011010000101001110010011001101001100000110111110111001001011011110111101111110,GIHVJTMJIAGOFU-LYKKTTPLSA-N
FC1=CC2=C(C=C1)C(=CN2CC(NC)C3=CC(=CC=C3)F)C4CCNCC4,3A28ABE15D12838D_790D25A50C39D458_6034_UN,8.894186,00000000000000000000000000000000000000000010000000000000000000100100000000010001001101110001010010101100110100010000101011100100110100100110001001011001010110101111010,GKGJTXQPYMPONB-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC(NC)C3=CC(=CC=C3)Br)C4CCNCC4,28719F36FBAA5F82_A1EB5FC9262633C7_6034_UN,8.894175,00000000000000000000000000000000000000000010001000000000000000100100000000010001001101110001010010101100110100010000101011100100110100100110001001011001010110101111010,QLOYUGZXKPKFIL-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC=C2NCCC4CCN(C3CCN(C)CC3)CC4,412BBB07A86E9A1E_70EEE79A16F1ABCA_6041_UN,7.4375787,00000000000000000000000000000000000000000010000000000100000000100100000000010000101101110001010010101100110100010001101011100100110101110110001011011011010110101111010,VZZWVWSZUJAMDM-UHFFFAOYSA-N
FC2=C(C=C1OC=CC1=C2)NCC3(CCN(C)CC3)N4CCCCC4,C793726142CC8FEC_2E0E36181F733E97_6041_UN,7.6298985,00000000000000000000000000000000000000000010000000000000010000100010000000010001101101110011010011101100010100011001101011100100110001110110001011011011110110101111110,DOCNVLIBDZOBIC-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC(CC)C3CCOCC3,33AD22EC97D7D385_B30615E8F36005AD_6041_UN,7.944993,00000000000000000000000000000000000000000010000000000000010000000100000000000000101000110011000000101100010111000010101011000100110011110110001011010111010111101111110,OPHGPKRMBXSDHO-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C[N]2C=C(C=N2)NC[C@@H]3CNC[C@H]3C4=CN=C[N]4C)F,D410E3B6E0D6A2E8_1C0015748DA045A3_6041_DP,8.5125065,00000000000000000000000000000000000000000010000000001100000000100100000000010101101101110011011010001000000110010000000011101100110101110110001010001011010110101111010,QDYDOHMWTKIOBT-GOEBONIOSA-N
ClC1=CC2=C(N=C1)N(C=C2)CC4[C@@H]3C[C@@H](C3(C)C)CC4,DC360516DA17F583_90D489BA3CB536F0_6034_UN,7.9887047,00000000000100000000000000000000000000100000000000000000000000000110000000110100000101010000000010101101010110001000101011100100110000100100001001011100010110101111010,QSOZJBPWYMBWPT-MHEXWIEDSA-N
FC1=CC2=C(N=C1)N(C=C2)CC4[C@@H]3C[C@@H](C3(C)C)CC4,2DAABD959B85B94E_624CEAF9382365B3_6034_UN,7.988701,00000000000100000000000000000000000000100010000000000000000000000110000000110100000101010000000010101100010110001000101011100100110000100100001001011100010110101111010,HZPDTVJOERTDDL-MHEXWIEDSA-N
BrC1=CC2=C(N=C1)N(C=C2)CC4[C@@H]3C[C@@H](C3(C)C)CC4,AFA437D3F1F0D264_3DF4A5D1B92CE2A7_6034_UN,7.988697,00000000000100000000000000000000000000100000001000000000000000000110000000110100000101010000000010101100010110001000101011100100110000100100001001011100010110101111010,CNEHCCHISUEDFN-MHEXWIEDSA-N
N(C1C2CCC1CCC2)C(=O)CC3=CC(=C(C=C3)I)Br,03B4557C3C6AC40A_C28DB45719134FCF_6038_UN,7.1051903,00000000000000000001000000010000000000000000001000000000000000000000000000000000000000010011100010000000110100110000011000000000110011100000000011010011001110100111110,NTRKOBKEKPWIMA-UHFFFAOYSA-N
N(C1C2CCC1CCC2)C(=O)CC3=CC(=C(C=C3)F)F,6C9C035CCE7FFA93_98AE779869AE8012_6038_UN,7.10519,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000010011100010000000110100110000011000000000110011100000000011010011001110100111110,IYFAKCKWENJBCO-UHFFFAOYSA-N
N(C1C2CCC1CCC2)C(=O)CC3=CC(=C(C=C3)Br)Cl,4CB2D78A22140DF3_019A62BE610EF7AB_6038_UN,7.1051893,00000000000000000001000000000000000000000000001000000000000000000000000000000000000000010011100010000001110100110000011000000000110011100000000011010011001110100111110,QODFJVCZVGSXDZ-UHFFFAOYSA-N
N(C1C2CCC1CCC2)C(=O)CC3=CC(=C(C=C3)Cl)Cl,A4676EA5DD1F8AFC_101DEFC05B3957E6_6038_UN,7.105184,00000000000000000001000000000000000000000000000000000000000000000000000000000000000000010011100010000001110100110000011000000000110011100000000011010011001110100111110,PWTPNGXTFUQSPC-UHFFFAOYSA-N
N(C1C2CCC1CCC2)C(=O)CC3=CC(=C(C=C3)Br)Br,4E122D7565181301_473F08A22BBC0194_6038_UN,7.105179,00000000000000000001000000000000000000000000001000000000000000000000000000000000000000010011100010000000110100110000011000000000110011100000000011010011001110100111110,UFCAKZCWKQFXIU-UHFFFAOYSA-N
N(C1C2CCC1CCC2)C(=O)CC3=CC(=C(C=C3)F)Br,F1E63D815AFA1B69_DC40C0CCDDD0047B_6038_UN,7.1051803,00000000000000000001000000000000000000000010001000000000000000000000000000000000000000010011100010000000110100110000011000000000110011100000000011010011001110100111110,AVAZHOCLTBDAOL-UHFFFAOYSA-N
N(C1C2CCC1CCC2)C(=O)CC3=CC(=C(C=C3)Cl)F,C75BE117C0866D34_B0FFAB1EB7CF066E_6038_UN,7.1051745,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000010011100010000001110100110000011000000000110011100000000011010011001110100111110,VZPLJZGWQOMHMI-UHFFFAOYSA-N
N(C1C2CCC1CCC2)C(=O)CC3=CC(=C(C=C3)F)Cl,335C26BF62F79F6D_D5F3796002076351_6038_UN,7.105175,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000010011100010000001110100110000011000000000110011100000000011010011001110100111110,BBKHZWAJTIZUAP-UHFFFAOYSA-N
FC1(CCOCC1)C2=CC=C(C=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,209F0F10F39E19F0_45764CA67DCC1FA3_6041_UN,7.8647246,00000000000000000000000000000000000000000010000000000000010000100010000000010001100101110011010010101000100111011001101011100100110011110110001001011011010011101111110,FMWLLPVXKOZTNS-RTWAWAEBSA-N
N(C1C2CCC1CCC2)C(=O)CC3=CC(=C(C=C3)Br)F,463194AE8143643A_D5B2B3141CEEC26E_6038_UN,7.105176,00000000000000000001000000000000000000000010001000000000000000000000000000000000000000010011100010000000110100110000011000000000110011100000000011010011001110100111110,RAUJZDMHKUZBCT-UHFFFAOYSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)CC3CC4(CCN3)CC4,9271AAF294FE8D97_9C2A17D519002F95_6034_DP,8.520805,00000000000000000000001000000000000010000000000100000000000000100110000000010111011101011001000010101001111100011011001111100100110001110110001011011111010110101111010,QOHFOGDYNCKEDY-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC4=C(C3CNC3)OC=N4,5F1CED4C9B79CE69_4AD92989530B16CC_6041_DP,8.118659,00000000100100000000000000000000000000100010000000000000010000100100000000000101001100110010000111101100010110110000010011000100100101110110001011000111110110101111110,SNUQREOXQTZWOZ-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CC=N2)NCCC4CCN(C3CCN(C)CC3)CC4,2AA8991A5D9C0DE0_7F14B4FF1A58D43F_6041_UN,7.2789674,00000000000000000000000000000000000000000000000000000000000000100100000000010001101101100001010010101100110000010001101011100100110001010110001001011101010110101111010,CMPKJAFIPMKEFS-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)F)NC2C3(C(N(C)C)C2)CCC3)F,527848351BFDECB7_5F76AC4960D6470D_7022_UN,7.654923,00000000000100000000000000000000000000000010000000000000000000000010000000100000100001110011010000000000110110011000101000100000110001110000011010011111000010101111010,MQJXBZRPWVMQKV-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N=CC(=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,5178231D19E194FE_E5BD1F829E071957_6041_UN,8.094731,00000000000000000000000000000000000000000010000000000000000000000100000000000001100001110010010000101100010110010001101001100100110001110100001011011011010110101111010,TZONFRRZTSNDKG-UHFFFAOYSA-N
NC1=C[N](C2=C1C=C(C=C2)Br)CC3C4(CCNC3)CCC4,B3C2BCF600C3279C_CF4C0C328B6EA0A6_6034_DP,8.540941,00000000000100000000000000000000000000000000001000000000000000000110000000010001101111110011000010101100110100011000001011100100110101110110001001011001010110100111010,OEFSXPMIBPEKTH-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C3=C2CC(CC3)(C)C)CC5(CC4=CC=C(C=C4)F)CCNC5,D9AD660D5DE6E248_3AC4E9CD2710B5A6_6034_UN,8.103563,00000000000000000000000000000000000000000010000000000000000000000110000000110000101101110011000010001100110100011001101011100100110000100110011011011101010110101111010,DGLHUZSBDFTSFJ-UHFFFAOYSA-N
NC1=CN(C2=C1C=C(C=C2)Br)CC3C4(CCNC3)CCC4,B3C2BCF600C3279C_6B6E524AA35A055E_6034_UN,8.540932,00000000000100000000000000000000000000000000001000000000000000000110000000010001101111110011000010101100110100011000001011100100110101110110001001011001010110100111010,OEFSXPMIBPEKTH-UHFFFAOYSA-N
ClC1=CC=C(C=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]5C[C@@H]4NC[C@@H]4C5,0ACD66D4B413F0E9_3A2D2CCE5480370D_6034_UN,8.880657,00000000100100000001000000000000000000100000000000000000000000100100000000010101001101010011000010001001110100010000001011100100110100100110001010011011010110100111010,GDMHUPKTPCWMEA-QFDAWVLOSA-N
CN1CCNCC1C2=NC=CN2CC4(CC3=CC(=CC=C3)Br)CC4,25FFDC8054E2C79B_9CF46F0AFBC37736_6034_UN,7.840495,00000000000000000000001000000000000000100000001000000000000000100110000000010101101101110001010010101000100100011001101011100100110000100110001011011011010110101111010,QAAKRZBMNWGAPT-UHFFFAOYSA-N
CC1=CC2=C(C=C1)[N](C=C2Br)CCC3CNC(C3)(C)C,CAF1B375A177AD86_1B8D59F68F3DF481_6034_DP,8.223213,00000000000000000000000000000000000000000000001000000000000000000110000000110000001101010011000010001100110110011001101011100100010000100110011000011101010110101111010,BOPDZYOFUWJUFI-UHFFFAOYSA-N
C[Si](C)(C)C1=C(N=C(C=C1)NCC3CN(CC2=CC=CC=C2)CC34CCC4)F,2BED3FA592851B07_AF411A2B8DC36B41_6041_UN,7.486705,00000000000100000000100000000010000000100010000000000000000000000110000000110100101101110011010010101000010100001000001011100100110001110110011011011111010110101111010,XSQVQOTYIGQUAZ-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)N[C@H](CC)C3=CC(=C(C=C3)C)F,5076430DBFA20FD8_9AA6350676BCB673_6041_UN,7.985696,00000000000000000000000000000000000000100010000000000000000000100100000000010100100101110000010010101000100110010011101011100100010001110100011011011111010110101111010,OCTLOILZMHKJPG-MOPGFXCFSA-N
FC1=CC(=C(C(=C1)F)F)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C,5C30881E4B1A4DC1_825A94B33E743919_6041_UN,9.049899,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101100110011110110001011011111110111101111110,MNSWDNGJABVXOB-HOCLYGCPSA-N
CC1=C(C(=CC(=C1)Br)C)NCC2=NC=CN2CC3NCC4(C3)CCSCC4,3AFADE0B7CF9F018_EBF8DB95FE00DF77_6034_UN,7.745532,00000000000000000000000000000000000010100000001000000000000000000110000000010101001101111011000010101000110110011000001011100100110101110110001011011111010110101111010,WZQSXMMERCCYPJ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(C)CCCN3CC4=CC=CC=C4)C5=CCNCC5,B87B55EB5844E8C6_8583798DD4831B99_6034_UN,8.353807,00000000000000000000000000000000000000000010000000100000000000100110000000011001001101110001000010111100110110011001101011100100110000100110001001011011010110101111010,YGEOYQKNVYWCOB-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2=CC(=NC=C2)OC3CCOC3)F,96CB2223A6177C53_A4FDFC0796AACD2E_7022_UN,8.037184,00000000000000000000000000000000000000000010000000000000010000000100000010100000001101110100110010101000000101100101011011100111010011110110001111011111110111111111110,VPUBVHBQWKXJNM-UHFFFAOYSA-N
CC34CCC(C=CC1=C[N](C)N=C1C2=C(C=C(C=C2)F)F)(CC3)CO4,58534D5C63AC306E_BDF24F68F0FA8FAB_7019_UN,7.618558,00000000000000000000000000000000000000000010000000001000010000100110000000010000100100010000011010110000010101001001101011101100110010100100001011011110110011101111110,PJZGCLAKZNYZBR-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC3C4CC(CC3)OC4,36308607069D9900_B67C9EAC0508DD46_6041_UN,7.778421,00000000000000000001000001000000000000000010000000000000010000000100000000010101001101010011010010001100011111000000001011100100110011110110001011011011110111101111110,ZQPLOYJQMOUDCR-UHFFFAOYSA-N
CN3CCC(C)(COCC2COC1(CCCC1)O2)CC3,FCBDA4ADB9D69EF4_F67409FF09EE26EF_6039_UN,7.199361,00000000000000000000000000000000000000000000000000000000010000000010000010010000000101100100010010101000010011011001101011110010110010000110000000111100110101111101110,OVGXLWYVQRDOJH-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=C2C3CC3)CCC(C)C4=CC5=C(C=C4)CCCC5,E49CC351063C4A4D_F09D4E24AC924985_6034_UN,8.419262,00000000000000000000001000000000000000000000001000000000000000100100000000010000000101010000000010001100010100010001101001100100110000100100000011011000010110101111010,QAYMUKWRURRGSO-UHFFFAOYSA-N
FC1=CC2=C(C(=C1)F)C=CC(=N2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,1F2A5BE6ACE249C5_AEDD76B0E9485D0A_6041_UN,8.760056,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101100010100010000001011100100110001110110001011011011010110101111010,OEWIGSBQNRSMLC-PEBXRYMYSA-N
C(C1(CC=C)CCCC1)=CC2=NC3=C([N]2C)C=CC(=C3)Cl,9E7134F7FEF06036_D9F24FB590FF58E2_7019_UN,8.223413,00000000000000000000000000000000001000100000000000000000000000000110000000010101000101010000010010010101010100001000001011100100110000100100001010011010000110101111010,YZCZKNMQFKFRDR-UHFFFAOYSA-N
CC1=NC4=C(C(=C1)NCC2N(C)CC3(CC2)CC3)C=CC(=C4F)F,2D60F4D8300AB517_E4C63988D773E04A_6041_UN,7.80587,00000000000000000000001000000000000000000010000000000000000000000110000000010001101001110011010000101100010110011001101011100100110001110110001011011111010110101111010,SPNJPQUJWOSLPG-UHFFFAOYSA-N
CC1=C(C=CC(=C1F)NC(C2CNC2)C3=CC=C(C=C3)F)C#N,FF001EB282A1B18B_D37A8391212CC2E0_6041_DP,7.7495303,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110010000000001000000100000000000001000100000101110110001011000011010010101111010,SYXUVFOCFIOFFP-UHFFFAOYSA-N
CC2=C(C=C1N=C(C(=CC1=C2)C)NCCC3CC(C)OCC3)C,82FFF1289D886696_7AEAC6F7B0DEDF7C_6041_UN,7.777201,00000000000000000000000000000000000000100000000000000000010000000100000000000100001000000001000000101100110011010001101011000100110011010110011011010111110111101111110,QQXBTASKOVCJGY-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2C[C@H]3[C@@H](CNC3)C4CCOCC4)C5CCNCC5,23246FF3BF84E4B4_3B905F43614FB6A2_6034_UN,8.787716,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011000010101100110101010000001011100100110110100110001001011011010111100111110,QAGGSYGQCWTDNL-RXVVDRJESA-N
C(C1CN1CC2CC2)=CC3=C[N](N=C3C)C4=C(C=CC=C4)Cl,717922510966AEA1_6859A853852FAAF7_7019_UN,8.367607,00000000000000001000001000000000000000000000000000001000000000100100000000010000100101110000001010011001000100000000000011101100110001110110001010011010010110101111010,HNAFIZXBWOBIJZ-UHFFFAOYSA-N
C(C1CN1CC2CC2)=CC3=C[N](N=C3C)C4=C(C=CC=C4)F,7BB0037A72FFAF41_25EF728B87F3FBCE_7019_UN,8.367593,00000000000000001000001000000000000000000010000000001000000000100100000000010000100101110000001010011000000100000000000011101100110001110110001010011010010110101111010,CRCITIJHEUPHAR-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NCC2CCCN(C)C2C3=CC=CS3)F)C4,13C6B11130AEDB2B_AB90DA329825E64E_6041_UN,8.042265,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101100010110010011101011100100110001110110001011011111010110101111010,QMZOMFQHBXTGSP-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC4CNC3(CCC3)C4)Cl,93A9617DA886BEF3_75981CA932DA7980_6034_UN,7.307903,00000000000100000000000000000000000010000000000100000000000000000110000000010110111101011011000010001001111110011000001111100100110101110110001010011011010110101111010,JXBUEIKTEYDCSL-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC(CC)CC3=CC=C(C=C3)F,88731E55D37ED632_E716CF3A7B59BF95_6041_UN,7.5795655,00000000000000000000000000000000000000100010000000000000000000100100000000010100100101110000010010101000100110010011101011100100010001110100001001011111010110101111010,RYXPPKKENXXVME-GGYWPGCISA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCCC2CCOC3=C2C=CC=C3,6E5343A2BF81F111_899EC7DC9AC64780_6041_UN,7.4912167,00000000000000000100100000000010000000000000000000000000010000000100000000100001001000100001010000101100110001011100001011000100110011010110011011011111110111101111110,QHOLZDMELHENQE-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CC2(C)CCCNC2)C=CC(=C3)Cl)C4,781D81AAD47D5110_B2BF2347A1A5534B_6034_UN,7.755271,00000000000000000000000000000000000000000000000000000000000000000110000000010000101101110011000010101101110110011011101011100100110101100110001011011101010110101111010,ZRMWSRRKMQIQIC-UHFFFAOYSA-N
N4CCC1(CCC1)C(C=CC2=C[N](N=C2C)C3=CC=C(C=C3)Cl)C4,41B09243E5BBB07E_013736059FFDF2F8_7019_DP,8.025144,00000000000100000000000000000000000000000000000000001000000000100110000000010000101100110001001010111001110100011000001011101100110001110110001011011011010010101111010,YSZUPMSJCARTNB-UHFFFAOYSA-N
N4CCC1(CCC1)C(C=CC2=C[N](N=C2C)C3=CC=C(C=C3)F)C4,9627EC55A13FE6E5_23C88F9B52FB16F8_7019_DP,8.025138,00000000000100000000000000000000000000000010000000001000000000100110000000010000101100110001001010111000110100011000001011101100110001110110001011011011010010101111010,ZRFNCCJOBFKJDT-UHFFFAOYSA-N
CC(N)C2=NC1=C(C=CC(=C1)Cl)N2CC3CNCC3OCC,0198E8275528FC6A_E5A74126673CAEB9_6034_UN,8.903253,00000000000000000000000000000000000000100000000000000000000000000100000000010101101111110011000111001101010111000010000011100111110110100110001110001111110111101111110,ZGTNLFPMECVVSA-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=CC2=O)CC3NCC4(C3)CCSCC4,BF94EFED9F7DD867_55DA21CAF46136C2_6034_UN,8.583319,00000000000000000000000000000000000010000000001000000000000000000110000000010001001101111011000011101100110100011100001011100101110000100110001101011001111110100111110,MQFAVHQGBWUPRZ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(C)C(OCC3)C4CC4,C28FA85FD61EBE6D_159218187D0F2F8B_6041_UN,7.6947126,00000000000000000000001000000000000000100000000000000000010000100110000000000100001100000011000011101100010011001001101011000100110011010110011011010111110111101111110,RPGDOCFNQWVWOL-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC34CCCC3(OC)OCC4)Cl,0458FE7B1C924904_1D573128692D278D_6034_UN,7.536147,00000000000000000000000000000000000010000000000100000000010000000110000000010110010101011011010011001101011111001000101111110111110011110110001110011111110111111111110,UXZMCQAJVOYSLG-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCCC3CCCN(C)C3,1D3FA0A8D573BAB0_F5EC110E3FF41185_6041_UN,7.62686,00000000000000000000000000000000000000000010000000000000000000000100000000010001001001110001010000101100110110010001101011100100110001110110001011011111010110101111010,YCTNARQWQXVIEL-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4(CC4)C5=CC(=C(C=C5)F)F,A04F74B113D09B04_0276A64EA69F1B3B_6041_DP,8.315712,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011000000011100100110101110110001011011011010010101111010,JDAJOCQMHYFHSE-NCNPBXTDSA-N
O(C1C2CCC1C3CNCC23)C4=C(C=C(C=C4)C(F)(F)F)C#N,36D4AFD3359384E2_5DE9237A70A9F0D7_6035_UN,8.542844,00000000000000000000000000000000000000000110000000000000000000000000000000000000001100100001000011001100011100001100001001000011110000100110001111010011110001100111110,YAGJNJIUNHIMEB-UHFFFAOYSA-N
N4CCC1=C(C(=CC=C1)NC[C@@H]2CCCN(C)[C@H]2C3=CC=N[N]3C)C4,5882A89916F6087C_7CD223E44D5C0DE1_6041_DP,7.71978,00000000000000000000000000000000000000000000000000001100000000100100000000010001101101100011011010101100110010010001101011101100110101010110001011011111010110101111010,RLVRLQUOIXTAFP-OXJNMPFZSA-N
FC2=C(C=C1OC=CC1=C2)NC[CH]4C[C]3(C[C](C)(C3)C)C4,A49C49508AA3B106_F065E4323950FB6C_6041_UN,7.797576,00000000000100000000000000000000000000000010000000000000010000000010000000100000001100010010000011001100010110001001000000000100100001110100000010000111110110101111110,CXJFCPPTBNWUKY-UHFFFAOYSA-N
CN(CC1CCNC1)CC2=NC=C(N=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,6D76F1B61CCB4A8B_CF5603645CAF5B62_6041_DP,8.012146,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100110101110110001001011111010110101111010,BEBTVROEWKYBPQ-RGMQVPTHSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4(CCCCC4)C5=C(C=C(C=C5)F)F,83720044DF1F993D_CBF5286B2F99D0E6_6041_DP,8.040992,00000000000000000001000001000000000000100010000000000000000000100110000000000100100101010011010010100000111100011000101011100100110101110100001011011011000010101111010,YNPGIKUNQWMBCJ-REPLKXPHSA-N
CC1=CC(=C(C=C1)F)NC2(CC2)C45CC3CC(CC(C3)C4)C5,B7DE066920C6FC94_66EE3DC1E1BA6A2B_6041_UN,8.101215,00000000000000000000001000000000000000000010000000000000000000100010000000000000000000010010000000000100110100011000000000000000110001110000000011010011000010101111010,IEUMUZFELPXXPV-UHFFFAOYSA-N
CC1=C(C=CC2=C1CCC2)NC3=CC=C(CC[Si](C)(C)C)C=C3,FD8E24A9FBEE83CD_95EDFBB50540FF15_6041_UN,7.7243514,00000000000000000000100000000010000000000000000000000000000000000000000000100000000000100001010010000100010010001001101000000100010001010000010011011111010110101111010,BRHZESJKPMPYMT-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CN(C2=C1C=CC=C2)CC[N]3N=CC=C3C4CCNCC4,D53FC7C7880574E0_96AB6E14D2B85845_6034_UN,7.975649,00000000000000000100100000000010000000000000000000001000000000100100000000110001101101100001011010101100110000011000001011101100110000000110011011011111010110101111010,MPZVKDVPWIHLCI-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCCCN3C4CC4,994692FEF9C099B8_C65DD4CA77E86F21_6041_UN,7.5276194,00000000000000000000001000000000000000100010000000000000000000100100000000010101001001010011000000101100010110010000001011100100110001110110001011011111010110101111010,UAYHQCSYQAKLAQ-UHFFFAOYSA-N
ClC2=C1C(=CN(C1=NC=C2)C[C@H]3OC(C)(CNC3)C)CC4=CC=CC=C4,36E27323AEEBFDAC_3B598BFADAF8C996_6034_UN,8.207275,00000000000000000000000000000000000000100000000000000000010000000110000000110100101101110010000110101101010110001001000011100100100010100110001001001101110111101111110,XYSKLCJGPGDXSD-KRWDZBQOSA-N
O[C@@H](CCl)C1=CC=C(C=C1)NC24CC(OC23CCNCC3)(C)C4,E3590E028AC708A7_D62ABDAD5373B496_6041_DP,8.558014,00000000000100000000000000000000000000000000000000000000010000000010000000000000001100100011000111101001110010011001001011000000110111110111001001010001110111111111110,YUNPRRIUJGTWAN-GTPINHCMSA-N
FC1=CC2=C(C(=C1)F)C(=C(C#N)C=N2)NCC3C4(CCNC3)CCOC4,DBA53453125E24BD_6BEDB71BE323FB84_6041_DP,8.23731,00000000000000000000000000000000000000000110000000000100010000000110000000000000101100110011000010101100110101011000001011000100110111110110001011010011010111100111110,MTFCAHDIBREMER-UHFFFAOYSA-N
C[N]1C=CN=C1C(NC(=O)CC2CC3CCC2C3)C4=C(C=C(C=C4)F)F,15CB0F283394BA62_66802DA59E0AFD89_6038_UN,8.048955,00000000000000000000000000000000000000100010000000000000000000000100000000010101000101010001110010000000110100110000011011100100110010100100001011011011001110101111110,OLHPGYVYLITFTC-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3=C(C=C(C(=C3)F)N4CCOCC4)F,82F927AA35A2D325_BBB9CB2111B20754_6041_UN,7.764287,00000000000000000000000000000000000000100010000000000000010000100100000000010100100101110000010110101000000111010001101011100100110011110110001011011011010011101111110,JLZUMIIEJMTNBF-SFHVURJKSA-N
FC2=C1N=CC=C(C1=CC=C2)NC4=C(C=C3OCCOC3=C4)[N](=O)=O,E878B1B861C5B0CB_AB51C9A116154325_6041_UN,8.271245,00000000000000000000000010000000000000000010000001000000110000010100001110000001100000010000001001100110010101000100001111101100001011110110101011111011110011110111110,XBKBWVVYSHOHAN-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NCC23CC(C)(CO2)CCC3)C=C,8A409EC2F0407D3E_E881CF251015D99E_6041_UN,7.019376,00000000000000000001000000000000001000000010000000000000010000000010000000000000001100010011000110011000010111001001101000000000110011110110000011010011110111101111110,YHSBMKSHDFZCPB-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC(C)COC3CCOC3,11817D4AE63FFFB8_E58FE196FEC58F9F_6041_UN,8.561738,00000000000000000000000000000000000000100000000000000000010000000100000010000100000100100100000110100100110001010001001011000111110011010110011111010111110111111111110,JLYFZOLHFNZWKW-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C(C3CC3(C)C4=CC(=C(C=C4)F)F)=O,8AE581BEF8444C6F_D817BBCE008C8C6B_6038_UN,7.907593,00000000000000000001001000000000000000000010000000000000010000100010000000010001001101110011100110101000110100111001111011100000110010100110001011011011111111111111110,OPJBXRGNDRIYJQ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@H]3[C@H]2CCCCN2CCC3)Cl)C4CC4,014847773E23725C_7F28E45702EF0800_7022_UN,7.6521673,00000000000000000000001000000000000000000000000000000000000000100000000000000000101001110011000000101101010110010000001001100000110001110110001011011011010110101111010,ORIGPGPYTNMXDU-OXJNMPFZSA-N
C[Si](C)(C)C1=C(C=CC=C1)NCC2N(C)CC3(CC2)CCC3,8F916CB5AAA115A0_77679900E19538D2_6041_UN,7.641695,00000000000100000000100000000010000000000000000000000000000000000010000000110001001001100011010000101000010010011001101001100000110001010110011011011111010110101111010,GTOVVAKSWTXYNC-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC4(CCCC4)C5=C(C=C(C=C5)F)F,87A055929E28CE56_1E1ACC72CFCA5309_6041_DP,8.0367365,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010010101111010,WZMAOKWRWVMSNZ-DBIVSCPCSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3C4CCC(CC3)C4,8A3CF84DE27B42B5_9C52E5C8D3B01571_6041_UN,8.415336,00000000000000000001000000000000000000000010000000001000000000000100000000010000100100010011011010000100110100010000001011101100110001110100001001011001000010101111010,DLFBRJLSGNVHOY-UHFFFAOYSA-N
FC1=CC(=NC=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,642E4800DC032AAB_1642AB9D33F6D594_6041_UN,8.372464,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,WXQXUMPEBAXDOI-ACJLOTCBSA-N
FC1=CC3=C(C(=C1)NCCC2CC(C)CC(C2)(C)C)OC=C3,A6D4FD24912D6BD1_339D96A2F9AD9873_6041_UN,8.058791,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010001000110001100110110011001001000000100110001110100010001010101110110101111110,LWPDIPIDVOUZGP-UHFFFAOYSA-N
CC3=NC2=C([C@H]1CCCN[C@H]1CC2)N3C[C@H]4[C@@H](CCNC4)C5=CC=C(C=C5)F,24772A8DC2203955_8600F7952BA8F24F_6034_UN,7.5626845,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101100110110010000101011100100110100100110001011011011010110101111010,HTHBBMOAHJQTTM-VMXMFDLUSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)CC3C4(CNC3)CCC4,63D06DC71395AB56_3BADE90D1F20BAC2_6034_UN,8.402212,00000000000100000000000000000000000010000000000100000000000000100110000000010110111101111011000010001001011100011011001111100100110001110110001010011111010110101111010,HWRZEPVYLYWPST-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC3CC(C2=NC=C[N]2C)OCC3)C4CC4,BED139381511B840_4BAAA322E248E2ED_6041_UN,7.8871984,00000000000000000000001000000000000000100010000000000000010000100100000000010101000101010011010111100000100111010000001011100100110011110100001011011011110011101111110,HTUVDIWXUNPCAY-UHFFFAOYSA-N
N(CCN1CC2C(C1)C3CCC2C=C3)C(=O)C4CCOC5=C4C=CC=C5F,95394F5A406F65EA_6297AE1B83D5CEB9_6038_UN,8.103143,00000000000000000000000000000000000000000010000000000000010000000000000000010001001101110011100010111100110101110100011011100000110010100110001011011001111111110111110,HRUXIJBTDJYEBW-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C)Cl)C4CC4,B549FDF3EB47EFCF_D3D5FE60F0353338_7022_UN,8.214607,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101110011010010101001000110010001101011100100110001110110011011011111010110101111010,BQUYFZBTMBAZMK-HRAATJIYSA-N
FC2=C(C=C1C=COC1=C2)N[C@H]4CC[C@@H](N3CCN(C)CC3)CC4,DC975DE072FED41A_80A4DA9EE6C50399_6041_UN,7.575471,00000000000000000000000000000000000000000010000000000000010000100000000000010001000101110010010010101100110100010001101011100100110001110110001011011011110010101111110,ZDPCWFDXZOGHGR-IYBDPMFKSA-N
C1(=CC2=C(C=C1)C(=O)CCC2)NC3=CC=C(SC)C=C3,4C26C6076A91BE0F_A81EE31DECD13705_6041_UN,8.912406,00000000000000000000000000000000000000000000000000000000000100001000000000000000010000001001010000000100010000000000001000000101100011010000000111010001101010101111110,NAGDJIUMMWUCEG-UHFFFAOYSA-N
C1(=CC2=C(N=C1)C(=CC=C2)F)NC3CCN(C)C4CCCC34,B05B014FAA63FD1B_7F2A17EA513EA768_7022_UN,8.466687,00000000000000000000000000000000000000000010000000000000000000000100000000010001100001110011010010101100110110010001101011100100110001110100001001011001010010101111010,WVVGTCJSRKGEDP-UHFFFAOYSA-N
C(CCC1CO1)=CC3=CC(=C(N2CCN(C)CC2)C=C3)F,A6B25F14EDA53189_317DF61B81D05C8A_7019_UN,7.6551704,00000000000000001000001000000000000000000010000000000000010000100000000000010001000001110000010000111000000101010001101011100000110011110110001011011010110111101111110,WKTWTGGKNDWPJO-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NCC3(CCCCC3)N4CCSCC4,E7B2E4B6D01EA799_70C738923F6DC18A_6041_UN,7.931118,00000000000000000000000001000000000010000010000000000000000000100110000000010101001101111011010010101100011110011000001011100100110001110110001011011011010110101111010,PMMGEQMKAIDONX-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C(C3=CC=C([N]3C)C4=CC=C(C=C4)F)=O,E70B1DD9D66139C5_EAF8D71CB88A1788_6038_UN,7.7808447,00000000000000000001000000000000000000000010000000000000010000100100000000010001001101110001110110101000110100110000011011100100110010100110001011011011111111111111110,FWVIWVDGPQHDCF-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)F)NCC2(CN(C)C)CCCC2)F,007C7C8F558E7231_096D2A88C26F3307_7022_UN,7.7797422,00000000000000000000000000000000000000000010000000000000000000000010000000100000101001110011010010001000000110001001001000100000110001110010011010011111010110101111010,ZCCWCMSOMQAASP-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC3CCCC(CC)C3,3C1214EC2A8D334E_0401839019FAF29B_6041_UN,8.026602,00000000000000000000000000000000000000000010000000000000000000000100000000000001000000010011000000100100110110010010101001000100110001110100001011010111000110101111010,AUOZRCFLNAHEMY-UHFFFAOYSA-N
N2CCC(OC1=CC(=C(C=C1Cl)C#N)C)CC2C3=CC=C(C=C3)F,078D3A811B33A0FB_DF262C7C9F31338C_6035_DP,7.7518806,00000000000000000000000000000000000000000110000000000000000000100000000000000000001000010001000001101001100100010100001001000111110010100100001111010011110011101111110,YPWCWRGRGJRBCQ-UHFFFAOYSA-N
CC(C)C1=CC(=C(C=C1)NCC2C3(CC2)OCCC3)F,64D0E258CF23EC83_A8620F88CEE548BC_7022_UN,7.8355174,00000000000100000000000000000000000000000010000000000000010000000010000000100000001100010011000011001000010101001000001000000000110011110110000010010111110111101111110,XYMBMKLBORSDBQ-UHFFFAOYSA-N
C(C2=NC1=C(C=CC=C1)[N]2C35CC4CC(CC(C3)C4)C5)=CC6=N[N](C)C(=C6Br)Cl,C9F01619D19521C4_B902A4F2A9376284_7019_UN,8.384001,00000000000000000000000000000000000000100000001000001000000000100110000000010101100101010000011010010101010100011000000011101100100001100100001011001010000010101111010,GVNYDLAIHUVCCR-UHFFFAOYSA-N
N3CCC(C=CC1=C[NH]C2=C1C(=CC(=C2)F)F)(CC3)C#N,E1C22E60639020EE_63F712E2202A4411_7019_DP,7.410181,00000000000000000000000000000000000000000110000000000000000000000110000000000000001100110001000010111100110100011000001011000100110100100110001001010001010010100111010,KNFZAFGGJPPBRK-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NC[C@@H]3CCO[C@H]3C=C)C,4BD2D4631ACCA237_7035356B8F46F421_6041_UN,8.18076,00000000000000000000000000000000001000000010000000000000010000000100000000000000101100010011000011111100010111000000001011000100110011110110001011010111110111101111110,HOCJSJAGNVMHGY-BBRMVZONSA-N
CC1=C(N(C(=N1)C2CNCCC2)CC(CC3=C(C=CC(=C3)Br)F)C#N)C,706B7F3849D55691_71C41D8137B11D7D_6034_UN,8.210899,00000000000000000000000000000000000000100110001000000000000000100100000000010101101101110011000010101000100110010000101011100100110000100110001011011111010110101111010,AEDLVTFFKLBSQR-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4=CC(=C(C(=C4)F)F)F,610A05475BBC496F_2AF9F5A7B24448F1_6041_DP,8.325574,00000000000000000001000001000000000000100010000000000000000000000100000000000100100101010011010010100000111100010000101011100100110101110100001011011011000010101111010,JMBQCRDBSRSEJN-PTEHBNRSSA-N
CCC4CCC1=C(C3=C(N1CC(OCCC)C2=C(C=C(C=C2)F)C)C=CC(=C3)C)C4,38D31533BA21C7C9_20EDB52C815C2203_6034_UN,8.251854,00000000000000000000000000000000000000000010000000000000000000000100000000010000000101010000000110001100010111010011101001100110110010100110010011011110110111101111110,DTOWBRFMZAJDFC-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NC[C@H]2CCCNC2,09203AB4F3D134C5_1C9E0D0A1D9BF443_6041_DP,7.7579594,00000000000000000100100000000010000000000000000000000100000000000100000000100001101000100011010000101000100000011000001011000000110101010110011001011101010110101111010,AOUKNPLGTZZEPQ-HNNXBMFYSA-N
CC2=CC1=C(C=C(C=N1)Br)N2CC[C@H]4[C@H]3C[C@H](C3(C)C)CC4,FA84CE1D9ED47C4F_0DFFEE9DFB2C0BF7_6034_UN,7.8305326,00000000000100000000000000000000000000000000001000000000000000000110000000110001100101010000000010101100010110011000101011100100110000100100011011011110010110101111010,JQKLCMDUGCFUGT-SQWLQELKSA-N
CC1=C(C=C(C(=C1)NCC2(C)CC3CCC2C3)Cl)C4CC4,5AEE9DB46A2218D1_90E2DA29CF5DB1A2_7022_UN,7.3410687,00000000000000000000001000000000000000000000000000000000000000100010000000000000001000010011000010001001010110001001101000000000110001110000000011010111010110101111010,ULMCNWGPUYZVFB-UHFFFAOYSA-N
CC4=NC1=C(C=CC(=C1)NC2CC3CCC(C2C)N3)[NH]4,42679FD89E4817A5_C33D6A14350CA896_6041_DP,8.276006,00000000000000000001000000000000000000100000000000000100000000000100000000000101100100000011000010100100110010010000101011000100110101010100001001010111000010101111010,YEWFHWSRIZFTIM-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NC2=CC=CC(=C2)CC3CCCN(C)C3)OC=C4,05EF086165463AE1_1B23F77A74186438_6041_UN,7.4560046,00000000000000000000000000000000000000000010000000000000010000000000000000010000000101110001010110101100010110010001101011100100110001110110001001011001110110101111110,JSFYJLQYDNKRCH-UHFFFAOYSA-N
CC1=C(C4=C(N1C[C@H]2[C@@H](CCNC2)C3=CC=C(C=C3)F)C=CC=C4)CC#N,80D70EF320782075_4DE326434BDF730E_6034_UN,7.4931593,00000000000000000000000000000000000000000110000000000000000000100100000000010000101101110011000010101100110100010000101011100100110000100110001011011011010110101111010,DIBYKGYNQWQNIO-RXVVDRJESA-N
CN(CCCC=CC2=CC1=C(CCNC1)S2)CC3=CC=C(C=C3)F,C67639A93035802A_978922DDD84A7A5F_7019_DP,7.382759,00000000000000000000000000000000000010000010000000000000000000000000000000000000011101111001010010111100110110010001101011100100110000100110001011011001010100101111010,XVXTXINNZGCDRE-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4=CC(=C(C(=C4)F)I)F,BBB23E9CD126F058_8DFE016AE3AA1E88_6041_DP,8.32541,00000000000000000001000001010000000000100010000000000000000000000100000000000100100101010011010010100000111100010000101011100100110101110100001011011011000010101111010,HTZSPAKXXGRTNZ-PTEHBNRSSA-N
FC2=C1CCCC1=CC(=C2)NCC3CCN(C)C3C4=CC=CS4,D0DA3999CAB836E5_D9666193369BA462_6041_UN,7.7671647,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010001100010110010001101011100100110001110110001010011011010110101111010,UHXZIZLNLNSEHE-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,A32826FE36C3CC18_D94943E4F8FD5BBF_6041_DP,7.9418955,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101110011010010101000110110010001101011100100110101110110001001011111010010101111010,XWOOFKXMZRGESI-BVBVCZNISA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=NC=C3)N[C@@H]4C6=C(OC5(C4)CCCC5)C=CC(=C6)F,912D395C5EA81F54_AE71E8D04DDDC69F_6041_DP,8.64118,00000000000000000000001001000000000000100010000000000000010000000110000000000100101101110001010011101100111110011100001011100100110111110110001011011001110011101111110,WDQRFZKTDRWKJN-YQMJFVBQSA-N
FC1=NC(=C(C=C1)C#N)NCC2CNCC3(O2)CCC3,E748F5EF730D04CF_0346181323A44426_6041_DP,8.020897,00000000000100000000000000000000000000100110000000000100010000000110000000000100101000110011000100101000010100001000001011000000110111110110001011010011110111100111110,MRSQPCQXEHCMFL-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@H]2[C@@H]3CNC[C@H](C2)C3)Cl)C4CC4,4A8449658F25CBCC_8D52FF25D3865BF0_7022_DP,7.1710787,00000000000000000001001000000000000000000000000000000100000000100000000000000000101000110011000010101001110110010000000001000000110101110110001011010011010010101111010,MTGSEDVVJCCVSA-DETPVDSQSA-N
FC1=C(C2=C(C=C1)C=CO2)NC3CCN(C)C4CCCC34,1BAC9215DA31D198_5C252445C7DE6E95_6041_UN,8.678433,00000000000000000000000000000000000000000010000000000000010000000000000000010000100101110011010110101100110110010001101011100100110001110100001011011011110010101111110,WQHYNZOPPQIPMS-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC3(CC3)C4=CC(=CC=C4)F,D0071A461F0D39D8_B1BAE111884FDA8D_6041_DP,7.4652147,00000000000000000000001000000000000000100010000000000000000000100110000000010101101101010011010010101000100110011000001011100100110101110100001011011011010010101111010,HNAZGAVWTNKTDN-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC(C3CCNCC3)F,311FEF2A503E0E11_3208D15E93D6ACE5_6041_DP,7.722821,00000000000000000000000000000000000000100010000000001000000000100100000000010101101101100001011010101000100110010000001011101100110101110110001011011111010110101111010,SXYLAUNTGJZPSL-UHFFFAOYSA-N
C1(=NC(=NO1)C2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,E86593D4F523D224_6FB6D3889EDF8D57_6041_UN,7.711064,00000000000000000000000000000000000001100010000000000000010000100100000100010101100101110011011111101010101111110001111011101100110011110110001001011011010011111111110,YAQYDNBFLZGNMY-CVEARBPZSA-N
IC1=CC2=C(C=C1)C(=O)C(=CN2CC3NCC3(C)C)C#N,A975F1CA00BB1A2C_5E58499DB330626E_6034_UN,8.12132,00000000100100000000000000010000000000000100000000000000000000000110000000110001101001010011000001101100110100011101100011100101010000100110001111001111111110101111110,PZNWAAPOBYQJMN-UHFFFAOYSA-N
NCC(COC1=C(C(=CC=C1)C2CNCCC2)F)C3CCOC3,32D5DBBE87209C3A_524C7D23CF10FFAF_6035_UN,8.331073,00000000000000000000000000000000000000000010000000000000010000100000000000000000001110110011000011101000100101010100001011000011110110100110001111010011110101110111110,OGCAIMHXFPFVAP-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C(=O)C3=C[NH]C4=C3C=C(C(=C4)Br)Br,63987A9105879E29_64F35BE34E1C8DF6_6038_UN,7.5457892,00000000000000000001000000000000000000000000001000000100010000000100000000010001101101110001100111101100110100110000011011100100110110100110001011011011111111110111110,BDXFJXHKCRHBCV-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CC3=C(C(=CC=C3)Cl)Cl,A328052DEF9CA077_5F9B7E992C9C1D7E_6038_UN,7.1238046,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010010100000001101110100110000011000000000110010100000000011010011011110100111110,SAUKQNIXKMJMSJ-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CC3=C(C(=CC=C3)Br)F,23D5ABCC94E18D2F_A3E983E31E16FF72_6038_UN,7.123801,00000000000000000000000000000000000000000010001000000000000000000000000000000000001000010010100000001100110100110000011000000000110010100000000011010011011110100111110,KIKKWIJLVZFCHT-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CC3=C(C(=CC=C3)F)F,A8F6ABDA32F241E2_482A165F1C38B082_6038_UN,7.1237965,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010010100000001100110100110000011000000000110010100000000011010011011110100111110,RTKVZERVBWTFDS-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CC3=C(C(=CC=C3)Cl)F,98243A14A46C177B_910F0D8A57B1BA93_6038_UN,7.1237884,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010010100000001101110100110000011000000000110010100000000011010011011110100111110,RIKLQPZTQXVQRJ-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NCC2CCN(C(CC)C)C2)C3CC3,C8109466A8A07B70_2CFD534FF5382167_6041_UN,8.28865,00000000000000000000001000000000000000000010000000000000000000100000000000010000101101110011000010001000000110010011101001100000110001110110001010011111010110101111010,BWSHWWDJCJESGI-UHFFFAOYSA-N
CC3(C)CCC(OCC2CCC1(CCNCC1)O2)C(C3)C#N,90B9D7E88F60EADA_6169F60AC964CDEF_6039_DP,8.028215,00000000000000000000000000000000000000000100000000000000010000000010000010100000001100100001000011101000110001011001101011000011110010000110001101010111110101111101110,SFHCJXYAPDGEMP-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1C[C@H]3N[C@H]2CCC[C@H]2C3)C=CC(=C4)Br)C5,8CBD8ABA43496320_345458EA04A39117_6034_UN,7.6473002,00000000000000000000000000000000000000000000001000000000000000000110000000110001000101010011000010001100110100011001101011100100110000100100001011011101010110101111010,SUNZDXWZAMTWRE-QOKNQOGYSA-N
N(CC2=CC=C(CN1CCOCC1)O2)C(C45CC3(CC(CC(C)(C3)C4)C5)F)=O,DBFBC4B0F195C591_B06C2A595AD6B172_6038_UN,7.0464187,00000000000000000000000000000000000000000010000000000000010000000010000000010000001101110010100110101100010111111001011011100000110010100110001001111001111111111111110,DWUZATCXCKOTPM-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)C4CC(F)(C4)C5=CC=C(C=C5)F,C2A52AFF30BE56EF_E4E182B53D672ADE_6038_UN,7.485388,00000000000100000000000000000000000000000010000000000000000000100010000000000000001000010010100010001000010100101000011000000000110000100000000001010001011110100111110,MCRKLNQTSADBLG-UHFFFAOYSA-N
C1CC(CCN1)C2=CC3=C(C=C2)N(C=C3)CC4=CC(=C(C=C4)Cl)N,EB779B1971CC1BB2_99E5C17DF66925F0_6034_UN,8.652849,00000000000000000000000000000000000000000000000000000000000000100100000000010000001111110001000010101101110100010000001011100100110101110110001011011011010110100111010,KRDBKQWOAJOBSW-UHFFFAOYSA-N
C1CC(CCN1)C2=CC3=C(C=C2)N(C=C3)CC4=CC(=C(C=C4)Br)N,03582A6CB7A617E3_C8469EEB32DA9AA0_6034_UN,8.652827,00000000000000000000000000000000000000000000001000000000000000100100000000010000001111110001000010101100110100010000001011100100110101110110001011011011010110100111010,CDHBRHAIPUAICO-UHFFFAOYSA-N
C1(=CC(=CC=C1)C2CCCCC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,9EC492AD03BBADEA_A391F1B16226D912_6041_UN,8.003134,00000000000000000000000000000000000000000010000000000000000000100000000000010001100101110011010010001000100110010001101001100100110001110100001001011011010010101111010,SLLXMHGDMATNET-PKTZIBPZSA-N
FC1=CC(=C(C=C1)NC2=CC=CC(=C2)CC3CCCN(C)C3)C4CC4,61DB434581EB39C5_265818100185D8B5_6041_UN,7.5264325,00000000000000000000001000000000000000000010000000000000000000100000000000010000000001110001010000101000000110010001101001100100110001110110001011011011010110101111010,CDBIKDVJQYMOGD-UHFFFAOYSA-N
FCC[N]1N=CC(=C1)C=CC4=C(OC3C2(CCC(C2(C)C)C3)C)C=CC=C4,2FA7AFE9662259CC_C68EF2F5BF780FAD_7019_UN,8.193344,00000000000000000000000000000000000000000010000000001000000000000110000000110000100100000000001010011000010010011101101011101111110010100110011111011110110111101111110,IWGFJZIPDIKPJX-UHFFFAOYSA-N
C1(=C(C2=C(C=C1)C=CC=C2)F)NC3=CC(=N[N]3C)C4CCCOC4,04BE8930E8C07717_1CF706D611D9975D_7022_UN,7.808609,00000000000000000000000000000000000000100010000000001000010000100100000000010101100100110000011011100100010101000000001011101100110011110110001011011011010011101111110,TVBUFBNVGXQYLN-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)N[CH]4C[C]3(C[C](C)(C3)C)C4,DE49BC053B5B67CD_D91566FED0897231_6041_UN,8.1245,00000000000100000000000000000000000000000010000000000000000000000110000000100001000000010001000000100100110110011001000001000100100001110100001011000111000010101111010,XFSPVSALKPHFDH-UHFFFAOYSA-N
N(CCN1CC2CCC1C2)C(C3=C(C)C(=C(C=C3)Br)F)=O,5E2D8B5EF32EC044_9CA46F3217570CB4_6038_UN,7.7284536,00000000000000000000000000000000000000000010001000000000000000000000000000010001001101110001100010101000110100110000011001100000110000100110001011011011011110101111110,ZQIAHPPFDHRBQD-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=N1)Br)N2C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,F8C253CAB8F3A1DC_6F872F063E5CCC50_6034_UN,8.254531,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101100010100010000101011100100110001100110001011011110010110101111010,BBUHWQLRGXDKBJ-VFNWGFHPSA-N
N2C[C@H]1CN(C[C@H]1C2)C3=NC=C(N=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,064BB21BE04FEEB5_1B86B20A67051EA8_6041_DP,8.449662,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101100110110010001101011100100110101110110001001011011010010101111010,DSISHHJRSSCJCH-AWQBJMPUSA-N
C[N]1N=C(C=C1NC2(CCCC2)CC3=C(C=C(C=C3)F)F)C4CCCC4,DA66B79549DC5B7D_53E5328B019DA3E9_6041_UN,8.039573,00000000000000000000000000000000000000100010000000001000000000100110000000010101100100010011011010000000100100011000001011101100110001110100001010011011000110101111010,PHQXBGWXLQRNJG-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NCC2CCNC3(C2)CCC3,BD03EE32E3DD2780_5876AADF3C106D83_7022_DP,7.330137,00000000000100000000100000000010000000000000000000000000000000000010000000100000001000100011010000101000110000011000001001000000110101010110011001011101010110101111010,WXJJENGDTRADSS-UHFFFAOYSA-N
CC45CCC(C=CC1=C[N](N=C1C2=CC=C(Cl)C=C2)CC3=CC=CC=C3)(CC4)CO5,7DBCDD4012096388_C2923085C5FFC776_7019_UN,8.134977,00000000000000000000000000000000000000000000000000001000010000100110000000010000100100010000001010111001010101011001101011101100110010100110001011011010110111101111110,BBBBVGPCVZZMNM-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC3=NC=C2CCCC2=C3,3D7A466335EC2E01_9652E58E9EBB9959_7022_UN,7.944002,00000000000000000000100000000010000000100000000000000000000000000100000000100100000000100001010010100100010000001000001001000100010001010100011011011101000010101111010,NHEXHYYNCRLPQF-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CCSC3=CC=C(C=C3)F,20E54A4660F6939E_E9DB45BA7737448B_6038_UN,7.955284,00000000000000000000000000000000000000000010000000000000000100001000000000000000011000011011100010001000110100110000011000000000110010100010000001010001011110100111110,CKXCNKRXGUOXTR-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)OCO2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,CB67EE1764277921_60EFD381A1E4D5C9_6041_UN,8.932297,00000000000000000000001000001000000000000010000000000000010000100100000010010101101101010011010111101100010101010100001011110100110001110110001011011011110111111111110,PRKDFYKYSYXHOJ-YJYMSZOUSA-N
C[C]4(C)C[C]3(C[CH](C=CC1=C[N](C)N=C1C2=C(C=CC(=C2)F)F)C3)C4,54C526012E3167EF_C80760876EF5139D_7019_UN,7.960634,00000000000100000000000000000000000000000010000000001000000000100110000000110000100100010000011010010000010110001001000011101100100000100100011010001110000010101111010,CENARWBCCASXIV-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NC[C@H]4[C@H](C3=NC=C[N]3C)OCC4,B6788388F7B6F200_4E5FA42E65085BEB_6041_UN,7.2121363,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101010011010111001100010101000000001011100100110011110110001010011011110111101111110,NTXZYUWBJBVFPX-SUMWQHHRSA-N
CC2=C1N=CC=C(C1=C(C=C2)NC4C[C@H]3CCC[C@H](N3C)C4)F,2E6B161DA0A86BCC_02A9085A14A1D4E1_6041_UN,7.8403344,00000000000000000000000000000000000000000010000000000000000000000100000000010000100001010001010000100100110110010000101011100100110001110100001001011101000010101111010,VZWRTBVGRCEJQG-GOOCMWNKSA-N
CC[C@@H]3CCN[C@H](COC1=C(C=C(C=C1)CN2CCNCC2)Cl)C3,408D066351FB5461_55C78293E2DDE739_6035_UN,8.735018,00000000000000000000000000000000000000000000000000000000000000000000000000010001001001110001000100101001100111010110101011100011110100100110001111011011110111101111110,HJGUBJATSMLFGI-WBVHZDCISA-N
C1(=C(C=C(C=C1)C2=CC=CC=C2)F)NC3CC4CC3CN4C,FA2576451235B833_D9FE57A43811C0F7_7022_UN,7.7601275,00000000000000000000000000000000000000000010000000000000000000100000000000010000100101110011010010101000110110010001100001100100110001110100001011001011010010101111010,LQOTXQOOCMYAOK-UHFFFAOYSA-N
FC1=CC3=C(C(=C1)NCC2CCCCN(C)C2)N=CC=C3,B8776A9C27895F83_7DFB9BCFABECDB70_6041_UN,8.280173,00000000000000000001000000000000000000000010000000000000000000000100000000010001101001110011010000101100010110010001101011100100110001110110001001011001010110101111010,OOGVYTZSVNMIRW-UHFFFAOYSA-N
C1(=C(C=C(S1)Br)I)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,87EFB4263A6E8C8A_0ECCE4FE746CE572_7022_UN,8.2675,00000000000000000000001000010000000010000000001100000000000000000010000000100000011100011011000010001100010100001001101000000100110001110100000011010111010110101111010,QDBBKGAXLWCKGE-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CCCC2CC=C)Cl)C3CC3,77A1187C4A6CA38D_E3DC41AFC3EFD92D_7022_UN,7.9573994,00000000000000000000001000000000001000000000000000000000000000100000000000000000000000010011000010010001100110010000001000000000110001110000000010010011000110101111010,LTCJOODDBYLKGP-UHFFFAOYSA-N
FC1=CC2=C(C(=C1)F)C(=C(C#N)C=N2)NCC4OCC3(CCNCC3)C4,F3F4926E5A7483ED_1D375C2C8FCA167D_6041_DP,8.0023365,00000000000000000000000000000000000000000110000000000000010000000110000000000000101100110011000110101100110101011000001011000100110111110110001011010011110111100111110,BWDXXKZNPZLLND-UHFFFAOYSA-N
C(C1CCOC1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,B86ED32AB52F9FBA_EC1BFC1CFC6DECF2_7019_UN,7.884313,00000000000000000000000000000000000000000010000000000000010000000000000000000000000101110000010010010000000111010000101000100000010011110110000010011010010011101111110,PPGWGCJSGGPWBF-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3(CCCO3)C4CC4,90FE202343D04530_1EEB63FEC2529A8D_6041_UN,8.087241,00000000000000000000001000000000000000000010000000000000010000100110000000000001001100010011000110101100010111001000001011000100110011110110001011010011110111101111110,IWBHYHVYRLNCDJ-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4(CC4)C5=CC(=C(C=C5)F)F,BF905C988B7D2649_A40D2AF7C781A5DC_6041_DP,8.158462,00000000000000000001001001000000000000100010000000000000000000100110000000000100100101010011010010100000111100011000101011100100110101110100001011011011000010101111010,ILJVMLUCICUCMI-MUJYYYPQSA-N
C1(=C(C2=C(C=C1)C=CC=C2)F)NC[C@@H]3CNCC(O3)(C)C,5A2E4D3CB357D125_A3BB99896295D3AF_7022_DP,7.579134,00000000000000000000000000000000000000000010000000000100010000000010000000100000101000110010000100101100010110001001000011000100100111110110001011000111110111101111110,CBHXEBZCDQFLFN-ZDUSSCGKSA-N
FC2=C(C=C1OC=CC1=C2)NC(C3=NC=C[N]3C)C4CCOCC4,3A0EB372947793AE_690FFD81612DBE84_6041_UN,7.9307613,00000000000000000000000000000000000000100010000000000000010000000100000000010101000101110011010011100100010101000000001011100100110011110110001011011011110011111111110,WSYIVLNUWMCFPU-UHFFFAOYSA-N
C(C[C@]12C[C@H]1CCC2)=CC3=C[N](C)N=C3C4=CC=C(C=C4)F,88F00E75BE8B0DDC_8828E18D813A6078_7019_UN,7.7073274,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001011011010000110101111010,MAFQRKFCGHJSAW-APWZRJJASA-N
CN(CC1CCNC1)C2=NC=C(N=C2)N[C@H]3C5=C(OC4(C3)CCCC4)C=CC(=C5)F,B08EFA24387C0B8F_6B1869F02596F075_6041_DP,8.089878,00000000000000000000000000000000000000100010000000000000010000000110000000000101101101110011010011101100110110011101001011100100110111110110001011011001110111101111110,AIICSZOWZZWSAM-LRTDYKAYSA-N
C[N]1C=NC(=C1)C2=CC=C(C=C2)NCC3(CCOCC3)C4=CC=C(C=C4)F,E54805B381CE0C7E_7107F1B2B0E24C42_6041_UN,7.436077,00000000000000000000000000000000000000000010000000000000010000100110000000010101001101110011010010101000000101001000001011100100110011110110001001011001010111101111110,TURTUIYVLMGUTG-UHFFFAOYSA-N
CC1=C(N=C(N=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)C5=C(C=CC=C5)F,C3D948457E495681_9DBB81EF143887E3_6041_UN,7.840387,00000000000000000000001001000000000000000010000000000000000000100100000000010101101101010011010010101000001100010000001011100100110001110110001011011111010110101111010,PVMKLFDJPADFQY-HXOBKFHXSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3CCSC(C)C3,D48730A616F34CA3_AB008CEA9DFCB1DE_6041_UN,8.069983,00000000000000000000000000000000000010000010000000000000000000000100000000000001011000011011000000101100010110000001101011000100110001110110001011010111010110101111010,BGRVJTFQZGLYTJ-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC4CCOC(C3=CN=C[N]3C)C4,BF02E33405E05527_5964CBDA5F74FA84_6041_UN,7.880232,00000000000000000000000000000000000000000010000000000000010000100100000000010101000101010010010111100100110111010000001011100100110011110100001011011111110011101111110,HJOZIEHOOYYYRT-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)NCC2CNCC3(O2)CCC3)C#N,001CD44E5DA423BB_753F13D9F4147F15_6041_DP,7.5424995,00000000000100000000000000000000000000000110000000000100010000000010000000000000101000110011000100101000010100001000001011000000110111110110001011010011110111101111110,BNSDJYDKCJMGFQ-UHFFFAOYSA-N
CC34CCC(C=CC2=CC=C([N]1N=C(C)C(=C1)Cl)C=C2)(CC3)CO4,1C4504327A735ADA_F391D0C88C593B81_7019_UN,8.449941,00000000000000000000000000000000000000000000000000001000010000100110000000010000100100010000001010110001010101001001101011101100110011110100001011011110110011101111110,SOKPWYXZTWNJPG-UHFFFAOYSA-N
CN(C)C3CCN(CC1=CC=C(C=C1)NCC2(CCCNC2)F)C3,B9121E804E864949_3BB6A036AD69F1D8_6041_DP,7.773857,00000000000000000000000000000000000000000010000000000100000000000010000000110001101101110011010010101000100110011000101011100000110101110110001001011101010110101111010,QWXGPCUXRRISCT-UHFFFAOYSA-N
N3CCC1=C(C=C(C(N1CC2C(C)(NCCO2)C)=O)C#N)C3,F2254F27731B78BE_AFA8ADC4DF712128_6034_DP,8.346284,00000000000000000000000000000000000000000100000000000000010000000110000000110000101001100011100101101100110011111100111011100001110110000110001111011111111111111111110,LGSJRAQIFWPORA-UHFFFAOYSA-N
CCC2=C1N(C=C(C1=CC=C2)C3=CCNCC3)C[C@H]4[C@@H](CCNC4)C5=CC=C(C=C5)F,98155CA30C6FE2BA_7E55D40E91E4D0F6_6034_UN,8.2600765,00000000000000000000000000000000000000000010000000100000000000100100000000011000101101110011000010111100110100010010001011100100110100100110001001011011010110101111010,OENLQVHPGLYTDU-UPVQGACJSA-N
C[N]1C(=NC2=C1C=CC(=C2)NC3C5CC4CC(CC3C4)C5)F,D30B1DDA1E00256B_FBD27A64E6B755BD_6041_UN,8.522794,00000000000000000000000000000000000000000010000000000000000000000100000000010101100101010010010010000100011100000000000011100100100001110100001011001011000010101111010,QNRUGYILBYHXCE-UHFFFAOYSA-N
CC1=C(SC=N1)C5=NC2=C(C=C(C=N2)NCC3C(N(C)CC3)C4=CC=CC=C4)[NH]5,6EA3EC980B22A9AD_A96E52AA01D6E144_6041_UN,8.584096,00000000000000000000000000000000000010100000000100000100000000100100000000010101111101101011010010101100010010010001101011100100110101010110001011011111010110101111010,TWZBZOWBGBXTAG-UHFFFAOYSA-N
CN1CCN(CC1)C2=CC(=CN=C2)N[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,0789DAA9715C79F7_4AFA161DB92C254F_6041_UN,8.100304,00000000000000000000000000000000000000000010000000000000010000100100000000010001100101110011010111101000100101010001101011100100110011110110001011011011110011101111110,MMEISRYYDUUMKJ-UXHICEINSA-N
FC2=C1N=CC=C(C1=CC=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,714F40935F058BCA_96A725786FD28490_6041_UN,8.031388,00000000000000000000000000000000000000000010000000000000000000000100000000000000100001110010010000101100010110010001101001100100110001110100001011011011010110101111010,ZHMAEMXRNSZYBV-UHFFFAOYSA-N
C[N]1N=C(N=C1NC2CC3=C(OC2)C=C(C=C3)F)C4CCOCC4,ECA1FAE46B49EB64_0CFA672469841FD4_6041_UN,8.219388,00000000000000000000000001000000000000100010000000001000010000100100000000010101100100110000011110100100111101010100001011101100110011110110001011011011110011111111110,BEKWRCDCLASPHD-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCCC3)C4=C(C(=CC=C4)F)F,49283215988CD1F7_735C1C35BD7CE4EF_6041_UN,8.139318,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100010001110100001010011011000010101111010,COVBKQIORSJOPM-UHFFFAOYSA-N
FC2=C1C=CN=CC1=CC=C2NC3=CC=CC(=C3)CC4CCCN(C)C4,9BC1C41E196ABE21_EBBEB9FF41D3D628_6041_UN,7.8495646,00000000000000000000000000000000000000000010000000000000000000000100000000010000000001110001010000101100010110010001101011100100110001110110001011011011010110101111010,HOTGCTUCJXRWTC-UHFFFAOYSA-N
N(CCC1C3CC2CC(CC1C2)C3)[S](C5=C(F)C=C4C=C[NH]C4=C5F)(=O)=O,78AB40432557A7A0_630BF06E138B537D_6029_UN,7.851957,00000000000000000000000000000000110000000010000000010001001111001101010001000000011100011000001010001110111100011000011001001100111100101100001011011011010110110111110,FDGMITCLIVWEOE-UHFFFAOYSA-N
ClC1=C(C=CC=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]5N[C@H]4CCO[C@H]4C5,E05D4A0987533161_A500106172DC7140_6034_UN,8.618506,00000000000000000000000000000000000000100000000000000000010000100100000000010101001101010011000111001101110101010000001011100100110110100110001010011011110111100111110,WQCKDMVANPNEEU-YGNUYKAGSA-N
CC(C)(C#N)C1=C(C=CC(=C1)NCC3CC2(CNC2)C3)F,73EBEFE4E4E37B83_FC811C48EF917738_6041_DP,7.5234957,00000000100100000000000000000000000000000110000000000000000000000010000000100000001000110010000000001000010100001000000001000000100101110110001010000111010110101111010,FQGJHYHUDVJQTF-UHFFFAOYSA-N
N3CCCC(CC=CC1=C(Cl)[N](C(=N1)N(C)C)C2=CC=C(C=C2)C)C3,96268B0D3CF2A0BB_4F34E18B980786B8_7019_DP,7.4715137,00000000000000000000000001000000000000000000000000000000000000100100000000110101001101110011010010111001101100010000001011100100110001110110011011011111010110101111010,ZTPVZZPDDLIAQG-UHFFFAOYSA-N
CN5CC(C1=NN=C(C)N1CC2CCCN2CC3=CC=CO3)C4(CNC4)C5,4EAD5237DBFD89B1_6FB9141965B410CC_6034_UN,7.538959,00000000100100000000000000000000000000100000000000001000010000100110000000010101101101100011011110001000010010011001101011101100110010000110001010011111110110101110110,ZHQNFVKBXPASSD-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC[CH]2C[C]3(C2)CC[CH2]CC3,E91AD414D7FF2A84_9A960B918EA22F7E_6041_UN,7.218004,00000000000100000000100000000010000000000000000000000000000000000110000000100001001000100010010000101000010000001000001001000000110001010100011011011111010110101111010,IKTRSACTXKPSHE-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2=CN(C(=N2)C3CCCN3)C[C@H]5C[C@@H]4NC[C@@H]4C5,631F22430592D4DC_3E96394A69FAC72C_6034_UN,8.805055,00000000100100000001000000000000000000100010000000000000000000100100000000010101001101010011000010001000110100010000001011100100110100100110001010011011010110100111010,LIXYNGPLSMOZBZ-QFDAWVLOSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC(C)C2COCC2)F)CC3,B84604FA11E79B7C_267EE17DD20C06B2_6041_UN,7.397278,00000000000000000001000000000000000000000010000000000000010000000000000000010001100101110011010011001000000111010001101011100000110011110110001010011111010111101111110,RSMWBSQNBVCZTG-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC3=CC2=C(CCCN(C)C2)C=C3,9E9CC40368EFC03B_D1CFE9D5941DD81E_6041_UN,7.841584,00000000000000000001100000000010000000000000000000000000000000000000000000110000000001100001010000001100010010011001101001100100110001010110011011011101010010101111010,MVAQNQFBEPRVIQ-UHFFFAOYSA-N
N(C[C@@H]1CCO[C@H]1C=C)C(=O)C2(CCC2)C3=CC(=C(C=C3)Cl)F,C54C069637E4B778_EFBCF736F27719E6_6038_UN,7.5195923,00000000000100000000000000000000001000000010000000000000010000100010000000000000001100010011100011011001000101101000011000000000110010100110000010010011111111110111110,VJDUBMSZZYTTCO-LRDDRELGSA-N
N(C[C@@H]1CCO[C@H]1C=C)C(=O)C2(CCC2)C3=CC(=C(C=C3)Cl)Cl,2BF68491F0706A74_2059AD3E294160C0_6038_UN,7.5195723,00000000000100000000000000000000001000000000000000000000010000100010000000000000001100010011100011011001000101101000011000000000110010100110000010010011111111110111110,SAIBICDZQBSLOP-LRDDRELGSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3(CC3)C4=C(C=CC=C4)F,10C3550F90649FDC_A90B17D5BCEFDF42_6041_UN,7.642491,00000000000000000000001000000000000000100010000000000000000000100110000000010100100101110010010010101000100110011001101011100100010001110100001011011011010010101111010,TZXUMYWOGOAURK-KRWDZBQOSA-N
CN(C)CC1=C(C=C(C=C1)NC2=CC(=NO2)C3CCCCCC3)F,F3E233090AC70844_4D2EB719E8632A21_7022_UN,8.049864,00000000000000000001000000000000000000000010000000000000010000100100000100100001100101110000111011001010000100100001011011101100110001110100001010011111010110101111110,XMTSANWOBZVPEK-UHFFFAOYSA-N
CC1=C(C3=C(N1CC2(CBr)COC2)C=CC=C3)C4=CCNCC4,9E4894679DDC2E85_2799E6BA00266FA4_6034_UN,8.445197,00000000100100000000000000000000000000000000001000100000010000100110000000011000001101100001000011111100110011011000101011100100110000100110001011011011010111101111110,MEDWQRNPGMJUTF-UHFFFAOYSA-N
FC1=C(C=CC(=C1)NCC2N(C)CC3(CC2)CC3)OC4CCOCC4,9B431FB0E2B4278A_567E77E524975C7B_6041_UN,7.226679,00000000000000000000001000000000000000000010000000000000010000000010000000010001001001110111010000101000010111011101101011100011110011110110001111011011110111111111110,JLYSSKZNMGBOJH-UHFFFAOYSA-N
CC2=NC1=C(CNCC1)N2CC4(CC3=CC=C(C=C3)F)CCNC4,0A1FEA8C8C249201_679674C2FC568F5B_6034_UN,8.184115,00000000000000000000000000000000000000100010000000000000000000000110000000010101101101110011000010101100110110011000101011100100110100100110001011011011010110101111010,VBUDNNRNQOOPEO-UHFFFAOYSA-N
O=[N](=O)C1=C(N=C(C=C1)NCC2=CC3=C(C=C2)COCC3)C4=CC=C(C=C4)F,69F314CE3512EC50_E4D56BAAA501F84E_6041_UN,7.5737305,00000000000000000000000010000000000000100010000001000000110000110100001100000101001000110000001001101110010101000000001111101100111011110110001011111011010111110111110,OSDSIVGFDIESMK-UHFFFAOYSA-N
CN4CCC1=C(C3=C(N1C[C@H]2OC(C)(CNC2)C)C=CC(=C3)Cl)C4,A1673B820FA2B2AD_6C80DDF74344D986_6034_UN,7.748156,00000000000000000000000000000000000000000000000000000000010000000110000000110000101101110010010110101101010110011001101011100100110010100110011011011101110111101111110,GGRCIQAQUHFJPM-AWEZNQCLSA-N
CC1=C(C(=CC(=C1)F)F)NC[C@@H]2CCCO[C@H]2C3=CC=N[N]3C,C2976EFACDABA2D9_5727F1FE5B19F7FB_6041_UN,7.834602,00000000000000000000000000000000000000000010000000001000010000100100000000010000101100010011011111101000000111000000001011101100110011110110001011011111110111101111110,PBUREBMDWPBQNS-YVEFUNNKSA-N
N(CC1C2CCC(C1)C=C2)C(C3=C(C)OC(=N3)C4=C(C=CC=C4)F)=O,225A9485DD5DCD1B_A65ED36D40B7594F_6038_UN,8.27285,00000000000000000000000000000000000000000010000000000000010000100100000000000001001100010111100111011000010100100000011011000100110000100100001011010011111110111111110,UTGLRVCEHAFQPN-UHFFFAOYSA-N
C[N]1C=CN=C1C2=NC=CC(=C2)NCC3(CCOCC3)C4=CC=C(C=C4)F,34BDDD4EFFE87118_42F90FF6CE483E60_6041_UN,7.5101757,00000000000000000000000000000000000000100010000000000000010000100110000000010101101101110011010010101000000101001000001011100100110011110110001011011011010111101111110,ZSSFLZHAJKBLQN-UHFFFAOYSA-N
ClC1=CC2=C(C=C1)N(C(=O)C=C2C3=CC=CC=C3)C[C@H]5N[C@H]4CCO[C@H]4C5,294124421B1E2DF2_255569772316900C_6034_UN,7.898577,00000000000000000000000000000000000000000000000000000000010000100100000000010001000101010011100111101101110101110100011011100101110010100110001111011011111111110111110,HTGPPTDACOQQHS-LRQRDZAKSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCCC3=C(C=CC=C3F)F,D5D1E405B07B558D_FE90B6E9D7F8F026_6038_UN,7.80165,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,CAFIULGWKPETBW-UHFFFAOYSA-N
N(CC12CC(C1)C2)C(=O)[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,9705CB25E0E4D504_95ACB2FC80B9DE14_6038_UN,7.4452486,00000000000100000000000000000000000000000010000000000000010000100010000000000000001100010111100011001000010101101000011000000000100010100110000010010011111111110111110,VVAWTULJJQLNLJ-LLAUKFHXSA-N
N(CC12CC(C1)C2)C(=O)[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)Cl)F,889D9BD743917ED4_F63953DE855C2791_6038_UN,7.4452376,00000000000100000000000000000000000000000010000000000000010000100010000000000000001100010111100011001001010101101000011000000000100010100110000010010011111111110111110,IOLGYEVWHROMGH-LLAUKFHXSA-N
C[N]6C=C(CC2CCC3=C(C1=C(C=C(C)C=C1)C)C4=C(N=C23)SC5=C4CCC5)C=N6,6BF7D3E74EC3CB3D_883AC5A1312DB81A_2201_UN,8.556665,00000000000000000000000000000000000010000000000100001000000000100100000000010000110100001000011010100100010010000000001011101100110000000100011011011110000110101111010,IZYDKDIWCFKEOC-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)N[C@@H]4C5=C(OC(C)(C4)C)C=CC(=C5)F,9FC384AA7271DCB7_6B5804EFECA4E099_6041_DP,8.118684,00000000000000000001000000000000000000100010000000000000010000000110000000100101100101010011010011100100110100011101101011100100110111110100011011011101100011101111110,CXKNBVZWSIWOAS-ZMMAXQRCSA-N
CC5(C)CCC1=C(C4=C(N1CC2=C(C=CC=C2)C3CCNCC3)C(=CC(=C4)F)F)C5,34A9B2DEC58524E2_D4D051510C3336F1_6034_UN,8.279247,00000000000000000000000000000000000000000010000000000000000000100110000000110000001101110001000010101100110100011001101011100100110000100110001011011111010110101111010,ZZTNJAXMBCQENC-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2OC3(CC2)CCCC3)F,48D59A31747645B1_FE44CCC4F64B3870_7022_UN,7.1484423,00000000000000000000000000000000000000000010000000000000010000000010000000100000001101110011010110001000010100001001001000100000110011110110001010011111110111101111110,ANPMMEPMUXFXCD-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NCC4(CCC4)C5=C(C=CC=C5F)F,BDBECD48D0E7244A_2838A03058C30451_6041_DP,7.949846,00000000000100000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000010110001000001011100100110101110110001011011011010110101111010,OUCLCIRJEUEDPK-RAKKMVLPSA-N
CN(CC1CCNCC1)C2=NC(=CN=C2)N[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,F5069EC7DE13937B_A27F011CE1A00A8F_6041_DP,8.508082,00000000000000000000000000000000000000100010000000000000010000100100000000000101101101110011010111101000100111010001001011100100110111110110001011011011110111101111110,RCESSVDHJKXDHQ-NQIIRXRSSA-N
FC2=C(C=C1C=CC=CC1=N2)NC4CC(C3=NC=C[N]3C)OCC4,E75EC9A2FBA7D8FA_49BE3FCCCA166339_6041_UN,7.864644,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010010010111100100110111010000001011100100110011110100001011011011110011101111110,XRDUKHCGAKWJDG-UHFFFAOYSA-N
CC1=CC(=C(C=C1)CNC([C@@H]2CC(CN2)C34CC(C3)C4)=O)F,C74D668731E3D6E7_4DF7B8EE905BAC8B_6038_DP,7.5492344,00000000000100000000000000000000000000000010000000000010000000100010000000000001001100010011100110001000110100111000010001000000110100100110001010000011011110101111110,GBOPOQSPKUQMCX-YOTRNEINSA-N
O=[N](=O)C2=C1[NH]N=CC1=CC(=C2)NC4=CC3=C(CCCN3C)C=C4,B4026040E8B9F590_2EE0A9E5BE37D315_6041_UN,8.554578,00000000000000000000000010000000000000000000000001001000100000010100011100010001100101100000011011101110010010010001101111101100101101010100001011011001010010111111110,RDZVMXRNXJRYKD-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=NC=C2)NC3=CC=CC(=C3)CC4CCCN(C)C4,D283541F6C65FF50_A6E3B9A2CCC35BE3_6041_UN,7.9791327,00000000000000000000000000000000000000000010000000000000000000000100000000010000000001110001010000101100010110010001101011100100110001110110001011011011010110101111010,XCPXAKHHLNULRU-UHFFFAOYSA-N
CC4(C)COC3(C[C@@H]2CC(OCC1=CC(=C(F)C=C1)F)C[C@@H]2C3)OC4,0794B99437D06D98_A2E52CC33F56F8F4_6039_UN,8.343558,00000000000000000000000000000000000000000010000000000000010000000010000000100000000000010100000010100100010101001001000010010011110010100110000111100110110101011011110,WNNARDMUVLBGDG-XYPWUTKMSA-N
BrC1=CC2=C(N=C1)N(C=C2CC3=CC=CC=C3)CC4(C)CCCNC4,3D304E7AEEFC8D29_94F1BF9B57351A7D_6034_UN,7.7861624,00000000000000000000000000000000000000100000001000000000000000000110000000010100101101110011000010101100110110011001101011100100110000100110001001011001010110101111010,IUQQBEUZIMVOCM-UHFFFAOYSA-N
N1CC2CCC1CN2C3=CC=C(C=C3)NC4=CC(=C(C=C4)C5CC5)F,80779D2150AC4D08_E99312A115A851D9_6041_DP,7.6851916,00000000000000000000001000000000000000000010000000000000000000100000000000010001001001010011000000101000110100010000001011100100110101110110001011011011010010100111010,IFWNBYPVQJFEAF-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NCC2CCCN(C)C2)C3OCCO3,474C964B4C887E05_E43B13F6A0B0C50F_6041_UN,6.8101997,00000000000000000000000000000000000000000010000000000000010000100000000010010000101101110011010010101000000111010001101011110000110011110110001011011011010111111111110,YEUZSRCMVGQUDK-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC2CN(C)C3(C2)CCOCC3)C=C,368194CD18A140BB_E449517225BFC7DB_6041_UN,7.11459,00000000000000000000000000000000001000000010000000000000010000000010000000010001100101110001010011111000110111011001101011100000110011110110001011011011010011101111110,LSHGBTYOFQROFA-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2CCC(C)C3=CC4=C(C=C3)CCCC4,20EEE208568D0F70_E72DF6BFEFF286C6_6034_UN,7.9857035,00000000000000000000000000000000000000000000001000000000000000000100000000010000000101010000000010001100010110010001101001100100110000100100010011011110010110101111010,HWTSMKYBSKCZFX-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CC=N2)NCC3(CCC3)C4=C(C=CC=N4)F,B7211977693028C3_9A90B56E10EF30E0_6041_UN,7.5875497,00000000000100000000000000000000000000000010000000000000000000100110000000010001101101010011010010101100010100001000001011100100110001110100001011011011010110101111010,QMXMFOWNURLSTG-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NCC(OC)C3CCOCC3,E5409E62A638F431_4C88F3A73EEC6D09_6041_UN,7.9170785,00000000000000000000000000000000000000000010000000000000010000000100000000100000101000110001010100101100010111000000101011000110110011110110011011010111110111111111110,BJCJJANTAYCCBN-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NCC3(CCC3)C4CCC4,1E2D6C955ADD1BA0_9777CE2B6A9002BD_6041_UN,7.9622526,00000000000100000000000001000000000000000010000000000000000000100110000000010101001101010011010010001100011110001000001011100100110001110100001010011011010110101111010,VTRUUNASDICHFJ-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NC4CC(C3=CC=N[N]3C)OCC4,A912A0D2FA137FB1_0FBAF6714B476580_6041_UN,7.3431964,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111100100110111010000001011101100110011110100001011011011110011101111110,NKFOHRMMRHGJAS-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CCC2CC2(C)C)C=CC(=C3)Cl)C4,C0609C62A99F01D0_72EF550A1F4FF1D1_6034_UN,7.865314,00000000000000000000001000000000000000000000000000000000000000000110000000110000001101010010000010001101110110011011101001100100110001100110011011011111010110101111010,UVMDVWQNEAZNIK-UHFFFAOYSA-N
CC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCC3)CC4CC4(C)C5=NC=C(C=C5)F,257EABF9C0804D67_EE76840C90F49603_6034_UN,8.320001,00000000000000000000001000000000000000100010000000000000000000100110000000010101001101010011000010101000100110011001101011100100110000100110001011011111010110101111010,OHXFGKOLACWFDG-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC34CC(C)(CO3)CCC4,6A145E0D9C3B69BA_260052500DDED3F6_6041_UN,7.2347836,00000000000000000001000000000000000000000010000000000000010000000110000000000000101100010011000110101100010111001001101011000100110011110110001011010111110111101111110,AGDWZJPNHUDJHC-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C=NC=C2)NCC3(CN(C)C)CCCC3,47576CCE33D4683D_63D057D88792333A_6041_UN,7.787514,00000000000000000000000000000000000000000000000000000000000000000110000000100000101001100011010010101100010010001001001001100100110001010110001001011101010110101111010,HMYMXLWLBGGRJC-UHFFFAOYSA-N
BrC2=C1N(C=CC(C1=CC=C2)=O)CC4CNC3(CCC3)C4,97AA7414C4E389CE_2EEC011B1923E1F3_6034_UN,8.4811,00000000000100000000000000000000000000000000001000000000000000000110000000010000101101010011000011101100110100011100001011100101110000100110001101011001111110100111110,RIYAANAACAHMKN-UHFFFAOYSA-N
N1CC4(C1)CCCN(CC2=NN=C(C=C2)NCC(N(C)C)C3=C(C=CC=C3F)F)C4,3CE6AECA4E10947D_8CC8404A9C607FBE_6041_DP,8.388729,00000000100100000000000000000000000000100010000000001000000000000110000000110101101001110011011000101000010100011000101011101100110101110110001011011111010110101111010,HQBGBNXONJWZFB-UHFFFAOYSA-N
CN1C(=O)CCOC2=C1C=CC(=C2)NC4=C3CCNC3=CC=C4,DBF40DD6F70C8C54_4CB63DF56F1CD178_6041_DP,8.812998,00000000000000000001000000000000000000000000000000000100010000000000000000010000101101000111110111001100110011110100111011100101000111010110001111011011111011111111110,BBKUUBUOEHVUMJ-UHFFFAOYSA-N
N3CCOC(CC=CC2=C(N(C)C1CCCC1)C=CC(=C2)F)C3,E097B8B3E211882F_10FAEE81ABBF480D_7019_DP,8.056389,00000000000000000000000000000000000000000010000000000000010000000000000000000000001001110011010110111000100111010000101011100000110011110110001011011011110111101111110,JWYPFBSKISYKDU-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)CCC2)N[C@H]4[C@H](C3=C(C)[N](N=C3)C)OCC4,C1A1B66E9A0F56D3_A6E4385BE0F254FA_6041_UN,8.162933,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111000100110101010000001011101100010011110100001010011111110011101111110,PDAACKSTNXESMW-AEFFLSMTSA-N
CC1=CC2=C(C=C1)C(=CN2CCC3CCCN(C)C3)C4=CCNCC4,A92E8D953A278B37_37795C84B2903D2F_6034_UN,7.927049,00000000000000000000000000000000000000000000000000100000000000100100000000011000001101100001010010111100110010010001101011100100110000000110001001011101010110101111010,RZWWQGCHDAOGSN-UHFFFAOYSA-N
ClC2=C1C(=CN(C1=NC=C2)CCC3CCC(C(CC)(C)C)CC3)CC4=CC=CC=C4,2127FDAF14F6DB44_41C9A7B136821304_6034_UN,8.144618,00000000000000000000000000000000000000100000000000000000000000000110000000110100000101010000000010101101010110011011101011100100110000100100011001011100010110101111010,HHFCQERSHDBMLS-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C(N=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,46E462EBE06217A9_4F9D95B3B2743FB0_6041_UN,8.231592,00000000000000000000001000000000000000100010000000001000000000100100000000010101101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,GIZAGUWIZWGGQG-ZHRRBRCNSA-N
CN1CCN(CC1)C2=NC(=NS2)NCC3(CCNCC3)C4=C(C=NC=C4)F,6DEA35AEFB349E83_98AE9471170AFE8C_6041_DP,7.91536,00000000000000000000000001000000110010000010000100000000000000100111000000010101111101111011011010101000101100011001101011101100110101110110001011011011010110101111010,FZFVLRIBSBDKOU-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)C2OCCO2)C)NC4(CC3=C(C=CC=C3F)F)CCCC4,6D51BEDAC11175B6_AC0E2926037C57AA_6041_UN,7.813324,00000000000000000000000000000000000000000010000000000000010000100010000010000000000100010011000010000000100101011000001010010100110011110110000011010111010111111111110,YDZJLVZQPIORNT-UHFFFAOYSA-N
CC1=C(C=NC(=C1)C2CCC2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,9E9E71CECC8085EA_A773E2F1A0A26AAE_6041_UN,7.9009275,00000000000100000000000000000000000000000000000000000000010000100100000000010001101001100001010100101000000011010001101011100100110011010110001011011111110111101111110,AFRISOCOARTRIX-VXKWHMMOSA-N
CC1=C(N=C(N1CC3CNC2=C(C=CC=C2F)C3)C4CCCN4)C5=CC=CC=C5,105EF6CC549D1599_1948B13D360D940A_6034_UN,8.210251,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101010011000010101100110100010000101011100100110100110110001011011011010110101111010,ZJWJWIJLVKMBII-UHFFFAOYSA-N
C1CC(CCN1)C2=CN(C3=C2C=CC=C3)C[C@H]4[C@@H](CNC4)C5=CC(=CC=C5)F,81B59704EE5B3719_AEF4956EF1A04037_6034_UN,8.8376665,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010101100110100010000001011100100110100100110001001011011010110100111010,AWBFMNWMVUUOJY-UGKGYDQZSA-N
CN3CCCC(CCOCC1CNC2(CO1)CCC2)C3,59CB64C3B5BD74A5_9851D46F31049058_6039_DP,7.9233704,00000000000100000000000000000000000000000000000000000000010000000010000010010000001001100011010101101000110011011001101011100010110010000110001001011001110111111101110,LJKBXZFFLLDYAG-UHFFFAOYSA-N
CCC5CCC1=C(C4=C(N1CC2=C(C=CC=C2)CC3CCNCC3)C=CC(=C4)C)C5,11E8552B91F498E5_61EBAD517667CC19_6034_UN,8.361559,00000000000000000000000000000000000000000000000000000000000000000100000000010000001101100001000010101100110010010010101011100100110000000110001011011111010110101111010,BUMLNCBEFBIQOP-UHFFFAOYSA-N
CC2=NC1=C(C=C(C=C1C)Br)N2CC3CCCN3CC4CCCN4,09F56069C1BBA1D7_215E524782576CF9_6034_UN,8.1652355,00000000000000000000000000000000000000100000001000000000000000000100000000010101001101110011000010001100110100010000101011100100110000100110001010011111010110101111010,CGLUQYVOJISAFZ-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4(CCCCC4)CC5=C(C=C(C=C5)F)F,467598E3BCAE144D_951ED9E752964F34_6041_DP,7.9356728,00000000000000000001000001000000000000100010000000000000000000000110000000000100100101010011010010100000111100011000101011100100110101110100001011011011000110101111010,BQTSAUZQPWINNB-WKCHPHFGSA-N
FC2=C1[NH]C=CC1=CC=C2NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,99E32C670A23E68C_A10031F437225E5D_6041_UN,8.118893,00000000000000000000000000000000000000000010000000000100010000100100000000010000101101110001010110101100010111010001101011100100110111110110001011011011110111101111110,SMESQVWSCLKRID-PXNSSMCTSA-N
FC2=C1C=CC=NC1=C(C=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,F5166906FF9ED9FE_E8DB5E653AB0D725_6041_UN,8.150039,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,GRPDKPKACOAPIY-QRQCRPRQSA-N
CN2CC1C(CCCC1C2)OCC4=CC3=C(C=CC=N3)S4,26BA471155032DCF_F16798FC0AD701DD_6039_UN,8.628117,00000000000000000000000000000000000010000000000000000000000000000100000000010000010101101000010011101100010011000001001011100111110010000110001101011000110111101111110,UGSPVTDKPNHOBQ-UHFFFAOYSA-N
CN(CC1CNC1)CC2=NC=C(N=C2)NCC3C4=C(CC3)C=C(C=C4)F,FF6180677D56600D_FB435C745FEF0C05_6041_DP,7.8815856,00000000100100000000000000000000000000100010000000000000000000000100000000000101101001110011010010101100010110010001001011100100110101110110001011011001010110101111010,CJHCNPUJLRGBSS-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC3CCCC34CNC4,9A36141052487C65_626CD4603465DC20_6041_DP,8.078339,00000000100100000000000000000000000000000010000000000100000000000110000000100000101000110011000010101100110100011000001011000100110101110110011011010111010010101111010,AXGWTHKKXTYIIV-UHFFFAOYSA-N
O(C(=O)CNC1=CC(=CC=C1)Cl)CC2C3CCC(N2)C3,1F28F1CC79F4A3FF_2E37A2D4B577D972_6031_UN,7.571487,00000000000000000000000000000000000000000000000000000000000000000000000000000000001100010011000110101001110101010000001001010010110111110110001001010001011111110111110,DCMSFKHVELEDPR-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2C3(CC2)CCC3)F,ED031289018FFAD1_D6EE416A192B27D3_7022_UN,7.391058,00000000000100000000000000000000000000000010000000000000000000000010000000100000001001110011010000001000010100001001001000100000110001110010001010011111010110101111010,ZAENPNRHPUBHLG-UHFFFAOYSA-N
C(C23CC1CC(CC(C1)C2)C3)=CC5=CC=C(C4=C(C)C=C(C=C4)F)O5,A89637582242F0BB_4DE91FEEF8013A31_7019_UN,8.416953,00000000000000000000000000000000000000000010000000000000010000100010000000000000000100010000000010010100010100001000000000000100100000100100000011000010100000001011110,CFRWELWJQFYOKF-UHFFFAOYSA-N
O(C2=C1C=C[NH]C1=CC=C2)C3=CC=C4C(=C3)OCCNC4=O,88F736B311240BCE_B95ECCE63867AA10_6003_UN,9.023452,00000000000000000001000000000000000000000000000000000000010000000100000000000000001100000100100111001100110001110100011011000111000110000110001111110001111011110111110,YLSLNUDWBAWFAL-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2(CC2)C3=CC=C(C=C3)F)C4CCCC4,C9A0BE8ED5EB2DAA_1889E9122A239185_6041_UN,7.890129,00000000000000000000001000000000000000100010000000001000000000100110000000010101100100010010011010000000100100011000001011101100010001110100001010011011000010101111010,GTSMGCWHMOHNKW-UHFFFAOYSA-N
BrC1=CN=C(N(C1=O)CC2(CNCCC2)C3=CC=CC=C3)C4CCC4,E6C5A73BD0B7F595_F534F32093499ACC_6034_UN,8.133116,00000000000100000000000000000000000000100000001000000000000000100110000000010100101001110011100001101000100100111100011011100101110000100110001111011011011110100111110,VLTYVHRYNIHBJO-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC3C4(C3)CCOCC4,9238492321C150B2_90F12CF46BDE7F2A_6041_UN,7.2768636,00000000000000000000001000000000000000100000000000001000010000100110000000010101101100100011011010101000010011001000001011101100110011010110001011011111010111101111110,RPVPMMYAZCTMHT-UHFFFAOYSA-N
FC1=CC(=CC=C1)C2=CSC(=C2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,38A08191EB099EB7_3D2C11066E8FDA06_6041_UN,8.169918,00000000000000000000000000000000000010000010000100001000010000100100000000010000111101111001011110101000000111010001101011101100110011110110001001011111110111101111110,DSIVZRZPMMJGHJ-ICSRJNTNSA-N
C[N]1C=C(Cl)C(=N1)C=CC2=CC(=N[NH]2)C45CC3CC(CC(C3)C4)C5,E95495B123D16A74_8F6BA5E22B1A7157_7019_UN,8.146997,00000000000000000000000000000000000000000000000000001000000000100110010000010000100100010001011010010101010100001000000011101100101000100100001011001011000010101111010,YTFJYVBWKYOWJA-UHFFFAOYSA-N
N(CC[C@@H]1C[C@H]1CC2=CC=CC=C2)C(=O)C45CC3(F)CC(F)(CC(F)(C3)C4)C5,318FC783BB6F35B5_05365477967EC88A_6038_UN,7.319657,00000000000000000000001000000000000000000010000000000000000000000010000000000000001000010011100000001100110100111000011000000000110000100000000001010011011110100111110,GBXGTENKUXGWQY-SMZPFAEDSA-N
CN5CCCN(CC1=C(C=C(C=C1)NCC3(CC2(CNC2)C3)C4=CC=CC=C4)F)CC5,3A5A72F5E7A06BA9_D909F72EBDA2593F_6041_DP,8.130867,00000000100100000001000000000000000000000010000000000000000000100010000000010001101001110010010000001000010110011001101011100100110101110110001011011011010110101111010,YCVAYYNYPFMFKL-UHFFFAOYSA-N
CC1(CCO1)C2=CC(=CS2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,B8D1CF37A20119FF_1887B948D12AFFF8_6041_UN,7.7497387,00000000100100000000000000000000000010000010000000000000010000100010000000010001110101111011010010001000100111011001101011100100000011110110001000011111110011101111110,DUZMIYDNLSXMMH-FAZYOCGDSA-N
CC1=C[N](C2=C1C=CC(=C2)Cl)CC3(CCNCC3)NCC4CC4,6C7DB839CB10A859_58DA5AB8B6D3FD66_6034_DP,8.248441,00000000000000000000001000000000000000000000000000000100000000000110000000010001101101110011000010101101110110011000001011100100110101100110001001011001010110101111010,COMTTWUKPCOQFG-UHFFFAOYSA-N
CCC(N)C2=NC1=C(C=CC(=C1)Cl)N2CC3CNCC3OCC,ED673073E96AF80D_BA439D5B89819565_6034_UN,8.64323,00000000000000000000000000000000000000100000000000000000000000000100000000010101101111110011000111001101110111010010000011100111110110100110001110001111110111101111110,DVSTVBFHVGOUSX-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C2CC2)NCC3CCCN(C)C3C4=CC=CS4,31254643DEA7492B_6545599DA7D5EFED_6041_UN,7.9686165,00000000000000000000001000000000000010000010000000000000000000100000000000010000111101111011010010101000000110010001101011100100110001110110001011011011010110101111010,UVXWMEVCIHJWKZ-UHFFFAOYSA-N
FC2=C1C=NC=CC1=C(C=C2)NC4=C(C=C3OCCOC3=C4)[N](=O)=O,9DB8A4AC255E82F9_EE372F9E6534D8BB_6041_UN,8.55786,00000000000000000000000010000000000000000010000001000000110000010100001110000001000000010000001001100110010101000100001111101100001011110110101011111011110011110111110,UTGUIQRNOQQNKF-UHFFFAOYSA-N
CC1=CN(C2=C1C=CC(=C2)F)CC3(CCNCC3)NCC4CC4,E6B658228E7BDC7E_22A728592C38C1EE_6034_UN,8.248425,00000000000000000000001000000000000000000010000000000100000000000110000000010001101101110011000010101100110110011000001011100100110101100110001001011001010110101111010,XUDSZUPOCDAKRT-UHFFFAOYSA-N
CC1=C[N](C2=C1C=CC(=C2)F)CC3(CCNCC3)NCC4CC4,E6B658228E7BDC7E_D4980502F3B57635_6034_DP,8.248416,00000000000000000000001000000000000000000010000000000100000000000110000000010001101101110011000010101100110110011000001011100100110101100110001001011001010110101111010,XUDSZUPOCDAKRT-UHFFFAOYSA-N
CC1=CN(C2=C1C=CC(=C2)Cl)CC3(CCNCC3)NCC4CC4,6C7DB839CB10A859_AEE577E3695E4ABD_6034_UN,8.248413,00000000000000000000001000000000000000000000000000000100000000000110000000010001101101110011000010101101110110011000001011100100110101100110001001011001010110101111010,COMTTWUKPCOQFG-UHFFFAOYSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=CC(=C(C=C1)I)Br)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,4230DCA9D7EA262E_DEF9C8E4323519C3_6035_UN,8.916235,00000000000000000000000000110000000000000000001000100000000000100110000000001000000000010000000010110100010110001101101001000111110010100100000111010110100001001111110,QTXIRZCMDYRKMJ-GFDXUBCRSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3COC(C)(C3)C)C4,8BD29BFE30D54BA3_B977A684B898C3EE_6041_UN,7.623335,00000000000000000000000000000000000000000000000000000000010000000110000000110000101101100011010011101100110011011001101011100100110111010110011011011101110111101111110,LIBWVMQTRBUFBK-UHFFFAOYSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=CC(=C(C=C1)I)Cl)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,AE67A7BD109D8957_2738BC14EA20B860_6035_UN,8.916231,00000000000000000000000000110000000000000000000000100000000000100110000000001000000000010000000010110101010110001101101001000111110010100100000111010110100001001111110,RJIZUJYUJNNXFU-GFDXUBCRSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=CC(=C(C=C1)Br)F)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,07E3786926E57043_DED01852679531A1_6035_UN,8.916225,00000000000000000000000000100000000000000010001000100000000000100110000000001000000000010000000010110100010110001101101001000111110010100100000111010110100001001111110,CAQQPZMUKZBXRK-GFDXUBCRSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=CC(=C(C=C1)Br)Cl)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,E2867C2B2BD32160_DA53A76101871352_6035_UN,8.916226,00000000000000000000000000100000000000000000001000100000000000100110000000001000000000010000000010110101010110001101101001000111110010100100000111010110100001001111110,HRHFJFWSVZVUFC-GFDXUBCRSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=CC(=C(C=C1)Cl)Br)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,2126AF19F6029983_3D43F4CE2988E4CE_6035_UN,8.916235,00000000000000000000000000100000000000000000001000100000000000100110000000001000000000010000000010110101010110001101101001000111110010100100000111010110100001001111110,DTIGZKGKQKGPIZ-GFDXUBCRSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=CC(=C(C=C1)F)Br)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,308BAE7F12F21C7D_FA99E42BF1F2DA74_6035_UN,8.916221,00000000000000000000000000100000000000000010001000100000000000100110000000001000000000010000000010110100010110001101101001000111110010100100000111010110100001001111110,HCNRWDAHDBYJAO-GFDXUBCRSA-N
CCC4CCC1=C(C3=C(N1CC2(C)CCCCCC2)C=CC(=C3)C)C4,FFD34D92523ADA08_528DBEB48033D212_6034_UN,7.8212237,00000000000000000001000000000000000000000000000000000000000000000110000000010000000101000000000010001100010010011011101001100100110000000100010011011100010110101111010,BGDSOUAVSKYHTO-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)F)NCC2(CCSC2)N3CCOCC3)F,85820194D2D80EC3_1AE4BD1886CD6BE9_7022_UN,7.9358883,00000000000000000000000000000000000010000010000000000000010000100010000000010001001101111011000110101000000101011000001011100000110011110110001011011011010111101111110,YLPAPHMICCLLJH-UHFFFAOYSA-N
O[C@H](CBr)C1=CC=C(C=C1)C2=CC=C(C=C2)NCC3N(C)CC4(CC3)CC4,86634547ACF1BD28_AAF5DE384C4EFFFD_6041_UN,8.434143,00000000000000000000001000000000000000000000001000000000000000100010000000010001001001100011010000101000110010011001101001100100110111110111001001011011110111101111110,CGWUWRUZOYFNDX-FOIFJWKZSA-N
FC1=CC2=C(C=C1)C(=NN=C2)NC4C[C@H]3CCC[C@H](N3C)C4,B411E2552199CF1E_60CDA1DB89C0718E_6041_UN,8.064061,00000000000000000000000000000000000000100010000000001000000000000100000000010101100001010001011000100100110110010000101011101100110001110100001001011001000010101111010,OBHWIKDZRLXGTA-GOOCMWNKSA-N
CC45CCC(C=CC2=C(C1=CC=C(F)C=C1)N=C3C=CC(=C[N]23)F)(CC4)CO5,6C4CE3E0C57072BC_2BAABCED4A619AB4_7019_UN,8.173836,00000000000000000000000000000000000000100010000000000000010000100110000000000101000101010000000010110100010101001001101011100100110010100100001011011010110011001111110,GUXQEVMNWKVKNP-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@H]3[C@H](C2=CC=N[N]2CC)OCC3)Cl)C4CC4,87D26525FA7A4594_45514ACAEB3096A6_7022_UN,8.184443,00000000000000000000001000000000000000000000000000001000010000100100000000010000100100010011001111001001100111010010001011101100000011110110001010011111110111101111110,OHLHMYXGGJPMLT-VQIMIIECSA-N
CC5=NC1=C(C=C(C=C1F)NC2C4CCC2CC3=C(C=CC=C3)C4)O5,D23F3FAAF28767B5_CA57BEA016ED2BFB_6041_UN,7.8688397,00000000000000000001000000000000000000000010000000000000010000000100000000000000000100010011100111000100010100100000011011000100110001110100001011010001100010101111110,ZXJDEOPSQAMZJX-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NCC3=CC2=C(NCCO2)C=C3,171A71351F29A5EE_BC2C7AA22B6A3C9B_6041_DP,7.675782,00000000000000000100100000000010000000000000000000000000010000000100000000100001001000100001010100101100110001011100001011000100000111010110011011011101110111101111110,CWCRMRBTIUBVTL-UHFFFAOYSA-N
CC34CCC(C=CC2=C1OC=CC1=C(F)C=C2)(CC3)CO4,7CA4E52AA8788275_F49544C5B6D1394C_7019_UN,7.567927,00000000000000000000000000000000000000000010000000000000010000000010000000000000000100010000000010110100010101001001101010000100110010100100000001010000110001011011110,KEHIGIGYWKRXON-UHFFFAOYSA-N
C1(=CC2=C(C=C1)CCCC2)NCC3(CN(C)C)CCOCC3,0D29F3A261598463_C7EFCF15D51ECAF0_6041_UN,6.8718624,00000000000000000000000000000000000000000000000000000000010000000010000000100000101001100011010000101100010011001001001000100000110011010110001011011101010111101111110,CGSCDFCSOIJYLZ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(C)CCCCN3CC4=CC=CC=C4)C5=CCNCC5,24C42F6DE94E40EE_60435FC4DE59C36D_6034_UN,8.353562,00000000000000000000000000000000000000000010000000100000000000100110000000011001001101110001000010111100110110011001101011100100110000100110001001011011010110101111010,DFHDSKOLKJTGMH-UHFFFAOYSA-N
N4CCC1=C(C=CC(=C1)NC[C@@H]2CCCN(C)[C@H]2C3=C[N](N=C3)C)C4,62CC9CDB0D9CFE13_96B674420A9C4CD8_6041_DP,7.7247214,00000000000000000000000000000000000000000000000000001000000000100100000000010000101101100011011010101100110010010001101011101100110101010110001011011111010110101111010,CXTIMXLUHYLSDX-FXAWDEMLSA-N
ClC1=C(C=CC=C1)C2=CN(C(=N2)C3NCCC3)C[C@]45CNC[C@H]4CN(C)CC5,6F1AE128F7718AFC_E09ADA0D29A90FCB_6034_UN,8.112469,00000000000000000000000000000000000000100000000000000000000000100110000000010101101101110011010010101101110110011001101011100100110100100110001011011011010110101111010,LOBPORIQHWTZKM-WFSJFSNBSA-N
CN(C)CC1=C(C=CC(=C1)NC2CCCC23CCC3)F,57A58D3DE46D3D7C_606136F476AF054E_7022_UN,7.565107,00000000000100000000000000000000000000000010000000000000000000000010000000100000000001110011010010001000110100011001001000100000110001110000001010011111010110101111010,NQWVSKWAOFVYTO-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3=C(C=CC(=C3)C4CC4)F,8A3CD9FEA45A6D82_8D62854F0B13749B_6041_UN,7.508601,00000000000000000000001000000000000000100010000000000000000000100100000000010100101101110001010010101000000110010001101011100100010001110110001011011011010110101111010,VSDGXTAMJXDLDP-IBGZPJMESA-N
CC3(C)CCC(OCC1OCCC12CNC2)C(C3)C#N,C1EAA405694C7EA7_79AC6D5E1193F742_6039_DP,8.188584,00000000100100000000000000000000000000000100000000000000010000000010000010100000001100100011000011001000010001001001101011000011110010000110001100010111110101111101110,WUPZYBGVZJCXBA-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC3CNC2(CCC2)C3)C=CC(=C4)Cl)C5,0B3599E1FA26E6B3_1387A52066A9DCD3_6034_UN,7.1998715,00000000000100000000000000000000000000000000000000000000000000000110000000010000101101110011010010101101110100011001101011100100110000100110001011011001010110101111010,LNFQJSNRFPOFMG-UHFFFAOYSA-N
O(CC1(CCOCC1)C2CO2)CC3N(C)CC(C3)(C)C,988F59C157EA2BEA_9B75A6CFFE055670_6039_UN,7.207154,00000000000000001000001000000000000000000000000000000000010000100010000000110000000101100100010110101000000011011001101011100010110010000110010000111110110111111101110,KXMGWJVWQACKIT-UHFFFAOYSA-N
FC1=C(C(=CC(=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)F)C#N,32771D5820384B10_A4BE062D7F4A9377_6041_DP,7.5372996,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110100111010,KYPKUJFAUOMJSY-XJKSGUPXSA-N
FC1=C(C(=CC=C1)NCC2(C)C(OCC2)C3CC3)C=C,A697888EC282C843_7076F42A45CBD2BA_6041_UN,7.918285,00000000000000000000001000000000001000000010000000000000010000100010000000000000001100010011000011011000000111001001101000000000110011110110000010010011110111101111110,CYCZDIYQKPDNEO-UHFFFAOYSA-N
ClC1=CC2=C(C(=C1)Br)N(C=N2)C[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,0D1F02DE6DFD1D83_2720D050BF5C30D0_6034_UN,8.245045,00000000000000000000001000000000000000000000001000000000000000100100000000010101100101010000010010101101010100010000001011100100110001100110001011011010010110101111010,JIKFGRXMAYMIAF-YJYMSZOUSA-N
N1CCC2(C1)CCN(CC2)C3=NC(=NC=C3)NC4=C[N](C[Si](C)(C)C)N=C4,C9BACC1C345742D2_29738CB1D31311EE_6041_DP,7.1307783,00000000000000000000100001001010000000100000000000001000000000100110000000110101101101100011011010101000111000011001001011101100110101010110011001011101010110101111010,GFYITGKYQAEBCX-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2(CCSC2)N3CCOCC3)F,1D255AB05F9172E6_0358CDD2CDCEE453_7022_UN,7.8856053,00000000000000000000000000000000000010000010000000000000010000100010000000110001001101111011010110101000000101011001001011100000110011110110001011011111010111101111110,AWOQLSPFCVTOOL-UHFFFAOYSA-N
FC1=CC(=CC=C1)CC2=CN(C=N2)C[C@]34CNC[C@H]3CN(C)CC4,2D0A77F121BAE241_50D8D9BBB7A914E6_6034_UN,8.098313,00000000000000000000000000000000000000000010000000000000000000000110000000010101101101110011010010101100010110011001101011100100110000100110001001011001010110101111010,KXGDFGBPFJXCOQ-LPHOPBHVSA-N
NCCCC(OC2=CC=C([C@@H]1[C@H](C)CCNC1)C=C2)C3=CC=C(C=C3)F,4D5653508504BC53_F2B9C81DFD7CF51F_6035_UN,8.252746,00000000000000000000000000000000000000000010000000000000000000100000000000000000001010110011000000101000100100010101101001000111110110100110001101010011110101101111110,ZSQACADIENDEJO-NKWVPACGSA-N
NCC[C@@H]1COC[C@H]1OC2=CC3=C(C=C2)NCCCC3,2F662A9EB5F7743A_D8428487C94E84D8_6035_UN,7.7551565,00000000000000000001000000000000000000000000000000000000010000000000000010000000001110100111000010001100110001010100001011000011110110010110001110010011110111110111110,VAUNCSZEDROKQO-CZUORRHYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CNC4(CO3)CCC4,C762AF403FCA11B9_06AAFEF68CEA74D1_6041_DP,7.275653,00000000000100000000000000000000000000100000000000000100010000000110000000000100101000000011000100101100110011011000001011000100110111010110011011010111110111101111110,ZNZOASDHGUHAQV-UHFFFAOYSA-N
CC3=NC2=C([C@H]1CCCN[C@H]1CC2)N3C[C@H]4[C@@H](CNC4)C5=CC(=CC=C5)F,0F4A85074DD51E36_F6D7E25718B1261D_6034_UN,7.511433,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101100110110010000101011100100110100100110001011011011010110101111010,DWCRLZYEUWLSSV-LEAZDLGRSA-N
CN4CCN(CC1=C(C=CC=C1)NCC2CC23CCC(F)(F)CC3)CC4,AD9DF2DA11EB58B9_4664EFAA59ABDC75_7022_UN,7.7371955,00000000000000000000001000000000000000000010000000000000000000000010000000010001101001110011010000101000010100011001101011100000110001110110001011011011010110101111010,SEQWQXFOZCPTPQ-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2CCCC3=C2C=CN=C3,0803DAD04C97F218_3B91CA7A4CB34DB4_6041_UN,8.046684,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100011010000100100110000011000001011000100100001010100011011011111000010101111010,TZOORKHRZFHDLM-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC4CC(C3=CC=N[N]3C)OCC4)F,B7E6DBE3C687D1E3_A01FCD3AD34EFF06_6041_DP,7.150983,00000000000000000000000000000000000000000010000000001000010000100100000000010000101100010011011111101100110111010000001011101100110111110110001011011011110011101111110,NGOKLYPYMMDZIU-UHFFFAOYSA-N
CN(CC1CNC1)C2=NC=C(N=C2)N[C@@H]3C5=C(OC4(C3)CCC4)C=CC(=C5)F,F77DA5D50FCC47E7_35E753BF1955408B_6041_DP,8.001268,00000000100100000000000000000000000000100010000000000000010000000110000000000101101001110011010001101100110110011101001011100100110111110110001011011001110111101111110,XYUBOXJQRPDGTR-KRWDZBQOSA-N
CC1=C(C=C(C(=C1)NC[CH]3C[C]2(C[C](C)(C2)C)C3)Cl)C4CC4,48885B579E7E3B4B_E51436EF7D32B00C_7022_UN,7.7926373,00000000000100000000001000000000000000000000000000000000000000100010000000100000001000010010000000001001010110001001000000000000100001110000010010010111010110101111010,ZCESNPPNWAGFBZ-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=C[NH]2)NC[C@@H]3CC[C@@H](O3)C4CC4,1AD11ED92E2D8D05_88CAB3127F71F29B_6041_UN,7.969982,00000000000000000000001000000000000000000000000000000010010000100100000000000001001100000011000110001100010010000000001011000100110111010100001010010011110111101111110,GCTHTICEEXPOMZ-LSDHHAIUSA-N
CC3=NC2=C([C@H]1CCCN[C@H]1CC2)N3CC(C)(N4CCNCC4)C5=CC=C(C=C5)Br,41F9BCC8B418F5D3_7535C809DF5569D7_6034_UN,7.5855036,00000000000000000000000000000000000000100000001000000000000000000110000000010101101101110011000010101100110110011001101011100100110100100110001011011111010110101111010,KYWFATNPKYBHRT-GAIPOIILSA-N
C1(=C(C=C(C=C1)Cl)Cl)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C,1001C8EA9F101EB7_6AB908BEB5C3554B_7022_UN,8.166957,00000000000000000000000000000000000000000000000000000000000000100100000000010101101101110011010010101001000110010001101011100100110001110110001011011111010110101111010,GWEZGFWRYAPRHA-YVEFUNNKSA-N
C1(=C(C=C(C=C1)F)F)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C,BC16D354D7166623_E51DBA7030CC5B85_7022_UN,8.1669445,00000000000000000000000000000000000000000010000000000000000000100100000000010101101101110011010010101000000110010001101011100100110001110110001011011111010110101111010,NZBKJXUMMDQOAX-YVEFUNNKSA-N
C1(=C(C=C(C=C1)F)Cl)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C,8EBE81BB4F6C887C_70DCBD8C5A7D1564_7022_UN,8.166945,00000000000000000000000000000000000000000010000000000000000000100100000000010101101101110011010010101001000110010001101011100100110001110110001011011111010110101111010,BKZITXFVTNBLKE-YVEFUNNKSA-N
C1(=C(C=C(C=C1)Cl)F)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C,84D8364A9EB57682_8745BC0C6246FED5_7022_UN,8.1669235,00000000000000000000000000000000000000000010000000000000000000100100000000010101101101110011010010101001000110010001101011100100110001110110001011011111010110101111010,GQLSQDWOERQZLS-YVEFUNNKSA-N
CN5CCC1=C(C4=C(N1CC2C3CCOCC23)C=CC(=C4)Cl)C5,3E0BA503AB22FF27_47C4F03748BDA77D_6034_UN,7.530646,00000000000000000001001000000000000000000000000000000000010000000100000000010000100101110000010010101101010101010001101011100100110010100110001011011000010111101111110,GZYDDUPPSJTXQS-UHFFFAOYSA-N
C1(=CC2=C(C=C1)CC3CCC(C2)C3=O)NC4=C(SCC)C=CC=C4F,D64C1B42E07B5F82_1D3F30229D7C5B82_6041_UN,8.234279,00000000000000000001000000000000000000000010000000000000000100001000000000000000010000011001000010000100010100000010001000000101110001110000000111010011111110101111110,POTSJNNKTLDPKA-UHFFFAOYSA-N
ClC1=CC3=C(C=C1)C(=O)C2=C(CCCC2)N3C[C@H]4[C@@H](CNC4)C5CCOCC5,AACD2DE043C0F085_DE1563586298226E_6034_UN,8.260406,00000000000000000000000000000000000000000000000000000000010000100100000000010000101101110011000011101101010101010100001011100101110010100110001111011011111111110111110,HXZYRGHXCMKNFR-JXFKEZNVSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC3=NC=C(CC2COCC2)S3,C782903253ECA392_B04628BAB12F8D8D_7022_UN,7.9306946,00000000000000000000100000000010000010000000000100000000010000000100000000100100010100101001010010000000001001001000001011000100110011010110011000011101010111101111110,QCZOARAPILJWNU-UHFFFAOYSA-N
FC2=C1OC(=NC1=CC=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,84E98F57BDD2FA97_D3B1316E99245019_6041_UN,8.135519,00000000000000000000000000000000000001000010000000000000010000000100000000000100100101110010010110001100011110110001111011100100110001110100001011011011110110101111110,NYCUZWAECBIVFO-UHFFFAOYSA-N
N4CCC1=C(C=C(S1)NC2=CC(=C(C=C2)N3CCOCC3)F)C4,3424C9788E3B6A73_8B7821C5D7AEF413_6041_DP,7.658369,00000000000000000000000000000000000010000010000100000000010000100000000000010000011101111001000110101100110101010000001011100100110111110110001011011011010011100111110,LQYUWIWAOPOPBD-UHFFFAOYSA-N
COC1=C(C=CC(=C1)C(F)(F)F)NC2C3C2C4CCC3C4,B85BE4BD70E3634D_C2181C5F738657DA_7022_UN,8.355402,00000000000000000001001000000000000000000010000000000000000000000000000000000000000000000001010110000000011100001100001000000011010001110000000111010011100011101111110,OVNNCVYDELLRNR-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC34CC(CO3)CCC4)F,EC509B5EE546DEDE_90AC40A30CB00E90_6041_DP,7.7716885,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100010011000110101100110101011000001011000000110111110110001011010011110111100111110,SOLPANHDHXADKS-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)NCC(C2CCNCC2)C3=CC=CC=C3)C#N)F,333984DBD03F1E44_6A802E225AAD7B67_6041_DP,7.8058996,00000000000000000000000000000000000000000110000000000000000000000000000000000000101000110001000000101000100100010000001001000100110101110110001011010011010110100111010,AJGNTZQJADVPSG-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCCC(OCC)C2CCCC2)F)CC3,AD65B3E5C115C178_C7161C64A76548E3_6041_UN,7.983012,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110000010011001000100111010011101011100010110011110110001010011111110111101111110,QVTZDJFPABJYCX-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC(N3CCN(C)CC3)C4=CC=CS4)F,E858B40965B71869_6816EC25E714F433_6041_DP,7.521345,00000000000000000000000000000000000010000010000000000000000000000000000000010001011101111011010010101100110100010001101011100100110101110110001011011011010110101111010,DDZBGIJHSKKRTK-UHFFFAOYSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC2=C[N](N=C2)CC3=NN=C4CCC[N]34,4459D83891977244_76599811FF5FA1B8_6041_UN,8.012931,00000000000000000000100000000010000000100000000000001000000000000100000000110101100101100011011010001100010000011001001011101100111001010110011010011111010110101111010,HAPUVLBWJOSGAG-UHFFFAOYSA-N
C1(=CC(=CC(=C1)F)COC2CCCCC2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,5ED97CE132F739E3_6099BB12505B4C9D_7022_UN,8.277617,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010001101011101111110011110110001101011111110111111111110,FXSNUXOSTIVISI-GOTSBHOMSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3(CC3)C4=C(C=CC=N4)F,05C6B0AA0B351D3A_767981A03BDA8FB4_6041_UN,7.8425174,00000000000000000000001000000000000000100010000000000000000000100110000000010101100101110010010010101000100110011001101011100100010001110100001011011011010010101111010,SQQASDIKETVLEY-HNNXBMFYSA-N
ClC1=NC=C(C=C1)CN2C=CN(C2=O)CC4[C@@H]3C[C@@H](C3(C)C)CC4,A5723E9448CC1BCC_F778972ED0146308_6034_UN,7.710391,00000000000100000000000000000000000001000000000000000000000000000110000000110101100101010000000010101001011110101100111011100101110000100110001111011110011110101111110,SNVRIVQZKQFYFC-YVZMLIKISA-N
C[N]1N=C(C=C1C#N)NC3(CC2=C(C=CC=C2F)F)CCCCC3,409F0930867FBEC7_20C000CAFB35C435_6041_UN,7.38672,00000000000000000000000000000000000000100110000000001000000000000110000000010101100100010011011010000000100100011000001011101100110001110100001011011011000110101111010,IXBZQECSDQLHJX-UHFFFAOYSA-N
CN4CCC1=C(C(=NC=N1)N[C@@H]2CCN(C)[C@H]2C3=CC(=C(C=C3)F)F)C4,36F01D50F5466E9B_3E560F9B27BBC079_6041_UN,8.192719,00000000000000000000000000000000000000100010000000000000000000100100000000010101100101110011010010101100110110010001101011100100110001110110001011011111010010101111010,BCONTMORTPQVQV-MSOLQXFVSA-N
O(C3CCN(CC1=CC=CC=C1)C2(CCC2)C3)CC4COCC(C)(C)O4,AF27698773B6A4D2_3C28E8509EA0008C_6039_UN,8.245201,00000000000100000000000000000000000000000000000000000000010000000010000010110000000001100100000001101000010011011001001011100011110010000110000101111100110111111111110,DEDKGRDFCIUVGI-UHFFFAOYSA-N
C(C2=NC1=C(C=CC=C1)[N]2C35CC4CC(CC(C3)C4)C5)=CC6=CC(=NC=C6F)F,0B02DF329B6AA5E0_0F11DABA7A4C821D_7019_UN,8.889535,00000000000000000000000000000000000000100010000000000000000000100110000000010101000101010000000010110100010100011000000011100100100001100100001011001010000010100111010,HNTCEFTUNDLIGB-UHFFFAOYSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC3=C([N](N=C3C)C4=C(C=CC=C4)Cl)Cl,BCF3FF2FAD697A34_FFA27E670F8D6C6E_7019_UN,8.516205,00000000000000000000001000000000000000000000000000001000000000100100000000010000100100010000001010010001000100000000000011101100110001110100001010011010000110101111010,UDJXLXYUZLWRGM-ZBFHGGJFSA-N
FC1=C(C=C(C=C1)N3SC2=C(C=CC=C2)C3=O)NCC4CC5(C4)C6CCC(C5)C6,D52AE25FBB96C2D4_7923A3FB8DFE119D_6041_UN,7.9280796,00000000000100000000000000000000110010000010000000000000000000100111000000010000111100011010101010001100010100101100011011101101110001110100001111011011011110100111110,GIDINTWOLLNFTA-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F)F)C#N,00AAB02122F58DC1_E5BBD552E2C8B024_6041_DP,7.702553,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010101111010,BJQYHEIAZWNBSF-VQIMIIECSA-N
CC1=C(N=NC(=C1)C2=C(C=CC=C2)F)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,8FE6464E61B9B5AB_E427617DC9E96553_6041_UN,8.177479,00000000000000000000001000000000000000100010000000001000000000100100000000010101101101010011011010101000000110010000001011101100110001110110001011011111010110101111010,ZGOPTJWTEPWJJI-HXOBKFHXSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CNCCC3C,F0D621F619B3D302_EE22F4DA94D89144_6041_DP,8.480227,00000000000000000000000000000000000000100010000000000100000000000100000000000100101000110011000000101100110110010001101011000100110101110110011011010111010110101111010,FJGGGMWWNXGLGJ-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC3=CC=CC(=C3)C4CCN(C)CC4)F,3655CC7F2FCA2424_7B71F28F3E11B482_6041_DP,7.24732,00000000000000000000000000000000000000000010000000000000000000100000000000010000001001110011010000101100110100010001101011100100110101110110001011011011010010101111010,QBVFJKWIOFXSEM-UHFFFAOYSA-N
CC1=CC(=C(C=C1)F)NC(CCC2=CC=CC=C2)C35CC4CC(CC(C3)C4)C5,CB9CCC1D8B668602_48A74FC2ABD946AC_6041_UN,7.718503,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010010000000000100110100011000001000000100110001110000000011010011000110101111010,ULSUCZSJFDDSQT-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2=N[NH]C=C2NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,80EE45468A5BE9B7_DD2100C722D1F86F_6041_UN,8.426324,00000000000000000000001000000000000000000010000000001110000000100100010000010101101101010011011010101000000100010000001011101100110101110110001011011011010110101111010,IVFOTGSOWQCNGV-ZHRRBRCNSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CCCC(CC)CC2)F,CA34EDAD054900FF_55A4BEBB76803BC5_7022_UN,7.6737504,00000000000000000001000000000000000000000010000000000000000000000000000000100000001001110011010000001000000110000011101000100000110001110010011010011111010110101111010,KOIJTYMSTMWWEI-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC3CC2(CCNCC2)OCC3)F,31A5B73688C4D047_DA3218D3983B3F9D_7022_DP,7.6077538,00000000000000000000000000000000000000000010000000000000010000000010000000100000001001110011010001101000110101011001001011100000110111110110001011011111110111101111110,XFBYXQHHGHNTMO-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2(CCCNC2)C)F,1D4F7AEBDA442D29_9786F0FF3E198C51_7022_DP,7.21842,00000000000000000000000000000000000000000010000000000100000000000010000000100000101001110011010000101000100110011001101001100000110101110110011011011111010110101111010,AORKBXZSKFWUJO-UHFFFAOYSA-N
CN1C(=O)CCC2=C1C=CC(=C2)NC4=CC3=C([N](CC)C=C3)C=C4,D032D72B705FBABD_FDE3996841CC85E5_6041_UN,8.9372225,00000000000000000000000000000000000000000000000000000000000000000100000000010000000101000001110010101100010010110010111011100101000011010100001111011111011110101111110,DOUMICFEOFOBOT-UHFFFAOYSA-N
C1(=CC2=C(C=C1)OCCCO2)NCC(N3CCN(C)CC3)C4=CC=C(C=C4)F,6BA7EF0355DC9683_2315012587BE33EB_6041_UN,7.6850233,00000000000000000001000000000000000000000010000000000000010000000000000010010001001001110101010001101100010101010101101011100100110011110110001011011001110111111111110,KSOJYLVQKOUNGR-UHFFFAOYSA-N
CCC1=C(C=CC(=C1)F)N[C@H]2[C@@H](OCC2)C3=C[N](N=C3)CC4CC4,1EF1797B19355B8E_EE63183B217BBD5A_6041_UN,8.013958,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011001111001000100101010010001011101100010011110110001010011011110111101111110,HTJOBHTWHZWCCC-MOPGFXCFSA-N
C[N]1N=C(N=C1NCC2(CCOCC2)C3=CC=C(C=C3)F)C4CCOCC4,E32DDB2B364A5551_89B6A23702A9C15D_6041_UN,7.8683643,00000000000000000000000001000000000000100010000000001000010000100110000000010101101100110011011010101000001111001000001011101100110011110110001011011011010111111111110,LFWBMALOEFQSTO-UHFFFAOYSA-N
N(CC3CN1CC2CC1(C2)CO3)C(=O)C5=C4C=C[NH]C4=C(C=C5)F,BCD9B795D5669D22_946C7CF646E2EFCC_6038_UN,7.8502264,00000000000100000000000000000000000000000010000000000000010000000110000000000000101101110011100110101100010101111000010011100100110110100110001001001001111111110111110,PDLYZYOQCGKWQP-UHFFFAOYSA-N
C2(=C1OCCOC1=CC=C2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,369EC93DE733105E_65D1CC6F6F1BD719_7022_UN,8.09169,00000000000000000000000000000000000000000000000000000000010000100000000010010000101001110011010101101101010111010101101011100100110011110110001011011011110111111111110,DOULTOXBHHBMOU-UHFFFAOYSA-N
C(C1CC2CC1C3CC23)=CC4=NC5=C([N]4C)C=C(C=C5)Cl,830117CDE43EEA45_CA9937B80473F0E1_7019_UN,8.94739,00000000000000000001001000000000000000100000000000000000000000000100000000010101000101010000010010010101010100000000000011100100110000100100001011001010000010101111010,GWSKPJFQSKLPFW-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4=CC5=C(N=C4)C(=C(F)C=C5)F,E600FB4C41D85EB9_11DF640A1539426C_6041_DP,8.387196,00000000000000000001000000000000000000100010000000000000000000000100000000000101100101010011010010100100110100010000101011100100110101110100001011011011000010101111010,SSEPQRWKYOZLKW-MIFYACCESA-N
C1(=CC(=CC(=C1)F)COC2CCCCC2)NCC3C(C)(OCC3)C,EF5FDA70B8BBE2FD_8BF37D376AABB5D8_7022_UN,7.7446876,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010011000011001000000111001000101000000011110011110110000101010111110111111111110,PZVKHMKRSBODIR-UHFFFAOYSA-N
C1(=CC2=C(C=C1)CC3CCC(C2)C3=O)NCC4=C(C=C(C=C4)F)F,5E2EE3BE913881B3_0BA6FA6B4F0E5B4C_6041_UN,7.8291187,00000000000000000001000000000000000000000010000000000000000000000000000000000000001000010001000010001100010100000000001000000101110001110000000111010011111110100111110,CEFXQVLNJKRIOV-UHFFFAOYSA-N
O(C3CCN(CC1=CC=CC=C1)C2(CCC2)C3)CC4=NC(=C(S4)C(C)(C)C)C,C0EE6D926E50FEEE_255B9D4C94DDC244_6039_UN,8.241099,00000000000100000000000000000000000010000000000100000000000000000110000000110000010101101000000111101000010011011000001011100111110010000110011111011110110111101111110,DSNOQHFMRQLYOU-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NC[C@H]3[C@@H](C3)C4CCC4)C,064E831341A10153_793E7E62DE507A5F_6041_UN,8.181523,00000000000100000000001000000000000000000010000000000000000000100100000000000000101000010011000000101100010110000000001001000100110001110100001011010111010110101111010,HXGNHXDMCJRSRM-HOCLYGCPSA-N
N1CC2CC1CC2OC(=O)C[N]3C=CC4=C3C=C(C=C4)F,F86C01C368ABA17E_AA877C0C446C50FC_6038_DP,8.162556,00000000000000000000000000000000000000000010000000000000000000000100000000010000001101010011000111101100110100010000000011110111110010100110001101001001111111110111110,IMQWRUSPKRIHDF-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NCC3CC2(CCNCC2)C3,7953ACCB2C0F6917_15ED1D9072A8CAD8_7022_DP,7.236168,00000000000100000000100000000010000000000000000000000000000000000010000000100000001000100011010000101000110000011000001001000000110101010110011001011101010110101111010,VESRGPBGDBWKSS-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC3(CCCCC3)N4CCCCC4,DD2B8D2B6CED11A8_512283F3C025FC15_6041_UN,7.5317483,00000000000000000000000001000000000000000010000000000000000000100110000000010101001101110011010010101100011110011000001011100100110001110110001011011011010110101111010,DBDZDXOWIBUTCZ-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5,3D0BE2BED9CF91AE_2F5F244BE6C00D24_6041_UN,8.17363,00000000000000000000001000000000000000000010000000000000000000000110000000100001001000010011000000101100010100001001101001000100110001110100001011010111010110101111010,FSFOKJDXOBBKNU-UHFFFAOYSA-N
NCCCC(OC1=CC2=C(C=C1)OCCNC2)C3=CC=C(C=C3)F,DA791601F7171E27_B037C2DDB983A47B_6035_UN,8.069351,00000000000000000001000000000000000000000010000000000000010000000000000000000000001010110010000101001100110101010100001011000111110110100110001111010001110101110111110,XNYSUWFMALVQQY-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC[C@@H]2CCN(C)[C@H]2C3=CN=CC=C3)F)CC4,5514B9F94DD078C4_D9DF4CD5FD91D8A8_6041_UN,8.187817,00000000000000000001000000000000000000000010000000000000000000100100000000010001101101110011010010101000000110010001101011100100110001110110001011011111010110101111010,CTQFWGWEZAJEEH-RDPSFJRHSA-N
CC4(C)CCC1=C(C3=C(N1CCC2CCCC(C)C2)C=CC(=C3)Br)C4,CB1B0B149EF53054_E5AED7EEA1325527_6034_UN,7.869062,00000000000000000000000000000000000000000000001000000000000000000110000000110000000101010000000010001100010110011001101001100100110000100100010011011100010110101111010,GSPARBSDVYUQEV-UHFFFAOYSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3(CCC3)C4=C(C=NC=C4)F)C5,ECBF930C13CE6A4E_2CEB2595396039D2_6041_UN,7.844594,00000000000100000000000000000000000000000010000000000000000000100110000000010000101101110011010010101100110100011001101011100100110101110110001011011011010110101111010,AGKGMPAYMIFIHN-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCN(C2)C3CC3)F)CC4,60F3C7EF02E1DF8B_59C40257AB0BA25E_6041_UN,7.8894053,00000000000000000001001000000000000000000010000000000000000000100000000000010001101101110011010010001000000110010001101011100000110001110110001010011011010110101111010,ANNYIJZEDNAALK-UHFFFAOYSA-N
FC2=C(C=C1C=CC=NC1=C2)NC3CN(C)C4(C3)CCC4,E471B36603F689B7_55F5333C2A853CE8_6041_UN,8.125865,00000000000100000000000000000000000000000010000000000000000000000110000000010001100101110001010010101100110110011001101011100100110001110100001011011011010010101111010,HSFZMMARCAAOIO-UHFFFAOYSA-N
CCN3CCC1=C(C(=CC(=C1)NC(COC)C2CCCOC2)F)C3,D364B56A06A38D1C_29106D2543C3B319_6041_UN,6.9820347,00000000000000000000000000000000000000000010000000000000010000000000000000010000000001110011010101101100110111010011101011100010110011110110001011011101010111111111110,ZYGNSYDRWWGTKJ-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2=CC(=C(C=C2)F)C=C[C@@H]3CCCO[C@H]3C4=NC=C[N]4C)F,5A59BD548E2130AC_B39FDC4FBAE040BF_7019_UN,8.315841,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010000010110110000000101000000001011100100100010100100001011011010110011101111110,BMEKBCBLGNAMRK-OYHNWAKOSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4=CC(=C(C(=C4)F)N5CCCC5)F,320BA125B662E2F6_94471025E7BE5B0F_6041_DP,7.7773004,00000000000000000001000001000000000000100010000000000000000000100100000000010100100101110011010010101000111100010000101011100100110101110110001011011011010010101111010,CZTPMZDOUFVTQA-SCAQPMJSSA-N
CC1=C(C(=CC=C1)F)NC3CCN(CC2CCCO2)CC3,E6368B5470374F5E_9CA6FD59C4F661AF_6041_UN,8.370738,00000000000000000000000000000000000000000010000000000000010000000000000000010000100101110010000110101000100101010000001011100000110011110110001011011011110111101111110,QPGLVFCVOUHYLL-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=NC(=C2)NC4=CC=C(CN(C)C3CC3)C=C4,1AEA08606D60DCC4_ECC286BEB7D34719_6041_UN,8.204406,00000000000000000000001000000000000000100010000000000000000000000100000000000100000001110000010000101100010100010001100001100100110001110100001001011001010110101111010,QRRZFZFLQLNIAJ-UHFFFAOYSA-N
CC1=C(C(=CC=C1)Cl)NC3CCN(CC2CCCO2)CC3,DB17F7B62AF1C752_23A837AB0D2E3B7F_7022_UN,8.370727,00000000000000000000000000000000000000000000000000000000010000000000000000010000100101110010000110101001100101010000001011100000110011110110001011011011110111101111110,UPDDXZOOJIWQJR-UHFFFAOYSA-N
C2(=C1C=CC=CC1=CC=C2C#N)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F,C74E691CD2096458_8DB9DDC5BEE6BBEB_6041_DP,7.434272,00000000000000000000000000000000000000000110000000000010000000100000000000000001101000110011000000101100110100010000001001000100110101110110001011010011010010100111010,WJSQAJJUOKIJPV-DYESRHJHSA-N
CC1=C(C=C(C(=C1)NC2=C(C=C(C=C2)C35CC4CC(CC(C3)C4)C5)Cl)F)F,66616EAB2E32527C_E9765F09ACB26856_7022_UN,8.528971,00000000000000000000000000000000000000000010000000000000000000100010000000000000000000010000000000000101010100001000000000000100100001110000000011000011000010101111010,NOBWJKPJPSTXFI-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC34CC(C)(CC3)CO4)F,B311ED3B2806F6D0_604259C2EA87EE63_6041_DP,6.878088,00000000000000000000000000000000000000000010000000000000010000000010000000000000001100010011000110101100110111011001101011000000110111110110001011010011110111101111110,XUTIGURQJLMNRQ-UHFFFAOYSA-N
FC2=C1C(=C[NH]C1=CC=C2)NC3CCC4CN(C)CC34,571D6301DC0ECEBB_58869CFBAC947661_6041_UN,9.00727,00000000000000000000000000000000000000000010000000000110000000000100000000010001100101110011010010001100110110010001001011100100110101110110001000011001010010101111010,AVYKQGOHPXQKCG-UHFFFAOYSA-N
N4CCC1(CCCC1C=CC2=C[N](N=C2C)C3=CC=C(C=C3)Cl)CC4,836D9E58E17404B2_C2F9A4DEBBB539A2_7019_DP,7.972947,00000000000000000000000000000000000000000000000000001000000000100110000000010000101100110001001010111001110100011000001011101100110001110110001011011011010010101111010,VJFZIJUINIARBA-UHFFFAOYSA-N
C(C12CN(CC1)CCC2)=CC3=C[N](C)N=C3C4=CC=C(C=C4)F,26AA1C93604A23BE_B2642DC18080FDA3_7019_UN,7.876587,00000000000000000001000000000000000000000010000000001000000000100110000000010000100101110000011010111000010100011000001011101100110000100110001011011010010010101111010,PMKCDXIZIXCSBX-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(C)C(OCC2)C3CC3)F)F,128FE1DFA3FC3D0C_64EF61C40C069BF1_7022_UN,8.592197,00000000000000000000001000000000000000000010000000000000010000100010000000000000001100010011000011001000000111001001101000000000110011110110000010010111110111101111110,CAMYJYRGYAUJAS-UHFFFAOYSA-N
CC(C)C1=CC(=C(C=C1)NCC2CC3(CN2)CCOCC3)F,292DEF0224CF904E_031ACB3A233B0B49_7022_DP,8.03569,00000000000000000000000000000000000000000010000000000010010000000010000000100001001100110011000010101000110101011000001011000000110111110110001011010111010111101111110,UTRLVNVVXJCYNB-UHFFFAOYSA-N
N3C[C@@H](OC1=NC=C(C(=C1C#N)C)I)[C@H](CC2=CC=CC=C2)C3,CEF338F64F61B3E9_B8A6C629AD70EBB5_6035_DP,7.5455008,00000000000000000000000000010000000000000100000000000000000000000100000000000000101100110011100111101000000100100100010011000111110010100110001111000011110111101111110,BZOMWNJIHVTBOH-RHSMWYFYSA-N
C1(=CSC(=C1)Cl)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4,55F36A97AA79D15A_E739DC22406FC5A2_7022_UN,7.74101,00000000000000000000001000000000000010000000000000001000000000100100000000010001111101011011011010101001000100010000001011101100110001110110001010011011010110101111010,XSKHKENSEXLZJD-PXAZEXFGSA-N
CC4(C)COC3(C[C@@H]2CC(OCCOC1CCCCO1)C[C@@H]2C3)OC4,FF1B32F51356D5EF_2F492441E1EC855E_6039_UN,7.338357,00000000000000000000000000000000000000000000000000000000010000000010000010100000000000000100000010100100010001001001001010010011110010000110100101110100110101011001110,FPHDWCGFKNYBOE-OQSMONGASA-N
C(C1C2CCOCC12)=CC3=C([N](C)C4=C3C=CC=C4)Cl,78AC30C990BFE835_13850926E3BFE55C_7019_UN,8.590352,00000000000000000001001000000000000000000000000000000000010000000100000000010000000101110000010010110101010101000000001011100100110010100110000011011010010011101111110,FBJYUQSALLQQMH-UHFFFAOYSA-N
C1CC(CCN1)C2=CN(C3=C2C=CC=C3)CC4=CC(=C(C=C4)N5CCCCC5)F,184C7C354D26111B_1006B0121B08A7B2_6034_UN,8.180201,00000000000000000000000000000000000000000010000000000000000000100100000000010000001101110001000010101100110100010000001011100100110001110110001011011011010110100111010,BGHAWYJRIJSMED-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C3=CC(=C(C=C3)F)CC)=O,3A47810ECB40EE29_12F9C82165C0DDF7_6038_UN,7.8653364,00000000000000000000000000000000000000000010000000000000010000000000000000000000001100010001100010001000110100110010011000000000110010100100000011010011111111111111110,APAOANWVVAQEQK-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3(OCCNC3)C,E256B4367E917333_45C3A003E52E0D40_6041_DP,7.679493,00000000000000000000000000000000000000100010000000000100010000000110000000000100101000110011000100101100110111011001101011000100110111110110011011010111110111101111110,FQEACJRPXULRHJ-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)N[C@H]3[C@H](C2=C([N](N=C2C)C)C)OCC3)F)F,1CC99FE3D23A78E9_0FBC5EB2C53F8264_7022_UN,9.00998,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111000000100101010000001011101100000011110100011010011111110011101111110,HHHAHMVSXGNUQM-CXAGYDPISA-N
FC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]5[C@@H]4CNC[C@@H]4C5,A13CB167F1CAAF08_24073D513D79B80A_6034_UN,8.602921,00000000000100000001000000000000000000100010000000000000000000100100000000010101001101110011000010001000110100010000001011100100110100100110001010011011010110100111010,BBUXIBUPRKXEDH-XLHDVRGUSA-N
N4CCC1(CCCC1C=CC2=C[N](N=C2C)C3=CC=C(C=C3)F)CC4,DA80FD9128752B7F_E0061D4076B3DDA2_7019_DP,7.9728317,00000000000000000000000000000000000000000010000000001000000000100110000000010000101100110001001010111000110100011000001011101100110001110110001011011011010010101111010,BRKTZGGOOOHVQV-UHFFFAOYSA-N
N2CCC(OCCCCC1(C)OCCO1)C23CCCC3,FDCB98815C8FCDA0_CF29F6DE666C7E2B_6039_DP,7.4486895,00000000000000000000000000000000000000000000000000000000010000000010000010000000001100000011000111001000110011011001101011010011110010000110000100110001110111111100110,UCVFUGXEBSFAEG-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@@H]4CC[C@H](CC3=CC=CC=C3)O4,D2F8B52675CDCA76_1EC453FD92606A5F_6041_UN,7.4130416,00000000000000000000000000000000000000100010000000000000010000000100000000000100001100010011000110101100010110000000001011000100110011110100001011010111110111101111110,LBAPOMCTOAHIPZ-MOPGFXCFSA-N
N(CC1=CC2=C(C=C1)COCC2)[S](C3=CC4=C(C=C3)C=CN=C4)(=O)=O,D96CBECADDA49D28_3B6111EB69C2B3A2_6029_UN,8.481072,00000000000000000000000000000000110000000000000000010001011111001101010001000000011000101000001000101110011001001000011011001100111010001110001011111001010111110111110,VVAVFVGMXQRBIA-UHFFFAOYSA-N
C[N]1N=C(C=C1NCC2(CCCC2)C3=C(C(=CC=C3)F)F)C4CCCC4,2C9C581A8A4A50ED_6A34368680996ECE_6041_UN,7.910572,00000000000000000000000000000000000000100010000000001000000000100110000000010101101100010011011010001000000110001000001011101100110001110100001010011011010110101111010,UUALFNUWOZKASB-UHFFFAOYSA-N
C[S](=O)(=NC1=NC(=CC=C1)NC2=CC4=C(C=C2)OC3(CCC3)C=C4)C,3B30726B9129E93E_030C0B17A13C883B_6041_UN,8.216373,00000000000100000000000000000000110000100000000000010000011011000111000001100100100000101000011001110110010000001100011111001100001011010100001011011101100011111111110,VDMKOHQDBIKTQJ-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC3CC2(CCNCC2)OCC3)F,5DA87B83C7A93DA9_4FB639DCC5435DB4_6041_DP,7.463455,00000000000000000000000000000000000000000010000000000000010000000010000000100000001001110011010001101000110101011001001011100000110111110110001011011111110111101111110,CNRDJFRSPBXTNZ-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC4CCCN(CC3CC3)C4,BAB1A895BF67B4A6_C1E65EC5EA9FA464_6041_UN,7.9714317,00000000000000000000001000000000000000000010000000000000000000000100000000010001101001110011000000101100010110010000001011100100110001110110001011011011010110101111010,ROHNENUWVAFMEO-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3=C[N](C[Si](C)(C)C)N=C3,74E2818DD38C126F_3A01FE87C528F950_6041_UN,7.755207,00000000000000000000100000001010000000100000000000001000000000100100000000110101100101100001011010101000000010011001101011101100010001010110011000011111010110101111010,VFWIPSACQIMACI-INIZCTEOSA-N
FC1=C(C2=C(C=C1)C=CO2)NC(CC)C3CCCCC3,192D95CA514ACF2B_94577AC1C8658187_6041_UN,7.9489717,00000000000000000000000000000000000000000010000000000000010000000000000000000000000100010011000110000100110110010010001000000100110001110100000011010011100110101111110,XUSDLOKTSXTZCV-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NCC4(CCCC4)C5=C(C=CC=C5F)F,D5B835593D757516_2C0075A65C5CD601_6041_DP,7.91337,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000010110001000001011100100110101110110001011011011010110101111010,LGRRDHRSBUAEJP-YLQYIJTPSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NCC4=C(C=CC(=C4)C5OCCO5)F,DBC5CA89B26AE8B7_8E284366846C1C3F_6041_DP,8.213115,00000000000000000000001000000000000000100010000000000000010000100100000010000101101101110001010010101000010111000000001011110100110111110110001011011011010111111111110,ZYWHTWVVTWKZNK-RTHVDDQRSA-N
C(C=CC1CCCCC1)=CC2=C[N](C)N=C2C3=C(C=C(C=C3)F)F,B57450A0339DD05B_B846C645A20F8559_7019_UN,8.770298,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010000000100000000001011101100110000100100001011011010000010101111010,NZLWGRNGKNKHCG-UHFFFAOYSA-N
CN3CCN(CC1=C(C=CC=C1)NCC2C(CCOC2)(F)F)CC3,6B09BB40961A5C8C_7DF31802C04D8AA6_7022_UN,7.5548997,00000000000000000000000000000000000000000010000000000000010000000000000000010001101001110011010001101000000101011001101011100000110011110110001011011011010111101111110,WJUMPEFFMBQINF-UHFFFAOYSA-N
N(C1C2CCC(CC1)CO2)C(C3=C(CCC)[N](N=C3)C4=CC(=CC=C4)F)=O,05DF298490005FD1_B391FCD00DA9980C_6038_UN,7.8687153,00000000000000000001000000000000000000000010000000001000010000100100000000010000100100010011101111100000110101110011011011101100110011110100001011011011111111111111110,CIYHHHUAUUVKMT-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)F)CC#N)NCC3OCC2(CCNCC2)C3,DECBD52E6E8CC28C_292DF462CA8BB444_6041_DP,7.983568,00000000000000000000000000000000000000000110000000000000010000000010000000000000001100110011000110101000110101011000001011000000110111110110001011010011110111100111110,VNARRDZHCAAIKJ-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)N[CH]4C[C]3(C[C](C)(C3)C)C4,FEF7ADDE8C063BC9_E1EFB24021226FE8_6041_UN,7.6599417,00000000000100000000000000000000000000100000000000000000000000100110000000110100100101100001010010101000110010011001101011100000110001010100011000011111010010101111010,DWUZJWYINMMZKD-INIZCTEOSA-N
BrC1=CN(C(=O)C2=C1C=CN=C2)CC3(N)CCOC4=C3C=CC=C4,8CC28609EA36721B_CB2F30FE97624E7B_6034_UN,8.294424,00000000000000000000000000000000000000000000001000000000010000000110000000010001100011010010100001101100110101111100011011100101010011100110001111011011111111110111110,KBSUGMXKZWQDMP-UHFFFAOYSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3(CCCNC3)F)C4,B2EB2FE4A587A84C_3C245049910AB064_6041_DP,7.1222563,00000000000000000000000000000000000000000010000000000100000000000110000000010000101101110011010010101100110100011001101011100100110101110110001011011001010110101111010,RRHRLNWPYJYTFA-UHFFFAOYSA-N
CC1(C)O[C@@H]2CC[C@H]1C[C@H]2OC3=C(C=C(C=C3)Br)C4=CC=NO4,38660624480E6DD0_12E918DA6E1C86DC_6035_UN,8.128745,00000000000000000000000000000000000000000000001000000000010000100110000110100000000100010100001011100010010110001100101011001111110010100100000111110110100001011111110,NTETYKVPCNOCJO-YMRXKLBXSA-N
C2(=CC1=C(C(=CC=C1)F)O2)NC[C@@H]3OCCN(CC)[C@H]3C4=C[N](N=C4)C,0AD49FBF437B3A24_859380FC07139AC9_7022_UN,7.824178,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001111110101100010111110010111011101100110011110110001001011111110111111111110,NJOPGIYUFZFCCA-WMZOPIPTSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC(C3CNC3)F,2DC0184C3DA4FFB3_403AF6D507B602D8_6041_DP,8.279525,00000000100100000000000000000000000000100010000000001000000000100100000000010101101100100011011010001000000110000000000011101100010101110110001010001111010110101111010,DQCNGYPXJITFEQ-UHFFFAOYSA-N
NCC34CCC(COC1=C(C=CC(=C1)C2CNCCC2)F)(CO3)C4,DEF539F8D38F86FF_A5A20C0FF6A70C3B_6035_UN,7.6570096,00000000000000000000000000000000000000000010000000000000010000100010000000000000001110110111000110101000110101011100001011000011110110100110001111010011110101110111110,UCAFCHUMABCECN-UHFFFAOYSA-N
FC2=CC(=C1OCCC1=C2)NCC3CCN(C(CC)C)C3,B808C0297AE5CC76_8E6B264C1BED810C_6041_UN,7.834553,00000000000000000000000000000000000000000010000000000000010000000000000000010000101101110011000110001100010111010111101011100000110011110110001010011101110111101111110,FYXQTPYGXCYITP-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(C3=C(C=C(C)C=C3)F)=O,17359BCFEF20E794_175CC224E88DC89E_6038_UN,7.721641,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010001100010001000110100110000011000000000110000100000000011010011011110101111110,MAAVCNIQPFLWOD-UHFFFAOYSA-N
C1(=CC=C(C=C1)C[N]2C=NC=N2)NCC3C(C)(C)C4CCC3C4,AA76FC3D2F8F938D_A63CE02F1B30024F_7022_UN,8.608235,00000000000000000000000000000000000000000000000000001000000000000110000000110101101100000001001010001000010010011000101011101100110001010110001001011111010110101111010,JAPDMTBIDFZMPW-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(=O)C3CCCCN3CC4=CC(=CC=C4)F,B6B530308CBADF96_659DA16C6BE9448A_6038_UN,7.6135073,00000000000000000001000000000000000000000010000000000000010000000000000000010001001101110011100110101000010100110000011011100000110010100110001001011011111111110111110,KITNHCLXILALJG-UHFFFAOYSA-N
O(C(=O)CN1C2CC(C1)C=C2)CCNC3=CC(=CC(=C3)Cl)Cl,93233FBE9A74B630_6B360592B2C2B842_6031_UN,7.627118,00000000000000000000000000000000000000000000000000000000000000000000000000010000001101110000000110111001110101010000001001110010110011110110001001011001011111110111110,CWHXFWPUDZTVDC-UHFFFAOYSA-N
N(CC12CC(C1)CO2)C(=O)C3CCCCN3CC4=CC=C(C=C4)F,17536C571484D018_F5181238E5A622B7_6038_UN,7.955991,00000000000100000000000000000000000000000010000000000000010000000010000000010001001101110011100110101000010101111000011011100000110010100110001001011011111111110111110,QPMLBKBVCWPLEF-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCN(C(CC)C)CC3,EC54371073F42D6E_9895EF1060809126_6041_UN,8.01762,00000000000000000000000000000000000000100010000000000000000000000100000000010100001001110011000000101100010110010011101011100100110001110110011011011111010110101111010,ZYABAXJWWCFGMW-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC2=NC=CN2C[C@H](CC)NC3CC4=C(CC3)C=CC=C4,8C4B173DCD356C27_1E790F076DC87068_6034_UN,7.947113,00000000000000000000000000000000000000100000000000000000000000000100000000010101001101010011000010001101110110010010101011100100110101110110001011011111010110101111010,XOMNOGBDSDKBRK-HMTLIYDFSA-N
CC(C)(C#N)C1=C(C=CC(=C1)NCC2CC3(CN2)CC3)F,8577F7C2BCCD223F_018588DBB4F4A6E5_6041_DP,7.5955153,00000000000000000000001000000000000000000110000000000010000000000010000000100001001100010011000010001000110100011000000001000000110101110110001010010111010110101111010,VKPBKEKLYSPWSW-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)NC2CC(OCC2)C3=CC=C(C=C3)F)[C@H]4C[C@@H]5CC[C@H](C4)N5,7DD7CABC4B472BFB_EA74064148BD059B_6041_DP,7.9251513,00000000000000000001000000000000000000100010000000000000010000100100000000000101100101110011010011101000110101010001101011100100110111110110001001011001110111101111110,POBJUNAVKIFXCC-WWVOSGSCSA-N
N(CCCC1=CC2=C(C=C1)OCCO2)C(C=C4CC3CCC(N3C)C4)=O,FC998DCA9DDD69E7_00DDC9286C068EF0_6038_UN,7.860981,00000000000000000001000000000000000000000000000000100000010000000000000010011000001101000011110010111100110011110100111011100000110010000110001011111001111111111111110,DSEOQWFRSVCCQV-UHFFFAOYSA-N
FC2=C(C=C1C=C[NH]C1=C2)NCC4=CC3=C(CN(C)C3)C=C4,05BBD4462690F453_26E7C2A75CBA4211_6041_UN,9.256139,00000000000000000000000000000000000000000010000000000000000000000100000000010000001101110000010010001100010100000001000011100100110101110110001011001011010110101111010,KRADEZSSGSTLQG-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CC4=C(CCC3)C=CC=C4,9D33FFE6324152BF_C80D9603F9EDC32C_6041_UN,7.878014,00000000000000000001000000000000000000000010000000001000000000000100000000010000101100010011011010001100010100000000001011101100110001110100001011011001010110101111010,AZRQHCPIGFOJGS-UHFFFAOYSA-N
C1CC(CN1)C3=CC2=C(C=CC=C2)N3C[C@H]4[C@@H](CCNC4)C5=CC=C(C=C5)F,CC18348780BED37E_8EF7248684295175_6034_UN,8.815998,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010101100110100010000001011100100110100100110001011011011010110100111010,SOJRJVCHDLTKQB-BXBRYHBFSA-N
CCC(C)C1=CN(C2=C1C=C(C=N2)Br)C[C@H]3[C@@H](CCNC3)C4=CC=C(C=C4)F,35B0AB8B34CDB053_C0C33AD0ED73FF05_6034_UN,8.719748,00000000000000000000000000000000000000100010001000000000000000100100000000010100101101110011000010101100110100010011001011100100110000100110001001011111010110101111010,OVRPXZRNURXMEE-LXKGCQHHSA-N
C[N]1N=C(C=C1NC2C3=C(CC2)C=CC(=C3)F)C4CCCC4,6F63F8A5B3C20CA5_7CA81DFEF605E28F_6041_UN,8.270624,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011011010000100110100010000001011101100010001110100001010011011000010101111010,URPZECQKFLHRNW-UHFFFAOYSA-N
ClC1=C2C(=NC=C1)N(C=C2C3CC3)CC(CC)C4=CC5=C(C=C4)CCCC5,C17956625DC65AC0_3BF0A5BA3BBCED78_6034_UN,8.065263,00000000000000000000001000000000000000100000000000000000000000100100000000010100000101010000000010101101010100000010101011100100110000100100001011011000010110101111010,SNAYCHSYMYTFMZ-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3CC4CC3C5CCCC45,4D72797DC4A64500_73B809E9C30C91F7_6041_UN,8.194321,00000000000000000000000001000000000000000010000000000000000000000100000000010101000101010011010010000100111100010000001011100100110001110100001011011011000010101111010,JOSHGYDIEXCABQ-UHFFFAOYSA-N
CCN3CCC1=C(C(=CC(=C1)NCC2C(C)(SCC2)C)F)C3,414287A54F702982_9C223B8025ABB973_6041_UN,7.7891607,00000000000000000000000000000000000010000010000000000000000000000010000000110000011101111011000010101100010110011010101011100000110001110110011011011111010110101111010,HTIGLQXVTLAVGR-UHFFFAOYSA-N
CC1(CCO1)C2=CC=C(S2)NCC4=C(N3CCCN(C)CC3)C=CC(=C4)F,EBBB84B0503E4DC1_EA685D2E5FEE74D5_6041_UN,7.5263505,00000000100100000001000000000000000010000010000100000000010000100010000000010001111101111000010010001000000111011001101011100100110011110110001010011111110111101111110,CTIWFKGKQXIDFQ-UHFFFAOYSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC5CC4(CCN(C)CC4)OC6=C5C=CC=C6,2CEC5DDE55CCBBC4_89195956724563FD_6041_UN,7.589485,00000000000000000000000000000000000000100010000000000000010000100110000000010101000101110001010011101100110101011101101011100100110011110110001011011001110011111111110,NMHXDVZUBXPWPI-UHFFFAOYSA-N
O(C[C@@H]2CN(CC1=CC=CC=C1)C[C@H]2F)CC3CCC(C)(C)CO3,80535FA62B8D91E5_52D7D49CEBD28E5E_6039_UN,7.973934,00000000000000000000000000000000000000000010000000000000010000000010000010110000000101110000000011101000000101001001101011100010110010100110000001011110110101111111110,FVPRJVIPIJIAKQ-LJJQOFDWSA-N
FC1=CC2=C(C=C1)N(C=C2C3CCNCC3)CC4=C[N](N=C4[C@H]5CC[C@@H](C)O5)C,C970007D36DB2AA4_B30F26590E435650_6034_UN,8.329275,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011111101100110110010001101011101100110010100110001011011111110111101111110,UDRSXSMXPPNJCE-IVZQSRNASA-N
N(CC23CC(CC1=CC=CC=C1)(C2)CO3)[S](C5=CC4=C([NH]N=C4)C(=C5)F)(=O)=O,4AFAB5F9767D9AE6_E450E35A5168CFF5_6029_DP,7.4570417,00000000000100000000000000000000110000000010000000011001011111001111010001000000111100011011001110001110011101001000010011001100111110101110001001101001110111110111110,RUPBYSKNXXPREI-UHFFFAOYSA-N
CC2=C1[NH]C=CC1=CC(=C2)NCC3C(CCC)CCC3,0DC73E2D3DCCCE88_836687FB494051EB_6041_UN,8.51629,00000000000000000000000000000000000000000000000000000000000000000100000000000000001100000011000010001100010010000011001001000100110101010100001000010111010110101111010,IQGWVXKDGGAGOX-UHFFFAOYSA-N
ClC2=C1C(=C[N](C1=CC=C2)C[C@@H]3CNCC(O3)(C)C)CC#N,174A24B5B2B82FF3_AB80F490E17DA832_6034_DP,7.5597687,00000000000000000000000000000000000000000100000000000000010000000110000000110000101101110010000110101101010110011001000011100100100010100110001001001101110111101111110,ITMXMXXBZYPUQE-ZDUSSCGKSA-N
C[Si](C)(C)C#CC1=CC(=NC=C1)NCC2N(C)CC3(CC2)CCC3,AA3B3EB913CCBB5F_1DAD8C59B85071C5_6041_UN,8.139313,00000000000100000100100000000010000000100000000000000000000000000110000000110101001001100011010000101000010010011001101011100000110001010110011001011111010110101111010,KKTOJYQHUWOFKY-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NCC2=C(C=N[N]2C)C3CC3,08E52C2AF713A19C_47F5F4365B6A9D61_7022_UN,8.267278,00000000000000000000001000000000000000000010010000001000000000100100000000010001101100010000011010011000000100010000100011101100100000100100001010011011010110101111010,FJRKWCQCDWXIKC-UHFFFAOYSA-N
BrC2=C1C(=C[N](C1=CC=C2)C[C@@H]3CNCC(O3)(C)C)CC#N,F53014E7777F7B7F_8208A0F6BFEBCCEE_6034_DP,7.55974,00000000000000000000000000000000000000000100001000000000010000000110000000110000101101110010000110101100010110011001000011100100100010100110001001001101110111101111110,HGCIXHBSXZNVCU-ZDUSSCGKSA-N
FC1=C(C2=C(C=C1)OCO2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,32165E9AE361A140_5740B6A6E831552C_6041_UN,8.761671,00000000000000000000001000001000000000000010000000001000010000100100000010010001101101010011011111101100010101010100001011111100110001110110001011011011110111111111110,MEUJELHWVXVLTA-YJYMSZOUSA-N
CN(CC1=NC=C(N=C1)N[C@@H]2CCN(C)[C@H]2C3=CC(=C(C=C3)F)F)C4[C@@H]5CNC[C@H]45,994728411F74C7A4_CDC7DD2F32731674_6041_DP,8.265448,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101110011010010101000110110010001101011100100110101110110001011011111010110101111010,KLVBIQBFDRHPCD-XODXUGTQSA-N
CC1=CC2=C(C=C1)C(=CN2CC3(CC3)C4=CN=C(C=C4)Cl)C5CCNCC5,06B8328B0B968669_F2F711F9EF65856F_6034_UN,8.110522,00000000000000000000001000000000000000000000000000000000000000100110000000010000001101110001000010101101110100011000001011100100110000100110001001011001010110101111010,CONGJZDQLDWUIJ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC2=C(C)C=CC(=C2)N3CC4CCC3C4)C5OCCO5,07EFBFFCBF35393A_11004852ABB92FA5_6041_UN,7.3055024,00000000000000000000000000000000000000000010000000000000010000100000000010010000100101010000000010101000010101010000001011110100110011110110001011011011010011111111110,AQYJEVGJFAEFLV-UHFFFAOYSA-N
CN1CCNCC1C2=NC=CN2CC3CC3=CC4=C(C=CC=C4)Cl,39C93797334BF580_0D9A11B3A4B34B4F_6034_UN,7.93073,00000000000000000000001000000000000000100000000000100000000000100100000000011101101101110001010010111001100100010001101011100100110000100110001011011011010110101111010,LJEQCLCNBMJRBT-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(CC3)C4=C(C=C(C=C4)F)F,F0AE8DB0375FAF6F_72E90F740A6EBB16_6041_UN,8.032272,00000000000000000000001000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100010001110110001011011011010110101111010,BPYGUFWHLOGBQU-SFHVURJKSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC5C[C@H]4CCC[C@H](N4C)C5,613FF660DA930F3F_8CE41817DF23698B_6041_UN,6.7932515,00000000000000000000000000000000000000100010000000000000010000100100000000010101100101110001010010100100110111010000101011100100110011110110001001011001010011101111110,LPLVSXMWKGJAQE-ZNXRZULTSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CNC(CO3)(C)C,4A0E9E2BFA36B4D3_7C21FD72396B4DF3_6041_DP,8.156029,00000000000000000000000000000000000000100010000000000100010000000110000000100100101000010011000100101100110111011001100011000100010111110110011011000111110111101111110,MWVRXQKSCHDSBP-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)C4=C[NH]C5=C4C=C(C(=C5)Br)Br,678B1FA54BCB5AEA_446878F8954FE209_6038_UN,7.1188507,00000000000100000000000000000000000000000000001000000100000000000110000000000000101100010010100011001100010100101000011001000100110100100100001011010011011110100111110,YHIQPTHPHHNGRS-UHFFFAOYSA-N
CC1=C(C=NC(=C1)C2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,7D78E2B024854DC2_D3573FB2C49ACC91_6041_UN,7.810725,00000000000000000000001000000000000000000010000000000000000000100100000000010001100101110011010010101000100110010001101011100100000001110100001011011111010010101111010,BHSFTUBIYDGCPT-XLIONFOSSA-N
CC1=C(C=CC(=C1)N2CCOCC2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,9EC568E181DF7A69_88C5771A9360877A_6041_UN,7.4809895,00000000000000000000001000000000000000000010000000000000010000100000000000010000001001110011000100101000000111010000001011100100110011110110001011011011010111101111110,JGUIRAAKEHFDHW-DOTOQJQBSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCCN3CC4CCC(C3)O4,58DAC16384270718_12F2CB3E6820488A_6041_UN,7.9545946,00000000000000000001000001000000000000000010000000000000010000000100000000010101001101110001010110101100111110010000001011100100110011110110001011011011110111101111110,LIHGXGBJYJMJIO-UHFFFAOYSA-N
COCC[N]1C=CC2=C1C=C(C=C2)NCC(N3CCOCC3)C4=CC(=CC=C4)F,8DD744788D28807C_757D9FC3FD66F04B_6041_UN,7.44247,00000000000000000000000000000000000000000010000000000000010000000100000000010001101101110001010110101100010101010001101011100110110011110110001001011001010111111111110,IPUDZHOOOQVYLJ-UHFFFAOYSA-N
FC1=C(C=CC=C1)[S](=O)(=O)NC2=CC4=C(C=C2)OC3(CCC3)C=C4,822A7DAF3DDB452F_DF7A413C8196CE6E_6026_UN,8.081403,00000000000100000000000000000000110000000010000000010001011111001011010001000000010000011000001000110110011100001100011000001100001011111100000011111011100011110111110,SIIBFCAXIXIURL-UHFFFAOYSA-N
ClC1=C(C=CC=C1)[S](=O)(=O)NC2=CC4=C(C=C2)OC3(CCC3)C=C4,4B638AC97A31E849_AC47D007FBBB87F9_6026_UN,8.081404,00000000000100000000000000000000110000000000000000010001011111001011010001000000010000011000001000110111011100001100011000001100001011111100000011111011100011110111110,UXGDISXVDZXJPM-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC34CC(C)(CC3)CO4,0388845EB7D9F9F4_6DCCDCE721EE4879_6041_UN,6.8486776,00000000000000000000000000000000000000100010000000000000010000000110000000000100001100010011000110101100010111001001101011000100110011110110011011010111110111101111110,AEWOLYSAFAHFDW-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)F)NCC2(CN(C)C)CCOCC2)F,ABF8145CBC940BFB_F5FCF9F111576EA0_7022_UN,7.235471,00000000000000000000000000000000000000000010000000000000010000000010000000100000101001110011010000101000000111001001001000100000110011110110011011011111010111101111110,AJLOEOJUETZVNR-UHFFFAOYSA-N
C[N]1N=C(N=C1NC2(CCC2)CC3=CC(=CC=C3)F)C4CCOCC4,D170C7C56AE1D66E_5F6D1899B98C168C_6041_UN,7.885731,00000000000100000000000001000000000000100010000000001000010000100110000000010101100100110011011010100000101101011000001011101100110011110110001011011011010111101111110,RDMQSQVXFBBEBT-UHFFFAOYSA-N
FC2=C1SC=C(C1=CC=C2)NCC3CCN(C(CC)C)CC3,FF077A5D01DDCA8B_12BF563A854DEE08_6041_UN,8.112376,00000000000000000000000000000000000010000010000000000000000000000000000000010000011101111011000010101100010110010011101011100100110001110110001001011101010110101111010,OLFGEBMNUCFWCU-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CCC2CCC(C)CC2)C=CC(=C3)C)C4,4A9EF20282797D1E_B2A8CC33194CE5C2_6034_UN,8.230209,00000000000000000000000000000000000000000000000000000000000000000100000000010000000101000000000010001100010010010011101001100100110000000100010011011100010110101111010,LCVQKOMAZKVTGF-UHFFFAOYSA-N
CCC1=C(C(=CC=C1)F)NC3C[C@H]2CCC[C@H](N2C)C3,772617C24D885C6C_1C62694D23779B5A_6041_UN,7.586091,00000000000000000000000000000000000000000010000000000000000000000000000000010000100001010011010000100100110110010010101001100000110001110100001011011111000110101111010,DPLAJEXBLRPDQH-GOOCMWNKSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC4=C(N3CCN(C)CC3)C=CC=C4Cl,26EAF56CBE758E6C_D3C01EAB70379FD2_7019_UN,7.86256,00000000000000000000001000000000000000000000000000000000000000100000000000010001000001110000010000111001000100010001101011100000110001110110001011011010010110101111010,RHNISOQUAWLDKP-AEFFLSMTSA-N
N(C1C2CCC(C1)CC2)C(=O)CCCC3=CC(=C(C=C3)F)F,853538D4AA5AD117_C8DA6F934C7B3BA3_6038_UN,7.541855,00000000000000000000000000000000000000000010000000000000000000000000000000000000000000010011100000000000110100110000011000000000110011100000000011010011001110100111110,QKEIQZWQFGCAFC-UHFFFAOYSA-N
N(C1C2CCC(C1)CC2)C(=O)CCCC3=CC(=C(C=C3)Cl)Cl,20C24A3A4E351DDB_54260D0EFA071730_6038_UN,7.541845,00000000000000000000000000000000000000000000000000000000000000000000000000000000000000010011100000000001110100110000011000000000110011100000000011010011001110100111110,ZCPJRPZCPFBSCL-UHFFFAOYSA-N
CC1=C(SC=N1)C4=NC2=C(C=C(C=N2)NCC3C[Si](C)(CC3)C)[NH]4,813BF4AC637548E7_4850E6010197E081_6041_UN,8.293706,00000000000000000000100000000010000010100000000100000100000000100100000000100101111100101011010010101100010010001001101011000100110101010110011010011111010110101111010,IVVAHYQVXYMSNT-UHFFFAOYSA-N
COC1=CN(C2=C1C=C(C=C2)F)C[C@H]3[C@@H](CNC3)C4CCOCC4,209709A653D77ABA_38754DF278C97ED6_6034_UN,7.9822254,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011010111101100010101000100001011100111110010100110001101011011110111111111110,NUJDXSAZFDICIL-YOEHRIQHSA-N
FC1=C(C2=C(C=C1)SC=C2)NCC34COC(C)(CC3)C4,B7A86ECEC8A6A1DF_ED8AEC454C770427_6041_UN,7.284418,00000000000000000000000000000000000010000010000000000000010000000010000000000000011100011011000011101100010111001001101010000100110011110110000011010011110111101111110,GOYBMYFLVDRVTF-UHFFFAOYSA-N
C[N]1N=C(C=C1N[C@@H](C)C2=COC3=C2C=CC=C3F)C4CCCC4,7DEFC8AE45A81F7C_BFA5E53F33124273_6041_UN,8.169524,00000000000000000000000000000000000000100010000000001000010000100100000000010101100100010000011011000100010100000000001011101100010001110100001010011111100010101111110,OVYBHXCMXSRXND-LBPRGKRZSA-N
CC1=CC2=C(C=C1)N(C3=C2CC(CC3)(C)C)C[C@H]4[C@@H](CNC4)C5=CC=C(C=C5)Cl,A08AECB7F1653E19_B6B9C6DF7F878889_6034_UN,7.6339145,00000000000000000000000000000000000000000000000000000000000000100110000000110000101101110011000010001101010100011001101011100100110000100110011011011111010110101111010,ZZXCFKAEKJHNBR-CVDCTZTESA-N
FC1=C(C(=CC=C1)NC[C@@H]2CCN(C)[C@H]2C3=CN=CC=C3)F,DBCF970651C50C9D_EE16DDCCA3FE5513_6041_UN,8.961209,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101000000110010001101011100100110001110110001011011011010110101111010,DTWGHXDWHLIFSD-GUYCJALGSA-N
CC2=C1N=C(C=C(C1=CC=C2)C)NCC3CCCC(O3)C4CC4,66090E94299BA146_7CA573163BD1AB22_6041_UN,7.949528,00000000000000000000001000000000000000100000000000000000010000100100000000000100001000000011000100101100010000000000001011000100110011010100001001010101110111101111110,SKVQLJXGLOTDGQ-UHFFFAOYSA-N
CC2=C[NH]C3=C1C=C(C=CC1=NC=C23)NCC(N4CC(C)OC(C4)C)C5=C(C=CC=C5F)F,BE877F6E57239BFB_3750AAE890BAFEE3_6041_UN,8.35243,00000000000000000000000000000000000000000010000000000000010000000100000000010001101101110001000110101100010110010001000011100100110111110110011011001111110111101111110,JUAHJKYCINWGSZ-UHFFFAOYSA-N
CC(C)(C)C2=CC1=C(C=CC(=C1)F)N2CC4CCC3(CCCC3)CN4,1A2EB3EAF6122D4B_6A10CADC7E7FA243_6034_UN,7.149098,00000000000000000000000000000000000000000010000000000000000000000110000000110001001101010011000010101100110110011000001011100100110000100110011011011111010110101111010,JTYDSFOURNSNTM-UHFFFAOYSA-N
N3CCCC(CC=CC1=C(Cl)[N](C(=N1)N(C)C)C2=CC=CC=C2)CC3,E6DAF4E1F0341777_D7E52B47563528E3_7019_DP,7.1389227,00000000000000000001000001000000000000000000000000000000000000100100000000110101001101110011010010011001101100010000001011100100110001110110001010011111010110101111010,SYFXMZKWMGCGFL-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC(C3CCNCC3)F,8C1624C60F0543D7_2060A8DCFC131DDA_6041_DP,8.044324,00000000000000000000000000000000000000100010000000001000000000100100000000010101101100100001011010101000100110010000001011101100110101110110001011011111010110101111010,GCMCILMGLQGKJF-UHFFFAOYSA-N
N5CCC1(CCC1)C(C=CC2=C[N](N=C2C3=CC=CC(=C3)C)C4=CC=C(C=C4)F)C5,8B8F0F6E5F3C07B6_60C895A087D4BF31_7019_DP,8.302285,00000000000100000000000000000000000000000010000000001000000000100110000000010000101100110001001010111000110100011000001011101100110001110110001011011011010010101111010,UKRCWNJOPVZYHD-UHFFFAOYSA-N
FC1=NC(=C(C=C1)NCC[C@@H]2CC[C@H]3C[C@@H]2C3(C)C)F,FE3CCBCF11D4FBA8_15D004F924238A0E_6041_UN,8.4923,00000000000100000000000000000000000000000010000000000000000000000110000000100001001000010001000000101000110110011000101001000000110001110100001011010111010110101111010,PKNNMVZWTFVDSL-SRVKXCTJSA-N
CC1=C(C3=C(N1CC2(Br)CCC2)C=CC=C3)C4=CCNCC4,D186C0EEA6C9D1E8_7CBDB0C27D021490_6034_UN,8.554198,00000000000100000000000000000000000000000000001000100000000000100110000000011000001101110001000010111100110110011000101011100100110000100110001011011011010110101111010,VNSHFUTXXFRKQV-UHFFFAOYSA-N
CC1=C(C3=C(N1CC2(F)CCC2)C=CC=C3)C4=CCNCC4,E560DA6EA34F66F5_297526337B192418_6034_UN,8.554192,00000000000100000000000000000000000000000010000000100000000000100110000000011000001101110001000010111100110110011000101011100100110000100110001011011011010110101111010,CGJHSYUBVOMCOA-UHFFFAOYSA-N
N2CCC(OC1=C(C=C(C(=C1)F)F)C#N)CC2C3=CC=CC=C3,918F3F34A7019027_352FC2F65D671D5D_6003_DP,7.7923565,00000000000000000000000000000000000000000110000000000000000000100000000000000000001000010001000001101000100100010100001001000111110010100100001111010011110011100111110,RHKBELAUUOAKKF-UHFFFAOYSA-N
N1CCCC2=C1N=C(C=C2)CCC5=C(C3=C(SC4=C3CCN(C)C4)N=C5)C6=CC=C(C=C6)C,0BDD3953277464F3_89FBE264CC6DA202_2201_DP,8.299974,00000000000000000000000000000000000010100000000100000000000000100100000000010100011101101011010010101100110000010001101011100100110000010110001011011111010110101111010,APXFBXUWDNQVOA-UHFFFAOYSA-N
CN4CCC1=C(N=C(S1)NCC2(CCCCC2)C3=CC=CS3)C4,61C077B1219469FB_59428C01D5EF5371_6041_UN,7.7085443,00000000000000000000000000000000000010000000000100000000000000100110000000010101011101101011010010101100011000011001101011100100110001010110001011011001010110101111010,ZOGWBSNRUKKIAY-UHFFFAOYSA-N
CC1=CC(=CC(=C1)F)NC(CCC2=CC=CC=C2)C35CC4CC(CC(C3)C4)C5,E65C47C61F19FF3B_7FE42FCB570FD235_6041_UN,7.522832,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010010000000000100110100011000001000000100110001110000000001010001000110101111010,KXNGIEKQRRASJJ-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NCC3(C2=C(C=C(C)C=C2)C)CC3)F)C4,23682D1E092750EF_BB9921BCCF0C25A0_6041_UN,7.745886,00000000000000000000001000000000000000000010000000000000000000100010000000010000001001110011000000101100010110011010101001100100110001110110011011011111010110101111010,SQAZOGJBUMVESW-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)N[C@H]4[C@H](C3=C[N](C)N=C3)OCCC4,9E7AAC318C1E6ED8_196B93E378456419_6041_UN,8.237923,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011011111100000100101010000001011101100100011110100001011011011110011101111110,SUNBCUAIGMXDHR-AEFFLSMTSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC3(CC3)C4COCCC4,F9FD03C690AA918B_E632473EC1CC29DA_6041_UN,7.627595,00000000000000000000001000000000000000100010000000000000010000100110000000000100000000110011000001100100110101011000001011000100110011110110001011010111010011101111110,HPFVRLWHXQJWEA-UHFFFAOYSA-N
CC1=C(C=CC=C1)C(NC(=O)C2CC3CC2C4CC34)CF,88B39C28FAFDE929_7F14CEF284BA9BC3_6038_UN,7.9004674,00000000000000000001001000000000000000000010000000000000000000000000000000000000000000000011100010000000110010110000010000000000110000100000000011000011011110101111110,NEZXOKGJNCBGMP-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)OC4CCC5C2CC(C3OC23)C45)F,72AC060B2D84A9C8_CE2FBFF625F388A3_7022_UN,8.421516,00000000000000001001001000000000000000000010000000000000010000000000000000100000000001110000010010101100010100000101001000100011110010100100000111011110110101111111110,YWQYTDYOWMBAMP-UHFFFAOYSA-N
FC2=C1OC=CC1=C(C=C2)NCCC3CCCN(C)C3,E6FB9E8A73486400_A342D15C20C99006_6041_UN,7.8727117,00000000000000000000000000000000000000000010000000000000010000000000000000010000001101110001010011101100110110010001101011100100110001110110001001011001110110101111110,JJVURUMQWFVPHP-UHFFFAOYSA-N
C1(=C(C=CC(=C1)F)OC2CCCCC2)NCC3(CN(C)C)CCOCC3,AED14DFBF758607A_149380CCB8FA298E_7022_UN,7.21349,00000000000000000000000000000000000000000010000000000000010000000010000000100000101001110011010100101000000111001101001000100011110011110110001111011111110111111111110,TYTKIMIZDIZETC-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CCC4=CC(=C(C=C4)Cl)Cl,9F4608522630EA4C_69BE95EFEC072FB7_6038_UN,7.313687,00000000000100000000000000000000000000000000000000000000000000000010000000000000001000010010100010001001110100111000011000000000110010100000000011010011011110100111110,JKFRIMYFNQFJAI-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CCC4=CC(=C(C=C4)Br)Cl,7D18A2F3C7FAABCE_13E708FA2FF466FF_6038_UN,7.313675,00000000000100000000000000000000000000000000001000000000000000000010000000000000001000010010100010001001110100111000011000000000110010100000000011010011011110100111110,YONBNLAGIXIUCE-UHFFFAOYSA-N
N(CCN1CC2C(C1)C3CCC2C=C3)C(C4=C(CC)C=CC(=C4)F)=O,F8F4AC1404DCCD96_C6F2467BC88CC0E6_6038_UN,8.300976,00000000000000000000000000000000000000000010000000000000000000000000000000010001001101110001100010011100110100110010011001100000110000100110001011011011011110101111110,XGKFEZMQQJQVBW-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CCC4=CC(=C(C=C4)Cl)F,F71FA6E3DBB3B20D_78E32E66796D64EC_6038_UN,7.3136706,00000000000100000000000000000000000000000010000000000000000000000010000000000000001000010010100010001001110100111000011000000000110010100000000011010011011110100111110,ZANQDRPRFXMKCQ-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C[N](C)C4=C3C=CC(=C4)Cl,81E588D7CD62CDE2_82EC2C8A7C726860_7019_UN,7.7996154,00000000000100000000000000000000000000000000000000000000000000000110000000010000000101010000010010010101010100001000001001100100110000100100000001011000000010101111010,NOZKGEWHILGJNX-UHFFFAOYSA-N
CC1=C(C=CC(=C1)NCC2C(CCCCC2)(F)F)OC3CCOC3,A8CDD8F3D74A4C54_06004882204A3625_7022_UN,7.8052654,00000000000000000001000000000000000000000010000000000000010000000000000010000000001100110111000010001000000101001100001000000011110011110110000110010011110111111111110,VPKHQZNZWKIVIT-UHFFFAOYSA-N
N(C1=CC=C(C=C1)N2CC3CCC(C2)O3)C(=O)[C@@H]4C[C@H]4C5=C(C=C(C=C5)F)F,640CD599DCDE0C7C_D932B031CF84CE73_6038_UN,7.304057,00000000000000000001001000000000000000000010000000000000010000100000000000010000000101110011100110101000010100100000011011100100110011110110001011011011111011110111110,AFYOBMAEUNGUEM-ZYKFHVCXSA-N
COC1(COC1)C2=CC=C(C=C2)N[C@H]3[C@@H](C3)C4=CC(=C(C=C4)F)F,06BB41B76D55B7BE_7DECD5E4F2B2A493_6041_UN,7.6572437,00000000100100000000001000000000000000000010000000000000010000100010000010000000000000110010010000000000100101011000100000000111000011110110000111000011110011111111110,LSMNSEDDTAPMOG-MAUKXSAKSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3(CCCNC3)C)C4,2A56B6885E9AE307_14F22CB0F3B72498_6041_DP,7.9148383,00000000000000000000000000000000000000000000000000000100000000000110000000010000101101100011010010101100110010011001101011100100110101010110001011011101010110101111010,KSNAHZVRQQVTQI-UHFFFAOYSA-N
CN(C1CCCNCC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=CC(=CC=C4)F,2B0CEFF74C0400B0_68AEA8B73717D509_6041_DP,7.8727813,00000000000000000001001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010000101011100100110101110110001001011011010010101111010,JVUWYLSIARGUCM-UQJFVLDMSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NCC2C3(CCNC2)CCC3,8F01717FA3E12317_4EB50821274ACC98_6041_DP,7.592226,00000000000100000000100000000010000000000000000000000100000000000010000000100000101000100011010000101000110000011001001001000000110101010110011011011111010110101111010,JLTICLYCJKZSCY-UHFFFAOYSA-N
FC1=C(N=CC=C1)[N]2C=C(C=N2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,2B8F7B0ACEA6BD00_CA043F0EA9DBC3C5_6041_UN,8.433468,00000000000000000000001000000000000000100010000000001000000000100100000000010101101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,BZKWITINJPLGLZ-QRWLVFNGSA-N
FC1=C(C=C(C=C1)C2=CN=C([N]2CCC3CNC(C3)(C)C)C4CCNCC4)F,02CE37A83F28C6D0_C9F373AEBAA67F3A_6034_DP,8.242703,00000000000000000000000000000000000000100010000000000000000000100110000000110101001101110011000010101000100110011001101011100100110100100110001011011111010110101111010,HKHHSMMCMZNUJG-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NC3=C(C=C(C(=C3)F)N4CCOCC4)F,75A92A5979FA4676_2478AD15FC4AD4F9_6041_UN,7.767151,00000000000000000000000000000000000000100010000000000000010000100100000000010100100101110001010110101000000111010001101011100100110011110110001011011011010011101111110,XODAZZJZDYDGLZ-SFHVURJKSA-N
FC1=CC5=C(C(=C1)C=CC3=CC(=C2OCOC2=C3)C4=C(C)[N](N=C4)C)OC(OC5)C6=CC=CC=C6,BCEE27F4739DD218_3CF6D99D64F03DA0_7019_UN,8.320239,00000000000000000000000000001000000000000010000000001000010000100100000010010000100100010100011010110100010101000100000011111100000000100110101011101110110011111111110,COPWIPHBSBDURT-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2OC3(CC2)CCCCCC3)F,DAA65DB2F644C812_2176160B535E19F4_7022_UN,7.1632543,00000000000000000001000000000000000000000010000000000000010000000010000000100000001101110011010110001000010100001001001000100000110011110110001010011111110111101111110,GHNHQIQCRLEGDL-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CC3CCN(CCC2=CC=CC=C2)C3)C(=CC(=C4)F)F)C5,8412594D05248ABA_2820A51F86CD9B0C_6034_UN,8.016897,00000000000000000000000000000000000000000010000000000000000000000110000000110000100101110000000010001100010100011001101011100100110000100110001011011100010110101111010,WUKVRXBIIVSXPZ-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C3=CC(=C[N]3C)C4=CSC(=N4)C)=O,B8C9B552C61C87BE_511F46CB23F50CE7_6038_UN,8.298457,00000000000000000000000000000000000010000000000100000000010000100100000000010001111101001001110110001000110000110000011011100100110010000100001010011111111111111111110,IETYLAASSDRUGT-UHFFFAOYSA-N
CCC1=CC2=C(C=C1)N=CC=C2NCC3(C(C)(C3)C)C4=C(C=C(C=C4)F)F,CC9277E11ACB2AE5_32379B11EA560338_6041_UN,8.186487,00000000000000000000001000000000000000000010000000000000000000100110000000100000101000010011000000101100010110001011100001000100010001110100011011000111010110101111010,WFLDQXUTJSKYKP-UHFFFAOYSA-N
CC1=C(C=CC(=C1)N2CCOCC2)N[C@@H]3CCN(CC)[C@H]3C4=CC(=C(C(=C4)F)F)F,067DE7186E22E0EC_D1E37CF4D7629082_6041_UN,8.131868,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011000110101000100111010010101011100100110011110110001011011111010111101111110,BVQRPBVSTGYFDC-GGAORHGYSA-N
C[N]1N=C(C=C1NC2C3=C(CCC2C)C(=CC=C3)F)C4CCCC4,990F37C1C272FB3C_0CD9983908619A2A_6041_UN,7.981759,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011011010000100010100000001101011101100010001110100001011011111000010101111010,WJEGJWLSLCLLDB-UHFFFAOYSA-N
C1(=CC=C(C=C1)CN2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,C51B3B283A31F181_789B3BB43FE4E81C_6041_UN,8.428764,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011010110101000100111010001101011100100110011110110001011011011010111101111110,RUAOQHFHAHLYMK-YADHBBJMSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2CC(C)CC3CCCCC3,84AEA29B84BD244D_A37EF87C754567FD_6034_UN,8.143773,00000000000000000000000000000000000000000000001000000000000000000100000000010000000101010000000010001100010110000001101001100100110000100100010011011110010110101111010,HQVPOSICNSLDFV-UHFFFAOYSA-N
C1(=CC=C(C=C1)CN2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)Cl)F,D8287A320579D771_EB90DA6136E15DF9_7022_UN,8.428738,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011010110101001100111010001101011100100110011110110001011011011010111101111110,FZQBFVKWKCTIGB-YADHBBJMSA-N
N(CC12CC(C1)CO2)C(=O)C3CCCN3CC4=CC=C(C=C4)F,F7148E2EEA937184_886A903ED8213C5D_6038_UN,8.031679,00000000000100000000000000000000000000000010000000000000010000000010000000010001001101110011100110001000010101111000011011100000110010100110001000011011111111110111110,WYMVZXAEYHLFIU-UHFFFAOYSA-N
NCC1(C(CCC1)OC2=CC=C(C=C2)CCC3CCNCC3)CC4=CC=C(C=C4)F,BDAB8370944CB506_940BA8291DD67BEE_6035_UN,7.9648995,00000000000000000000000000000000000000000010000000000000000000000010000000000000001010110011000011101000100100011100001001000111110110100110001101010011110101100111110,JZOTXCIUWHLEBG-UHFFFAOYSA-N
C(C12CC(C1)OC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,4D4BA90149987099_93272E26968E8550_7019_UN,7.279239,00000000000100000000000000000000000000000010000000000000010000000010000000000000000101010000010010010000010111011000101000100000110011110100000010011010110011101111110,ZKDZKVLWHJABMN-UHFFFAOYSA-N
N4C[C@@H]1COC[C@]1(C=CC2=C(C)[N](C(=C2)C)C3=C(C=CC=C3)F)C4,F70C7D27F491E411_CF9C2492D43DA26E_7019_DP,8.50934,00000000000000000000000000000000000000000010000000000000010000100110000000010000001101110011000011011100010101001000000011100100110001110110001010001111010011101111110,ACRNQDAGKZRAEW-XLIONFOSSA-N
N4C[C@@H]1COC[C@]1(C=CC2=CC(=C(C=C2)N3CCOCC3)F)C4,F22D4833B86C443C_D6577CEDEC7DC7AA_7019_DP,8.327611,00000000000000000000000000000000000000000010000000000000010000100010000000010000001101110011000111111100010101011000001011100000110011110110001011011011010011110111110,FQSCWZBLIJIJCC-QAPCUYQASA-N
CN5CC(C1=NN=C(C)N1CC2CCN(C2)C3=C(C=CC=C3)Cl)C4(CNC4)C5,0032C0F50EEECAA1_A00A65FCDB329DFA_6034_UN,7.586676,00000000100100000000000000000000000000100000000000001000000000100110000000010101101101110011011010001001010110011001101011101100110001110110001010011111010110101111010,PMFAAMQFVINYPT-UHFFFAOYSA-N
CN5CC(C1=NN=C(C)N1CC2CCN(C2)C3=C(C=CC=C3)F)C4(CNC4)C5,D552E4FD566C1780_F01F4D75C4075321_6034_UN,7.5866804,00000000100100000000000000000000000000100010000000001000000000100110000000010101101101110011011010001000010110011001101011101100110001110110001010011111010110101111010,SNKJLLCYOOOAEH-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4(CCCCC4)C5=C(C(=CC=C5)F)F,AAE621A425A23721_92D154B5FDFDC835_6041_DP,7.978945,00000000000000000001000001000000000000100010000000000000000000100110000000000100100101010011010010100000111100011000101011100100110101110100001011011011000010101111010,NPKFNDKZRWNEGI-BCDXTJNWSA-N
C(=CC1=CC(=CC(=C1)F)F)NC[C@@H]2CCO[C@H]2C3=CC=N[N]3C,F7563E3906813E6B_76A4F8E9FA0F245D_7022_UN,7.812798,00000000000000000000000000000000000000000010010000001000010000100100000000010000101100010011011111011000000101000000001011101100110010100110001010011011110111101111110,QZNGFIUTIWBPOW-SUMWQHHRSA-N
C(C1=CSC2=NCCN12)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,95E2D43E21DDEA93_12CAFACC359E9A8A_7019_UN,8.215928,00000000000000000000000000000000000010000010010100000000000000000000000000001111010101011000010010011100011110010000101111100000010001110110001010011010010010101111010,UIGMGLAPQXCROC-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC3CC2(CCNCC2)OC4=C3C=CC=C4,CE140B1D76195ABC_431A1C57CCED39D5_6041_DP,7.715168,00000000000000000000100000000010000000000000000000000000010000000110000000100001001000100001010001101100110000011100001011000100110111010110011011011111110011101111110,OFCOZCASOQDKMJ-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(C3=C(C=C(CC)C=C3)F)=O,0F590486B339A871_225073BC62E6D4C8_6038_UN,7.95391,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010010100000001100010100100010011000000000110000100000000011010011011110101111110,QLPINRCWHQHWNC-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2CC=CCC)C3CCNCC3)F,6829418D4BDE6262_78DF64A7090FF1E2_6034_UN,8.580156,00000000000000000000000000000000000000100010000000000000000000100100000000010101001101110001000010111000100110010010001011100100110000100110001011011011010110101111010,FXHDZQGYLXOYDH-UHFFFAOYSA-N
CC(=O)C1=C(C=C(C(=C1)NCC2CCNC23CCC3)F)F,140A88CA6AA07127_EDF95CB380202606_6041_DP,8.648244,00000000000100000000000000000000000000000010000000000100000000000010000000000000101100010011000010001000110100011000001001000000110101110110001010010011111110101111110,HNUVRRQMAFOVGC-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)[S](C4=CC3=C(C=C(Cl)C=C3)C=C4)(=O)=O,3BD542C1A267BC2A_4DE0E7AF6870B644_6029_UN,8.098305,00000000000000000000000000000000110000000000000000010001001111001001010001000000011000011001001010001111111100011000011000001100111000101000000001011001010110110111110,WLKNGSRTYNEMQO-UHFFFAOYSA-N
CC1=C(N=C(N1C[C@@H]2C[C@H]2C3=CC=C(C=C3)F)C4CCCN4)C5=CC=CC=C5,B64B6878D415D382_37D39F69226DA511_6034_UN,8.519464,00000000000000000000001000000000000000100010000000000000000000100100000000010101001101010011000010001000100100010000101011100100110000100110001011011011010110101111010,KMZPKUTYHLXQGY-QUCQDJGISA-N
O(CCC1CCC2(CC1)OCCO2)CCC3CCN(C)CC3,3B8B9E65DEB3F4F9_30B25EE30704113E_6039_UN,7.549617,00000000000000000000000000000000000000000000000000000000010000000000000010010000000101100000010010101000010001011001101011110010110010000110000001111000110101111101110,ITWITADGSLVIJO-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NCC2N(C)CC3(CC2)CCC3)OC4CC4,646A79EBE1D7EC63_AAA5CD01C3501671_6041_UN,7.662283,00000000000100000000001000000000000000000010000000000000000000000010000000010001001001110011010100101000010110011101101001100011110011110110001111011011110111101111110,LBHRWVJKQGKBDT-UHFFFAOYSA-N
NCC(COC2=C1CNCCC1=C(C=C2)F)CC3CCC3,179942F4E1952D8C_D6DC60B2B0A943DC_6035_UN,8.030326,00000000000100000000000000000000000000000010000000000000000000000000000000000000001010110011000001101100110101010100001001000011110100100110001111010001110101100111110,NVAPKMLSWCAEJF-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NC2=CC=C(C=C2)CC3=NN=C4CCC[N]34,B6C8542BAA0D53A7_78F27165B61C5CEC_6041_UN,8.35101,00000000000000000000100000000010000010100000000000001000000000000100000000100101110101101000011010001100010000011000001011101100110001010100011010011111010110101111010,VXVOHRLXJGSYFD-UHFFFAOYSA-N
CC1=C(C=CC(=C1)N2CCOCC2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,F20AB049525B02CC_F2CF96BE3B406514_6041_DP,7.5758314,00000000000000000000000000000000000000000010000000000100010000100000000000010000101001110011000100101000100111010000001011100100110111110110001011011011010111101111110,WTCPMKVFZZOETC-SIKLNZKXSA-N
FC1=CC2=C(C(=C1)F)C=CC(=N2)NC[C@@H]3CCN(C)[C@H]3C4=CN=CC=C4,86E405BE0605EE6B_F83523F29F35D169_6041_UN,8.934182,00000000000000000000000000000000000000100010000000000000000000100100000000010100101101110011010010101100010110010001101011100100110001110110001001011011010110101111010,HSILLWPBXJLIPR-XOBRGWDASA-N
C1(=C[N](N=C1)CC2CCOC2)NCC(N(C)C)C3=C(C=CC=C3F)F,4727FD6B2F004374_ED821C797EB9E46E_6041_UN,8.263225,00000000000000000000000000000000000000000010000000001000010000000100000000110001101101110001011011001000000101010000101011101100110011110110001010011111010111101111110,XKTUBTPENKMPLJ-UHFFFAOYSA-N
C[N]1C=CN=C1C(NC(=O)C2CC3CCC2O3)C4=C(C=C(C=C4)F)F,02AB42A2DBB2872A_E9D881CE88913D68_6038_UN,7.8738937,00000000000000000000000000000000000000100010000000000000010000000100000000010101000101010111110011000000010100100000011011100100110010100100001011011011101011111111110,UGPGSCSIJJEEJD-UHFFFAOYSA-N
C(NC1CC1)C3=CC2=C(C=CC=C2)N3CC4CC4(C)C5=NC=C(C=C5)F,AECB06B10E85FC1B_816CAE8E6CD00106_6034_UN,8.3131695,00000000000000000000001000000000000000000010000000000000000000100110000000010001001101010011000010101100110110011001100011100100110001100110001011011011010110101111010,GWWXDTDOHJDXIE-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC(CC)C4CN(CC3=CC=CC=C3)CCO4)F,6AFC20C38910674C_808F789D3E78638A_6041_DP,8.047982,00000000000000000000000000000000000000000010000000000000010000000000000000010000101001110011000100101100110111010010001011100100110111110110001011011011110111101111110,GSWMIWHJINBPDA-UHFFFAOYSA-N
FC2=C1C(=C[NH]C1=CC=C2)NCC3CCCN(C)C3C4=CC=CS4,A77214EA5F26FB3F_3A854833386524BE_6041_UN,8.187748,00000000000000000000000000000000000010000010000000000110000000100100000000010001111101111011010010101100010110010001101011100100110101110110001001011011010110101111010,DRPMFAFMCYJJAN-UHFFFAOYSA-N
CN(C1CCNC1)C2=NC(=CN=C2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,645E1B30D60CBA39_D7E0C4C1A56AC13E_6041_DP,8.808265,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100010101110110001011011111010010101111010,WYMDBAQFOBUMCT-SBCCGAISSA-N
C(C1CCCCC12CCC2)=CC3=C[N](N=C3C)C4=CC=C(C=C4)F,705FDBC06D3271C3_F975C0085869D4C8_7019_UN,7.882973,00000000000100000000000000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011010000010101111010,RZZRLHYLSRCQFQ-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C[N](N=C3C)C4=CC=C(C=C4)Cl,94ED65F7A8CF3BA2_DB8A7996956F30C8_7019_UN,7.8829565,00000000000100000000000000000000000000000000000000001000000000100110000000010000100100010000001010010001010100001000001011101100110001110100001011011010000010101111010,FSPLUUHFQIXGHV-UHFFFAOYSA-N
CCOC(CC1=CC(=CC=C1)NCC2(CCC2)C3=C(C=NC=C3)F)OCC,992D19159F5D1C36_49875DBAEF9B72F3_6041_UN,7.9181986,00000000000100000000000000000000000000000010000000000000000000100110000000000000001000010011000000101000000111001010001001010110110011110110001011010111010111111111110,GKOMTQZSQZOAHS-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)C#N)F)NCC3OC2(CCC(C)(CC2)C)CC3,0B43CD211FF8B8A8_3461D44175736668_6041_UN,7.9420204,00000000000000000000000000000000000000000110000000000000010000000010000000100000001100010011000110001000010100001001101000000000110011110100001011010111110111101111110,FAUCSKPLVQSCFF-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4CCCC(C4)C5=CC(=C(C=C5)F)F,02D99F9C3CDA7B48_3C0A8D5AD8B9184B_6041_DP,8.102971,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000110110010000001011100100110101110110001011011011010010101111010,NJVPSGUGAYSRGI-OYCSEFRBSA-N
CC1=NC(=C(C(=C1)C)F)N[C@H]2[C@H](C(C)C)CC[C@H](C2)C,A5C99ED3644C5A25_D6344ECE65DF6EFC_6041_UN,8.898601,00000000000000000000000000000000000000100010000000000000000000000100000000100100000000010011000000100000100110010001101001000000110001110100011011010111000010101111010,DFOJBHUSQCGOHX-BYCMXARLSA-N
N(CCC1=CN=CS1)C(C34CC2(CC(CC(C)(C2)C3)C4)F)=O,89C59D1914BF4113_0758814A71F8A264_6038_UN,8.105729,00000000000000000000000000000000000010000010000100000000000000000110000000000000011100011010100010001100110110111001011011000000100000100100001001010001011110101111110,BYNHDJDQSHNRTL-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC3CC2(CCCC2)CN3)C=CC(=C4)Cl)C5,988F2105DD669AB8_739BCE32A041187F_6034_UN,6.79504,00000000000000000000000000000000000000000000000000000000000000000110000000010001101101110011010010101101110100011001101011100100110000100110001011011001010110101111010,KNBFJHPHGALKHR-UHFFFAOYSA-N
FC2=C1C=CC=NC1=CC=C2NCC3CCCN(C)C3C4=CC=CS4,530AFB45F6CC62F0_326433B657D842A8_6041_UN,8.403578,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,QBSPKGBWZAAGAO-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3C4CCC(CC3)CO4,3F585EFC1A3107E9_0FA6EC1257DA050E_6041_UN,8.242322,00000000000000000001000001000000000000000010000000000000010000000100000000010101000101010011010110100100111101010000001011100100110011110100001011011011110011101111110,DHRRHIPVBXLPLQ-UHFFFAOYSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CCC[C@H]3NCCC3)Cl,A820AEE4078C5AF1_03798925723CAB97_6034_UN,7.704406,00000000000000000000000000000000000010000000000100000000000000000100000000010110011101011011000010001001101110010000001111100100110101110110001010011011010110101111010,DSSLDBBJZPIDCE-HNNXBMFYSA-N
C[N]1C=NN=C1C2=C(C=CC=C2)NC3C4CC5CC3CC(C4)(F)C5,6339C7FF9DABAE4B_91F93CA170B14750_6041_UN,7.563059,00000000000000000000000000000000000000100010000000001000000000100110000000010101100101010010011010000100010100001000000011101100100001110100001011001011000010101111010,WFRWSSNQRUCAQH-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC(CC)C3=C(C=C(C=C3)F)F,DBFA6BD4464F0A84_6D980EA3AB9971F8_6041_UN,7.987338,00000000000000000000000000000000000000100010000000000000000000100100000000010100100101110000010010101000100110010011101011100100010001110100001011011111010110101111010,MPZDIABUTSCQPZ-ZVAWYAOSSA-N
C1CC(=CCN1)C2=CN(C3=C2C=CC=N3)CCCC#C[Si](C)(C)C,FFAC19449A596C23_0A94D59BCDF36D1E_6034_UN,7.4478292,00000000000000000100100000000010000000100000000000100000000000100100000000111100001101100001010010111100110010011000001011100100110000000110011001011101010110101111010,RDLXBERECXZSPL-UHFFFAOYSA-N
C[N]1C=CC2=C1C=C(C=C2)[S](=O)(=O)N3C4CCC3CC(CCF)C4,FE40C8E6DABA97B0_BB319C577F66EE91_6026_UN,8.153951,00000000000000000001000000000000110000000010000000010001001111001101000001010000010101001000011010100110011000011000011011101100111000101100001001011000010110111111110,FLSISYNVKRXSRY-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CC2(CC2)C3CC3)C=CC(=C4)Br)C5,1AC72AF590F80A06_6D4D911DBA4EF6D0_6034_UN,7.6390514,00000000000000000000001000000000000000000000001000000000000000100110000000110000000101010000000010001100010100011001101001100100110000100100000011011100010110101111010,GLYAXWSPXQIJBN-UHFFFAOYSA-N
C1NCCC(C1)C2=C3C(=CC=C2)N(C=C3)CC4(C)COC(=O)C4,4BDE827DC26DC0DE_D2BEADF2FFE27A33_6034_UN,8.25557,00000000000000000000000000000000000000000000000000000000010000100110000000010000001101100001000011101100110001011001001011110101110010000110001101011001011111111111110,BPRAKOBONANRLZ-UHFFFAOYSA-N
CN4CCC1=C(C3=C(N1CC(C)CC2CCOCC2)C=CC(=C3)Cl)C4,A6FC974AFAF21997_ACA50B6D0F5EDACB_6034_UN,7.403848,00000000000000000000000000000000000000000000000000000000010000000100000000010000100101110000010010101101010111010001101011100100110010100110001011011100010111101111110,UWWQKMWGDMKFTR-UHFFFAOYSA-N
C(C1CCNCC1)C2=CN(C=N2)CC4=CC(=C(N3CCN(C)CC3)C=C4)F,C1B0320C34D7C21E_C1C483544B918EA8_6034_UN,8.242325,00000000000000000000000000000000000000000010000000000000000000100100000000010101001101110001010010101000100100010001101011100100110001110110001011011011010110101111010,WQCDFVORKQCKJH-UHFFFAOYSA-N
CC(C)C1=C(C=C(C=C1)NC[C@@H]2CCN(C)[C@H]2C3=CN=CC=C3)F,EFD8566FCA359F6C_41D2AD75900829B2_6041_UN,8.372866,00000000000000000000000000000000000000000010000000000000000000100100000000110000101101110011010010101000000110010001101011100100110001110110011011011111010110101111010,MWZHWPWGSFNUBE-JXFKEZNVSA-N
C1(=CC2=C(C=C1)COC2=O)NC4=CC3=C(CCCN3C)C=C4,B554E7A15033508D_0145EFEB6A2238C3_6041_UN,8.9283495,00000000000000000000000000000000000000000000000000000000010000000000000000010000100101100000010010101100010011010001101011110101100001010110001111011001011011111111110,KFRHJMSIRXVJCJ-UHFFFAOYSA-N
FC2=C1N=C(N(C1=CC=C2)C[C@H]3[C@@H](CNC3)C4=CC(=CC=C4)F)C5CCNCC5,0512A12E310552A5_B3C9CAC616BD24F2_6034_UN,8.988214,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101100110100010000001011100100110100100110001011011011010110100111010,OXBBONADYAAJES-HKUYNNGSSA-N
NCC(COC2=CC1=C(CCN(C)C1)C=C2F)CC3CCOCC3,D8FB4D260F2F72F4_4147567422331DB2_6035_UN,7.549093,00000000000000000000000000000000000000000010000000000000010000000000000000010000001011110010010001101100010101010101101011100011110010100110001111011011110101111111110,LINCCOUEAJIPSE-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C(F)F)Cl)N[C@H]3[C@H](C2=C(C)[N](N=C2)C)OCC3,F02C1218CD7923F4_A66B4858858629F9_7022_UN,9.212168,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111000001100101010000001011101100000011110100001010011111110011101111110,ODMWVGWMWBBLHC-HIFRSBDPSA-N
C[N]1C=NC2=C1C=CC(=C2)NC35CC(OC34CCNCC4)(C)C5,B46A4713F256C885_F3E5FBBDC3859FF6_6041_DP,7.1988463,00000000000100000000000000000000000000000000000000000000010000000110000000010101101101100011010111101100110010011001001011100100110111010110001001011101110011101111110,NUWCJNRRUFBGAD-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CCC3)C4=C(C=CC=C4F)F,EA3CBE1D0FC0D528_F07FBFD6D95574F1_6041_UN,8.294237,00000000000100000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100000001110100001010011011000010101111010,FBMCLDJPNIMJKO-UHFFFAOYSA-N
CC1=C(C4=C(N1CC2(CCCO2)C3CC3)C=C(Br)C=C4)C,8513F6B9738326F9_21B382844D4243E5_6034_UN,8.59736,00000000000000000000001000000000000000000000001000000000010000100110000000010000000101010000000110001100010111001000101011100100110010100110000010011110110111101111110,BTJKUJQEUXNTBF-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCCOC3CCOC3,6CB2335C0F496BA9_AEC7173A59BB211E_6041_UN,7.884351,00000000000000000000000000000000000000100000000000000000010000000100000010000100001100100100000110101100110011010000001011000111110011010110011111010111110111111111110,YSLNLAICRKFNCF-UHFFFAOYSA-N
CC1=C(N=C(S1)NCC2CNCC(O2)(C)C)C3=CC=C(C=C3)F,2D32276B6C797FB8_DE071DD364FDF9E1_6041_DP,7.859875,00000000000000000000000000000000000010000010000100000100010000100110000000100100111100111010000110101000001110001001000011000100100111110110011011000111110111101111110,DDNILZGGAIYESE-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC4(CC3(CNC3)C4)C5=CC=CC=C5,91D870A6730D2768_6DB9EDBA2114F44A_6041_DP,7.7726297,00000000100100000000000000000000000000000010000000001000000000100110000000010000101100110010011010001100010100001000000011101100100101110110001001001001010110101111010,WQVJFTYDDBCAIJ-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[C@@H]3CNCC(O3)(C)C,B92DA54F8074D391_059E9FD0C51E3B77_6041_DP,8.047464,00000000000000000000000000000000000000000010000000000100010000000110000000100001101000110010000100101100010110001001000011000100100111110110011011000111110111101111110,XLXQHYZQVYKHEJ-ZDUSSCGKSA-N
CN(C)C3CCN(CC1=CC=C(C=C1)NCC2(COCCNC2)F)C3,A5787C6601DF03E2_995B8591FFB4DCB8_6041_DP,7.7326612,00000000000000000001000000000000000000000010000000000100010000000010000000110001101101110011010111001000100111011000101011100000110111110110001000011101010111101111110,HQUURNKEBVBLCJ-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C[N]2C=C(C=N2)NC3CCN(C)C34CCCNC4)F,CC609BE1BBAC0411_0FA847248E1AB2FD_6041_DP,8.45273,00000000000000000000000000000000000000000010000000001100000000000110000000010001101101110011011010101000110110011001101011101100110101110110001011011011010110101111010,HWQKXZBUEAXNKD-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC34CC(CNC3)(F)C4,39A7A84F8CEAA62D_B996AD4893A8EE45_6041_DP,7.557214,00000000000100000000000000000000000000100010000000000100000000100110000000010100101101110011010010101000010110011001101011100000110101110110001011011011010110101111010,WFLPJQAKDYKDCH-OOHWJJMZSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC4(CCCCC4)C5=C(C=C(C=C5)F)F,E8AA8EDA9BE97653_75E3926ECCED7B26_6041_DP,7.979583,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011000001011100100110101110110001011011011010010101111010,VAHBCBYIIQSPQC-GWTOYCKXSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC4=CC(=C(C=C4)F)C5CC5,B9338B536A09D718_7DE4D0BCD19FF927_6041_DP,8.409775,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110001010010101000010110000000000011100100110101110110001011011011010010101111010,GHHFERQLZWYOSG-RTHVDDQRSA-N
N(C1=CC2=C(C=C1)CCOC2)[S](C3=C[NH]C4=C3C=C(C)C=C4)(=O)=O,04BD2436BC330DC2_7DCECE3F05E0F923_6029_UN,8.726564,00000000000000000000000000000000110000000000000000010101011111001101010001000000110100101001001011100110011001001000011011001100111111011110001011111001010011111111110,QPUWTMJEIVDWCT-UHFFFAOYSA-N
CC(C)C1=C(C=C(C=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)F,0FE7DBE1660B307E_20959D10AFA02534_6041_UN,8.000687,00000000000000000000001000000000000000000010000000001000000000100100000000110001101101010011011010101000000100010000001011101100110001110110011011011111010110101111010,LVGQSOJCPKKFKB-ZHRRBRCNSA-N
O(C(C1CCNCC1)C2=CC=C(C=C2)Cl)C3=C(C(=CC=C3)C#N)Br,8C44386A0DFFEEFB_D75F022BDF599B60_6035_UN,8.210337,00000000000000000000000000000000000000000100001000000000000000000000000000000000001000110001000000101001100100010100001001000111110000100110001111010011110001100111110,ORJQRBQVDOQGMJ-UHFFFAOYSA-N
O(C(C1CCNCC1)C2=CC=C(C=C2)F)C3=C(C(=CC=C3)C#N)Br,7430DDB6E612DE80_540970718F93559E_6035_UN,8.2103405,00000000000000000000000000000000000000000110001000000000000000000000000000000000001000110001000000101000100100010100001001000111110000100110001111010011110001100111110,MTYCPUQQDSHRRC-UHFFFAOYSA-N
N(CC12CCC(CC1)O2)C(=O)C3CCCCN3CC4=CC(=CC=C4)F,F9965888D268EDD6_C5E9FA86DE84B7CA_6038_UN,7.8772554,00000000000000000000000000000000000000000010000000000000010000000010000000010001001101110011100110101000010100111000011011100000110010100110001001011011111111110111110,HHASUCMMSSKYBF-UHFFFAOYSA-N
C1(=CC(=CC=C1)F)N[C@@]34[C@@H]2OC(C)(O[C@@H]2[C@@H](CC3)C4)C,4AC191CB13884F0F_FF01E79E6BEDDA8A_7022_UN,7.744415,00000000000000000000000000000000000000000010000000000000010000000010000010100000000100010011000111000100110100011000001010010000010001110100000001010101100011111111110,DZRCFQCOKAURNK-YDEYXMKJSA-N
C1(=CC2=C(C=C1)CC3CCC(C2)C3=O)N[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)F)F,76AA19454A6C338B_7988C0EDF39B36AB_6041_UN,7.481576,00000000000000000001000000000000000000000010000000000000010000100000000000000000000100010011000111000100110101010000001000000101110011110100000111010011111011110111110,XOVHWQYEUTTZAO-KBEHYWLWSA-N
CN7CCC1=C(C(=NC=N1)NC2C5C3CC6C4CC(C2C34)C56)C7,7CF8A676C1D58FC1_F3E50381D0CFD578_6041_UN,8.3519745,00000000000000000001000000000000000000100000000000000000000000000100000000010100100001100011010010101100010000010001101011100000110001010110001011011001010010101111010,CREJGGVWZDHZKD-UHFFFAOYSA-N
BrC2=C1N(C3=C(C1=CC=C2)CCC3)C[C@]45[C@](C)(C4)CNC5,47E96F7AA9C83D54_1035FCE58044686E_6034_UN,8.316997,00000000000000000000001000000000000000000000001000000000000000000110000000010000101101110011000010101100010110011001101011100100110000100110001011011011010110101111010,CTULMVMRSZQCBU-MSOLQXFVSA-N
CN1[C@H]4CC[C@@H]1C[C@H](OC2=CC(=C(C=C2)N3CCCCC3)Cl)C4,60236BC332D6D3C1_5E7012AB7708F262_6035_UN,7.684913,00000000000000000001000000000000000000000000000000000000000000100000000000010000000101110000010011101001010110010100101011100011110011110110001111011010110011101111110,XLJVYHZVWMBMEO-QLPKVWCKSA-N
CCC4CCC1=C(C3=C([N]1CC2CNCC(C2)(C)C)C=CC(=C3)C)C4,F3C67F4AECACED8A_895FB4267198E64D_6034_DP,8.18408,00000000000000000000000000000000000000000000000000000000000000000110000000110000101101100010000010101100010010011011101011100100110000000110011011011101010110101111010,FHJANPYAXKGMTQ-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Cl)NCC4(C)CC3CC3C4,B646CD0DA4CE5F27_EA218ADAD198D8D9_7022_UN,8.225857,00000000000000000000001000000000000000000000000000000000000000000010000000000000001000010010000010001101010110001001000000000100110001110000000011000011010110101111010,MAPSTEMQTAHEDE-UHFFFAOYSA-N
C2(=C(C=C1C=CC=CC1=C2)Br)NCC4(C)CC3CC3C4,6FF62B4A76193BA0_BAC1C2EC3A13BCAF_7022_UN,8.225854,00000000000000000000001000000000000000000000001000000000000000000010000000000000001000010010000010001100010110001001000000000100110001110000000011000011010110101111010,DQAXVOIFOAZWRL-UHFFFAOYSA-N
N1C4CCC1CC(CC=CC2=C[N](C)N=C2C3=CC(=CC=C3)F)C4,0DC6556619C33AF4_353D7001A8F465BC_7019_DP,7.452177,00000000000000000001000000000000000000000010000000001000000000100100000000010000100100010011011010110000110100010000001011101100110000100100001011011011000110101111010,URDWFPLQKPGHJI-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(C4=C(C=CC(=C4)C5=C[N](C)N=C5)F)=O,DF51ABC90335F3F5_1D4DC83D5B638FC1_6038_UN,8.213429,00000000000000000001001000000000000000000010000000001000000000100100000000010000101100010011111010001000010100100000010011101100110000100100001011001011011110101111110,PVAMSWKLXTYNPY-UHFFFAOYSA-N
FC2=C1C=C[NH]C1=CC=C2NC4C[C@H]3CCC[C@H](N3C)C4,C8F9CBD7696A52F2_9DEC17716BCABF07_6041_UN,7.6424775,00000000000000000000000000000000000000000010000000000000000000000100000000010000100101010001010010100100110110010000101011100100110101110100001011011011000010101111010,CMYIMTPZENJIRB-YHWZYXNKSA-N
N3CCCC(CC=CC1=C(C)[N](C(=C1)C)C2=C(C(=CC=C2)Cl)Cl)C3,4E455AB5C8C8FA85_95CCDFCD209D642A_7019_DP,8.786476,00000000000000000000000000000000000000000000000000000000000000100100000000010000001101110011000010111001100100010000001011100100110001110110001011011111010110101111010,YPMFJTOAQXRRTI-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)N[C@@H]3C5=C(OC4(C3)CCCC4)C=CC(=C5)F,495874E1B8BAEBA2_F326FD6867E9267B_6041_UN,7.982894,00000000000000000000000000000000000000100010000000001000010000100110000000010101100100010001011011100100110100011100001011101100110011110100001011011111100011101111110,YPZVFBKRRPYMIC-FQEVSTJZSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCCN2C)F)CC3,46E8DF0139CE0C8A_11C2031830AE6B7F_6041_UN,7.3367863,00000000000000000001000000000000000000000010000000000000000000000000000000010001101101110011010010001000000110010001101011100000110001110110001010011111010110101111010,GNISXJZRGRBNDG-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=C([NH]2)NCC3CCN(C(CC)C)C3,FF309BF929027CCC_321B12974AB6C366_6041_UN,8.424496,00000000000000000000000000000000000000100011000000000000000000000100000000010100101101110011000010001100010110010011101011100100110101110110001000011101010110101111010,IEDGMUBCBXLFNQ-UHFFFAOYSA-N
ClCC1=CC2=C(C=C1)N(C=N2)CC(C)(N3CCNCC3)C4=CC=C(C=C4)Br,71A748A25EC6DF13_72250B8826E1B01A_6034_UN,7.659293,00000000000000000000000000000000000000000000001000000000000000000110000000010101001101110001000010101101110110011001101011100100110000100110001001011001010110101111010,CXGKROMXQMQWKK-UHFFFAOYSA-N
BrCC1=CC2=C(C=C1)N(C=N2)CC(C)(N3CCNCC3)C4=CC=C(C=C4)Br,C2B24C87AE1814FF_984B3691C29CD289_6034_UN,7.6592946,00000000000000000000000000000000000000000000001000000000000000000110000000010101001101110001000010101100110110011001101011100100110000100110001001011001010110101111010,NODCGEMMMILIHO-UHFFFAOYSA-N
CN(C)CC1CCCCC1OCCN2C(C)COCC2,4FA002C6ABEFC20F_3C2E531B140F0765_6039_UN,7.399913,00000000000000000000000000000000000000000000000000000000010000000000000000110000000001100000010101101000000011010001101011100011110010000110011101011110110111111101110,HNDUXLKJABBEFM-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CC[C@@H]2C[C@H]2C3CC3)C=CC(=C4)Br)C5,1D936AF18371A9D3_C4B6AD283F2F3D08_6034_UN,7.2351804,00000000000000000000001000000000000000000000001000000000000000100110000000110000000101010000000010001100010100011001101001100100110000100100000011011110010110101111010,ZDOLGSVANJZLIV-WBVHZDCISA-N
CC1=CC(=C(S1)[Si](C)(C)C)NC2=C(C=CC=C2)C3=NC=C4CCCC[N]34,383A85B05FD0E1B6_A880A404220742B7_6041_UN,8.109093,00000000000000000000100000000010000010100000000000000000000000100100000000100101110101101000010010101100010000011000001011100100110001010100011011011111010010101111010,ICKOBEHQHMQGAF-UHFFFAOYSA-N
C2(=CC1=C(C=CC=C1F)S2)NCC(N3CCCC(CC)C3)(C)C,2CE0A9F222DCE7F7_D241E1DA5F0BC686_7022_UN,7.849434,00000000000000000000000000000000000010000010000100000000000000000010000000110001011101111001000010101100010110011011101011100100110001110110011001011101010110101111010,HUQSZFUIWCCRSO-UHFFFAOYSA-N
CN(CC1CNC1)CC2=NC=C(N=C2)NC3C4=C(SCC3)C=CC(=C4)F,316B18D693751776_F4BB815EEAC026A2_6041_DP,7.983508,00000000100100000000000000000000000010100010000000000000000100000100000000000101111001111010010000101100110110010001001011100100100101110110001011011001010110101111010,XIUXJRNYYCIGOH-UHFFFAOYSA-N
CN(C)C3CCN(CC1=CC=C(C=C1)NCC2(CNC2)F)C3,C90BA5AEC1B3F979_3C7954A8AD7F4761_6041_DP,7.71449,00000000100100000000000000000000000000000010000000000100000000000010000000110001101101110010010010001000000110011000101011100000110101110110001000011101010110101111010,BILNZFMJFSZBSK-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3(CCCCC3)CC4=C(C=C(C=C4)F)F,1BEBFF4376A6045C_BDD3D868F6801D03_6041_UN,7.7734785,00000000000000000000000000000000000000100010000000000000000000100110000000010100100101110011010010101000100110011001101011100100110001110100001011011011010110101111010,MDVBGBQQWACYBA-NRFANRHFSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC[C@@H]2OCCN(C)[C@H]2C3=C[N](N=C3)C)F)CC4,8EC46EA333498FB8_B24826AC892E9D54_6041_UN,8.014599,00000000000000000001000000000000000000000010000000001000010000100100000000010001101101110001011110101000000111010001101011101100110011110110011011011111110111101111110,FITRBYMQGZEQBV-GOTSBHOMSA-N
CC(C=CC1=C[N](C)N=C1C2=C(C=C(C=C2)F)F)C3CCCCC3,4702FBDF37359FAE_49C019BCDBA47403_7019_UN,8.133494,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010000000110000000101011101100110000100100001011011110000010101111010,WORVRFCGDITYNN-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)N[C@@H]2[C@H](C)OCC2)F)CC3,14F4E83DB02D4DF4_DEB7494000FD0D06_6041_UN,7.317053,00000000000000000001000000000000000000000010000000000000010000000000000000010001100101110011010111001000100111010001101011100000110011110110001010011111110111101111110,DHPZAMQHRGPPKW-KSSFIOAISA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NCC3C(CCCC3)C4CC4,C763C2EA325A5A7A_E6C7DAC775EAB546_6041_UN,8.016484,00000000000000000000001000000000000000000010000000000000000000100100000000100000101000010011000000101100010100000000001001000100110001110100011011010111010110101111010,NWBOOJZOLJOMPG-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC34CCNC3CCCC4,BD9DCD368667478B_06409B84FA2993B8_6041_DP,7.6982174,00000000000000000000000000000000000000100010000000000100000000000110000000000100101100010011000010101100110110011000001011000100110101110110001011010111010110101111010,JCEWYQXLOJYDGP-UHFFFAOYSA-N
C1(=NC=NC(=C1)C2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,4BBF19A4301EBA93_823C305A51F6D5E3_6041_UN,8.608869,00000000000000000000001000000000000000100010000000000000000000100100000000010101100101110011010010101000100110010001101011100100000001110100001011011011010010101111010,DVNUQQZKYGLJIC-QAPCUYQASA-N
N(C1=CC(=CC=C1)C2=CC(=C(C=C2)F)F)C(C3CC4CNCC3C4)=O,B27FD8C5999DF551_10A92881BFFEB1AC_6038_DP,7.5419855,00000000000000000001000000000000000000000010000000000000000000100000000000000000001000110011100010101000010100100000010001000100110101110110001011000011011010100111110,HYALEYVUOSILSE-UHFFFAOYSA-N
N(C1=CC(=CC=C1)C2=CC(=C(C=C2)Cl)Cl)C(C3CC4CNCC3C4)=O,4D2B5D1912C586B2_6E1271999DC4D2D3_6038_DP,7.5419793,00000000000000000001000000000000000000000000000000000000000000100000000000000000001000110011100010101001010100100000010001000100110101110110001011000011011010100111110,XSQAIFOTVIXZCH-UHFFFAOYSA-N
ClC1=C(C=C(C=C1)CCC=CCC2(C)CCOCC2)Cl,191334F716F4F908_E5E5A2881336B100_7019_UN,7.8933425,00000000000000000000000000000000000000000000000000000000010000000010000000000000000000110000000000110001000101001001101000000000110010100110000011010010010101001011110,RVZOQHJUOZZECK-UHFFFAOYSA-N
C1(=C[N](N=C1)CC2CCOC2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,0115D2D1BB79349F_7E8411E27253A461_6041_UN,7.9164157,00000000000000000000000000000000000000000010000000001000010000000100000000010001100101110001011011101000000101010001101011101100110011110110001011011011010111101111110,HEXTUGYMHXMSGN-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3CC4(CC3)CCCCC4,5620435F330EC17A_EC50FCEE53F550D0_6041_UN,7.682025,00000000000000000000000001000000000000000010000000000000000000000110000000010101000101010011010010000100111100011000001011100100110001110100001011011011000010101111010,TXNSGIVRJDEQJU-UHFFFAOYSA-N
N4CC[C@@H]([C@H](CNC(=O)C23CC1CC(F)(CC(F)(C1)C2)C3)C4)C5=CC=C(C=C5)F,8E2FBA718C042166_4E09F8FC4B89D879_6038_DP,7.108512,00000000000000000000000000000000000000000010000000000100000000100010000000000000101000110011100000101100110100111000011001000000110100100110001001010011011110100111110,MIGVFXJONXWWLS-MJMBJWEISA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC4C5=C(CC4)C=C(C(=C5)F)F,F7A930DC0172EEF9_EB48E7613EDABBCF_6041_DP,8.533025,00000000000000000001000000000000000000100010000000000000000000000100000000000101100101010011010010100100110100010000101011100100110101110100001011011011000010101111010,QXPNYPOJPLYNQH-MYUHZXPASA-N
C[N]1C(=CN=C1C2CCCCN2)NCC3(C)CCC4(CC3)CC4,C4CCDF1FAF8126E3_9F88CEE5540FA620_6041_DP,7.115301,00000000000000000000001000000000000000100000000000000000000000100110000000010101101101000011010010101000110010011001101011100000110101010110001011011111010110101111010,UAGGXEPOMZAQAT-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2=C(ON=C2)C3CCOCC3)F)CC4,A2344C988836CA63_DA9F8F48B411016E_6041_UN,7.4487667,00000000000000000001000000000000000000000010000000000000010000100100000100010001100101110001011111101010000111010001101011101100110011110110001011011011110111111111110,NRGNQVIECVGMMN-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)N[C@H]3CC[C@@H](CC3)C5=NC4=C(C=CC=C4)O5,C3EC4209DEF3F47C_3E53BF80EC86BC7F_6041_UN,7.963623,00000000000000000000000000000000000000100010000000001000010000100100000000010101100100010010111110100100110100110000011011101100110001110100001011011011100010101111110,SZZCRGVJUIYPOY-KOMQPUFPSA-N
CCN5CCC1=C(C(=CC(=C1)N[C@H]2[C@@H](OCC2)C3=NC=C[N]3C4=CC=CC=C4)F)C5,AB7A7A4B5239B029_B5B460D479489622_6041_UN,8.087801,00000000000000000000000000000000000000100010000000000000010000100100000000010101100101110011000111101100110111010010101011100100110011110110001011011011110111101111110,FDTUQUBMFOVMED-DHIUTWEWSA-N
FC1=C(C2=C(C=C1)SC=C2)NC4CC3(CCN(C)CC3)OC5=C4C=CC=C5,FC126A61F11CBEB1_E62BEB6189E1150C_6041_UN,8.096276,00000000000000000000000000000000000010000010000000000000010000000010000000010000010101111001010011101100110100011101101011100100110011110110001011011011110011101111110,RSOUDILFHPPCME-UHFFFAOYSA-N
CC1=C(N=C(N1CC3CC2(CC2F)C3)C4CCCN4)C5=CC=CC=C5,A419618A508A2F74_C7C22361CAD25A68_6034_UN,8.229732,00000000000100000000001000000000000000100010000000000000000000100110000000010101001101010011000010001000110100011000101011100100110000100110001010011011010110101111010,YDJPSDDTFQPSLT-UHFFFAOYSA-N
C1(=C(C=CC2=C1OCO2)F)NC3=CC(=CC=C3)C4CCCCC4,CA76A1B540D6D82D_33CD4D6E29BDE741_7022_UN,8.652754,00000000000000000000000000001000000000000010000000000000010000100000000010000000000100010001000111000100010101000100001010010100110001110100000011010011110011110111110,RPCYQGHQLGNTDS-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC3=C2CCCCC2=CC=C3,80ABE2FFA31C69DC_CDEE2E7F49A6D024_6041_UN,7.7673388,00000000000000000000100000000010000000000000000000000000000000000000000000100000000000100011010000000100010000001000001000000100110001010000010011011101000010101111010,LRBHAUFATCSVLI-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC23CCNC2CCC3)F)CC4,1EFD5F9D7AE1A11D_8B76E36B7E88C077_6041_DP,7.584388,00000000000000000001000000000000000000000010000000000110000000000010000000010001101101110011010010001100110110011001101011100000110101110110001010011011010110101111010,CGLNRABUVYLCRE-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC2(CCCO2)C3CCCO3)C=CC(=C4)Cl)C5,19A6D26266322CF1_E0A7FB5D100D754F_6034_UN,7.3149633,00000000000000000000000000000000000000000000000000000000010000100110000010010000100101110000010111101101010101011001101011100100110010100110001011011000110111111111110,XFMFZQZXWHSOED-UHFFFAOYSA-N
N2CCC(OCCC1N(C)CCCC1)C(C2)C3CCOC3,A82F9D6B57F81C43_ED7CB69DA60BC9AD_6039_DP,7.6618924,00000000000000000000000000000000000000000000000000000000010000100000000000010000001101100001010011101000100011010001101011100011110010000110001101011011110111111101110,RIQPCCIQSPAOMQ-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC3C(C3)C4CCCC4,BCAE67A7CE2B6B6A_E121A3E6452D38D3_6041_UN,8.274802,00000000000000000000001000000000000000000010000000000000000000100100000000000000101000010011000010101100010100000000001001000100110001110100001011010011010110101111010,UMTBAXJWCYIOJM-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@H]3NC[C@H](C3)Cl)Cl,5BCC95A1B779C0D0_6F4422C4756DAC34_6034_UN,8.228934,00000000000000000000000000000000000010000000000100000000000000000100000000010111011101011011000010001001101100010000000111100100110101110110001010001011010110101111010,NQXSEMLBEQDGHZ-STQMWFEESA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@H]3NC[C@H](C3)F)Cl,1CF5B0C82882C83C_854798BEB927B300_6034_UN,8.228922,00000000000000000000000000000000000010000010000100000000000000000100000000010111011101011011000010001001101100010000000111100100110101110110001010001011010110101111010,MWQPSCIJUQKWAX-STQMWFEESA-N
FC1=CC2=C(C=C1)C(=CN2CC3(CN(C)C)CCCCC3)C4CCNCC4,01DC55F47A5164EF_57E3BD717ED657A2_6034_UN,7.6625195,00000000000000000000000000000000000000000010000000000000000000100110000000110000101101110001010010101100110110011001001011100100110000100110001001011101010110101111010,ICPLYTANEVAYPK-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1C[C@H]2[C@@H](CCNC2)C3=CC=C(C=C3)F)C=CC(=C4)Br)C5,370B38250EF3B1CC_19BDAF41F9555B3F_6034_UN,8.036397,00000000000000000000000000000000000000000010001000000000000000100110000000110000101101110011000010101100110100011001101011100100110000100110001011011111010110101111010,OOQYWTOAYAZCFU-RXVVDRJESA-N
C2(=C1C=CC=CC1=CC(=N2)N3CCOCC3)NC4=C[N](C[Si](C)(C)C)N=C4,A9A549D6B09C4A92_9C1F53142CA55C6F_6041_UN,7.2469707,00000000000000000000100000001010000000100000000000001000010000100100000000110101100101100001011110101100010001011001001011101100110011010110011001011101010111101111110,OTMMKYFUYWQFFL-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=O)N(C=C2I)C[C@H]3[C@@H](CNC3)C4CCOCC4,D262A1F39CDCF346_602C1BEC8C67D638_6034_UN,8.950388,00000000000000000000000000010000000000000010000000000000010000100100000000010000101101110011100010101100010101100100011011100101110010100110001111011011011111110111110,WLQKJCXGSOHBEK-GUYCJALGSA-N
CC[N]1C=CC2=C1C=CC=C2NCC(N3CC(C)OC(C3)C)C4=C(C=CC=C4F)F,30642FD737D869E4_A211C90C0BBCE0D9_6041_UN,8.321275,00000000000000000000000000000000000000000010000000000000010000000100000000010001101101110001000110101100010110010011000011100100110011110110011011001111110111101111110,RGAMQEHMLOXFFV-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=O)N(C=C2Br)C[C@H]3[C@@H](CNC3)C4CCOCC4,CD4FDDEF7660EBBD_7E6A87633F443FFE_6034_UN,8.950342,00000000000000000000000000000000000000000010001000000000010000100100000000010000101101110011100010101100010101100100011011100101110010100110001111011011011111110111110,YCISRUHRVTXEGA-GUYCJALGSA-N
N3CCCC(CC=CC1=C(C)[N](C(=C1)C)C2=C(C(=CC=C2)Cl)Cl)CC3,58506D314015B4BB_91CF9CAF25BF94ED_7019_DP,8.790491,00000000000000000001000000000000000000000000000000000000000000100100000000010000001101110011000010011001100100010000001011100100110001110110001010011111010110101111010,PMOCYTHQKBGGFW-UHFFFAOYSA-N
CN(CC1CNC1)C2=NC(=CN=C2)N[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,9F4FD4348E9C2EB8_7F82C17DBC22A99D_6041_DP,8.486618,00000000100100000000000000000000000000100010000000000000010000100100000000000101101101110011010111101000100111010001001011100100100111110110001011011011110111101111110,PLEMTKFXRVKSHZ-APWZRJJASA-N
N(CCC1CC2CCC1O2)C(=O)C(=O)C3=C[NH]C4=C3C=CC(=C4)F,F5475AD39C6BCE8A_049D63700CCF0920_6038_UN,7.9199114,00000000000000000000000000000000000000000010000000000000010000000100000010000000001100010001100111001100110100110000011011000100110110101100001001110001111111110111110,MKNAQSGSRLQIKG-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC[C@H]2[C@H](CCCC2)N3CCOCC3,023F3BD758A8F530_CF08173421A34B7B_6041_UN,7.690851,00000000000000000000100000000010000000000000000000000000010000100000000000110000101001100011010100101000000001011000001011100000110011010110011001011111010111101111110,LVLZBOIOJGEXKI-PXNSSMCTSA-N
FC1=CC(=CC(=C1)NCC2(CCCC(C)C2)N(C)C)C[N]3C=CN=C3,C09A1ECD22B361A8_E0520EE79F415EF5_6041_UN,8.061309,00000000000000000000000000000000000000000010000000000000000000000110000000110101001101110011010010001000000110011001101011100100110001110110011001011101010110101111010,JOWQZLPHKWGVIW-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C(=O)OCC2)NC4=CC3=C(C=C[N]3C)C=C4,B648583505F6FF03_5D1B6A853FB7EB0D_6041_UN,8.791708,00000000000000000000000000000000000000000000000000000000010000000100000000010000100101000001010010100100010001000000001011110101000011010100001111011001011011111111110,VUACCOAHSULZIG-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC2C3CCC(C2(C)C)C3)C4OCCO4,296D4D815DDCFE15_A4B857A1F0825AFC_6041_UN,7.306221,00000000000000000000000000000000000000000010000000000000010000100010000010100000000100010011000010000000010111001000101010010000010011110110000011010111010011111111110,IUZCZYFOGVEDAD-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)N[C@H]2[C@@H](OCC2)C=C)F)CC3,484C98CFCCA94BA9_94469DF204E18B07_6041_UN,7.6743073,00000000000000000001000000000000001000000010000000000000010000000000000000010001100101110011010111011000100111010001101011100000110011110110001010011011110111101111110,MYXDVOUXOWZFKP-MOPGFXCFSA-N
FC1=CC2=C(C=C1)C(=CN2C[C@@H]3CCCO[C@H]3C4=C[N](C)N=C4)C5CCNCC5,13981D484FCE2C24_A0C06DA725A862B7_6034_UN,8.163596,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011011101100110101010000001011101100110010100110001001011011110111101111110,SWCREBFUCUKNIB-GAJHUEQPSA-N
FC1=CC2=C(C=C1)OC=C2NCC3CCCN(C)C3C4=CC=CS4,8FE3A491C7F5D8ED_DFFA630023E62C79_6041_UN,8.439995,00000000000000000000000000000000000010000010000000000000010000100000000000010000111101111011010111101100010110010001101011100100110001110110001001011011110110101111110,GTALSPGSQBITJX-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3CNCCC3)CC5(CC4=CC=C(C=C4)F)CCNC5,8E87D8A89CCDAEA3_4698A7F649F247F8_6034_UN,8.1237755,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101110011000010101100110100011000001011100100110100100110001011011011010110101111010,ACFNYDFOHRBXOD-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=C1)NCC2CCCC3=C2N=CC=C3,E4D1677C3001EA32_57F2CFAE2EB50E59_6041_UN,7.6804705,00000000000000000000100000000010000000000000000000000000000000000100000000100000101000100011010000101100010000001000001001000100110001010100011011011111010110101111010,JRDKFLGZJNHWSY-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)F)CC#N)NCC2CNCC3(O2)CCC3,C63A1D5F368A27C8_46CF3309470436F9_6041_DP,7.8385177,00000000000100000000000000000000000000000110000000000100010000000010000000000000101000110011000100101000010100011000001011000000110111110110001011010011110111100111110,NNFSMXVEYCIZJK-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NCC(CN2CCCC2)C3CC3)F)C4,A7D87B36A4C091B7_CB82EFB70392F68E_6041_UN,7.8156567,00000000000000000000001000000000000000000010000000000000000000000000000000010000101101110011000010101100010110010010101011100000110001110110001011011001010110101111010,JZHZUHQZVQFVSC-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2=CN(C(=N2)C3CCCN3)CC4(CC)CNC4,5528578FDADE4ADB_B0E5E69D3E586DE4_6034_UN,8.416991,00000000100100000000000000000000000000100010000000000000000000100110000000010101101101110011000010001000100100011010101011100100110100100110001010011011010110101111010,WMBJABKBPLSWOW-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C#N)[N]2C=C(C=N2)NCC4CC3(CNC3)C4,4793F5944700E026_52793E70DCA7A9A6_6041_DP,7.9669304,00000000100100000000000000000000000000000110000000001000000000100110000000010001101100110010001010001000010100001000000011101100100101110110001010001011010110100111010,PHBONGGQYCRHNR-UHFFFAOYSA-N
CC1=C(C=N[N]1C)C2=C4C(=CC(=C2)C=CC3CCCC(F)C3)OCO4,EBC33F4BEE422639_ACC36C1B63B3683E_7019_UN,8.203033,00000000000000000000000000001000000000000010000000001000010000100100000010010000100100010000011010010100010101000100001011111100110000100100001011011110110011111111110,LBRPKJZDQQNKMF-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3CCCCC34CCC4,574C92609C030C11_085774FE37AEB68F_6041_UN,7.959366,00000000000100000000000000000000000000000010000000001000000000000110000000010000100100010011011010000100110100011000001011101100110001110100001001011001000010101111010,SZYXZSRPIPFZLJ-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC3=C(C2CNC2)OC=N3)F)CC4,D6D61BCB87EB6B63_809CAAA7ECBFA666_6041_DP,7.898986,00000000100100000001000000000000000000000010000000000000010000100100000000010001101101110010010111001000000110110001111011100100110101110110001010011011110110101111110,UJHDVHJRBLVFAC-UHFFFAOYSA-N
FC1=CC(=C(C=C1)OC2=NC=C(C=N2)NCC5C3(C4=C(C(C)(CC3)C)C=CC=C4)C5)F,33299B99AAFFE32F_01EC2B1368594F60_6041_UN,8.146508,00000000000000000000001000000000000001000010000000000000000000000110000000100101101000010011000000101100011100101101111011000111110001110100001111010111110111101111110,YIVIKHSEJRRGHI-UHFFFAOYSA-N
CC(Cl)C2=NC1=C(C=CC(=C1)Br)N2CC3CNCC3OCC,83DDE156946DB4E2_3D1CD5A3423E42B7_6034_UN,9.292723,00000000000000000000000000000000000000100000001000000000000000000100000000010101101101110011000111001101010111000010000011100111110010100110001110001111110111101111110,XKOWTWAMRCNRJW-UHFFFAOYSA-N
BrC1=CC2=C(N=C1)N(C=C2CC3=CC=CC=C3)C[C@H]4[C@H](CC(C)(C)C)CNC4,85A4B4509272E9B6_D78698D21E9CA7D7_6034_UN,8.117491,00000000000000000000000000000000000000100000001000000000000000000110000000110100101101110011000010101100010110001001000011100100110000100110011001001111010110101111010,BGGBNCWFWUJMHX-UXHICEINSA-N
C1(=CN=C(C=C1)C2(CCOCC2)C#N)N[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,8446685D4F8F7A70_7FDC15F243761FED_6041_UN,7.5685563,00000000000000000000001000000000000000000110000000000000010000100110000000000001100000110010000000100000100101011000001011000100110011110110001011010011010011100111110,AXAUOQVNHRROFB-RHSMWYFYSA-N
C1(=CC2=C(C=C1)C=C[NH]2)NC4=CC3=C(CCN3CC)C=C4,B311A11B398CDF1F_3B7504089C2C59F8_6041_UN,7.9877977,00000000000000000000000000000000000000000000000000000100000000000100000000010000100101100000000010001100010010010010101011100100110101010110001011011001010110101111010,OGEFUNCUJOFXES-UHFFFAOYSA-N
ClC1=C(C=CC(=C1)NCC2=NC=CN2CC3CC(C)(C)NC3)Br,4E13876A7DAD42A3_CDF503FEFEB67C95_6034_UN,8.603439,00000000000000000000000000000000000000100000001000000000000000000110000000110101101101010011000010001001100110011001100011100100010101110110001010001111010110101111010,GMVHZMBOVFWYHA-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CC(=N2)NCC3N(C)CC4(CC3)CC4,9962E4B71FBF06C6_E5B50995815892BD_6041_UN,8.073141,00000000000000000000001000000000000000100010000000000000000000000110000000010101001001110011010000101100010110011001101011100100110001110110001001011011010110101111010,DAGGJERQZDASCQ-UHFFFAOYSA-N
CC(=O)C1=CC(=CC(=C1)F)NCCN2CC3C(C2)C4CCC3C=C4,562B5029C3C103F2_D444FF046F217782_6041_UN,7.9678593,00000000000000000000000000000000000000000010000000000000000000000000000000010001001101110001000010011100110100010000001001100000110001110110001001011001111110101111110,MKJBHJHHFLZVRM-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(C)CCCCCCC3,C53D1C51FCCEA0EF_0193D483ABFA1DE9_6041_UN,7.0054655,00000000000000000000000000000000000000000010000000001000000000000110000000010000101100010011011010001100010110001001101011101100110001110100001000011101010110101111010,KCIGHCKRWIJJKW-UHFFFAOYSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NC(CCC)C3=C(C=C(C=C3)F)F)C4,7D1DF06C1B2189C3_8D3CB7EED8BC6132_6041_UN,7.8233523,00000000000000000000000000000000000000000010000000000000000000000100000000010000100101110011010010101100110100010011101011100100110101110110001011011111010110101111010,AMXQLHHJMPVKHE-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=C2C3CC3)C[C@]45CNC[C@H]4CN(C)CC5,B05B68CE750173A3_8BCD62DE960A05A3_6034_UN,7.6904984,00000000000000000000001000000000000000000000001000000000000000100110000000010000101101110011010010101100010110011001101011100100110000100110001001011001010110101111010,VWMITWRQQVDRCV-YWZLYKJASA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2C3(CCCC2)CCC3,A2AA696591F46BB6_ED29B3581018A35A_6041_UN,7.4167185,00000000000100000100100000000010000000000000000000000000000000000110000000100001001000100011010000101000010000001000001001000000110001010100011011011111010110101111010,DBSXXXQFUZTUAP-UHFFFAOYSA-N
C[N]1C=CN=C1C(NC(=O)C2C3C4CC2CC34)C5=C(C=C(C=C5)F)F,92614634F056852C_859461822D5C3269_6038_UN,8.022556,00000000000000000000001000000000000000100010000000000000000000000100000000010101000101010001110010000000010100100000010011100100110000100100001011001011001010101111110,OQHFKISLOKQLLM-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC[C@@H]3CNCC(O3)(C)C,8BB26B535C018A3B_1F28B2BF2FECB0B0_6041_DP,8.109615,00000000000000000000000000000000000000100010000000001100010000100110000000110101101100110010011110101000000110001001000011101100100111110110011011001111110111101111110,ZHOIFPZWWYGLKZ-LBPRGKRZSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2CC3CNCC3OCC,E9A71A5EDDEDAA95_A701278B57A4CF09_6034_UN,9.09333,00000000000000000000000000000000000000000000001000000000000000000100000000010000101101110011000111001100010111000010100011100111110010100110011110001111110111101111110,CQZBOTPKCZXRES-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NC3(CC3)C4CCCCC4,F6341BABCABABF6F_FF53292C9E4DBB1B_6041_UN,7.99271,00000000000000000000001001000000000000000010000000000000000000100110000000010101000101010011010010000100111100011000001011100100110001110100001011011011000010101111010,BCVRTEXDQXMRKU-UHFFFAOYSA-N
O(CC1CCC2(CC1)OCCO2)CC3OCCN(C)C3,9BD1598DB4758EFC_85F4C25120802D5C_6039_UN,7.396004,00000000000000000000000000000000000000000000000000000000010000000000000010010000000101100000010111101000010011011001101011110010110010000110100001111000110101111101110,HMZKZLKOHVIUKZ-UHFFFAOYSA-N
CCN3CCC1=C(C(=CC(=C1)NC(CC)C2CCCCCC2)F)C3,E4975C68D206B4C6_EF00116142989FCD_6041_UN,7.375869,00000000000000000001000000000000000000000010000000000000000000000000000000010000000001110011000000101100110110010010101001100000110001110110001011011101010110101111010,CFICHQNLKXGMFP-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2(CC=C)CCOCC2)F)CC3,776201E40D211F76_7AF8BF9B54E3B4B3_6041_UN,7.580361,00000000000000000001000000000000001000000010000000000000010000000010000000010001100001110010010001111000100111011001101011100000110011110110001011011011010111101111110,ZMVYRHJJNPXANO-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NC2=C[N](C)N=C2C3CCCCC3,A12156113D382449_81CB4C57FE9C7F4E_7022_UN,8.529874,00000000000000000000000000000000000000000010010000001000000000100100000000010001100100010001011010010000000100000000001011101100110001110100001011011011000010101111010,KHSPBCCUERTPDV-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)Br)F)NC(=O)C2(CC=C)CCCCC2,F6760AA5BDACC1CA_0EA3B03D2B89EC35_6038_UN,8.445759,00000000000000000000000000000000001000000010001000000000000000000010000000000000000000010011100000010000000100101000011000000000110001110000000011010011001110101111110,FOEVDVFNQJKPPQ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)F)Br)NC(=O)C2(CC=C)CCCCC2,316A05961517CE86_70F2BAEABB17794E_6038_UN,8.445753,00000000000000000000000000000000001000000010001000000000000000000010000000000000000000010011100000010000000100101000011000000000110001110000000011010011001110101111110,BLIKVNUBZNJOLU-UHFFFAOYSA-N
C(C1CCCCC=C1)=CC2=C(C)C3=C(O2)C=CC(=C3)F,00F6B53BFABEC86F_B2355118CB8F06E4_7019_UN,8.698165,00000000000000000001000000000000000000000010000000000000010000000000000000000000000100010000000010010100010100000000001000000100110000100100000010010010100000001011110,LATRVANWSJNRAD-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3(CCCC3)C4=CC=CC=C4,9C5DA438B672250E_895FB10DFE24BE20_6041_UN,7.4870677,00000000000000000000000000000000000000000010000000001000000000100110000000010000101100010011011010001100010100001000001011101100110001110100001001011001010110101111010,FBHNLJKXPUSCMF-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC3C4(C(N(C)C)C3)CCC4,51DBE4D23B42AA92_8844A47B97F03ACA_6041_UN,7.519269,00000000000100000000000000000000000000100010000000000000000000000110000000100100100001110011010000100100110110011000101001100100110001110100011011011111000010101111010,GMNHHIIGMAVCFD-UHFFFAOYSA-N
O(C1CCOC(C1)C2CCOC2)CCN3CCOC(C)C3,E1C2E7189CA10DA8_031D39DF128B3C84_6039_UN,8.214356,00000000000000000000000000000000000000000000000000000000010000100000000000010000000101100100000110101000000011010001101011100011110010000110100101111000110101111101110,STEKXOMAAGDKIA-UHFFFAOYSA-N
CCN3CCO[C@@H](CNC(CC2CC1CCC(N1C)C2)=O)[C@@H]3C4=CC=CC=C4,DEE6BA3C23252E3F_C6C3E8BF2C4F19B2_6038_UN,8.031301,00000000000000000001000000000000000000000000000000000000010000100000000000010000101101100001110110101000110011110010111011100000110010000110001001011111111111111111110,XXGXKLLTRRNVPM-JFJCZNLESA-N
FC1=CC2=C(C=C1)C(=CN2CCN(C)C3CNCCC3)C4CCNCC4,88426689CEADB801_2CD00CC86986D3E7_6034_UN,8.070747,00000000000000000000000000000000000000000010000000000000000000100100000000010001001101110011010010101100110110010001101011100100110101100110001001011001010110101111010,TUQDMSFVEVITJC-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)NC3CCN(CC2CCCO2)CC3,B4989311700999F9_73904ACB0D94E725_6041_UN,8.136673,00000000000000000000000000000000000000000010000000000000010000000000000000010000100101110010000110101000100101010000001011100000110011110110001011011011110111101111110,GXDSXKJRSSKNEX-UHFFFAOYSA-N
SC2=C(C=C1OCCOC1=C2)NC3C4CCC(C3(C)C)C4,C930442DDA62C13A_5A002200101B3585_6041_UN,7.537831,00000000000000000000000000000000000000000000000000000010010100001010000010100000010000001011000011100100010011001100101010000000010111010110000011010111110011111111110,GEYDNZQZHDBXFW-UHFFFAOYSA-N
CC1=C(C=C(C=C1)Cl)NC3CCN(CC2CCCO2)CC3,06E121FCF9FDA82E_F1F282656073470B_7022_UN,8.136673,00000000000000000000000000000000000000000000000000000000010000000000000000010000100101110010000110101001100101010000001011100000110011110110001011011011110111101111110,JKGBDBRTQLGWRW-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC(C)CCC3CCCC3,20FD12FA094F792E_0C2F0B4C90C674F8_6041_UN,7.9986744,00000000000000000000000000000000000000000010000000001000000000000100000000010000100100010010011010000100110100010001101011101100110001110100001000011101000110101111010,RILHUYDIEJSKBR-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(N(C)C)CCOCC2)F)CC3,CCCB33AF4FBE8451_B319CCBE17C1D899_6041_UN,7.6354465,00000000000000000001000000000000000000000010000000000000010000000010000000110001101001110011010001101000000111011001101011100000110011110110011011011111010111101111110,KXEWQJFHRSCNJS-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC[C@H]2[C@H](CCCC2)N3CCOCC3,FE794DAF0AB8391D_9DCA758F57E122E8_7022_UN,7.683417,00000000000000000000100000000010000000000000000000000000010000100000000000110000101001100011010100101000000001011000001011100000110011010110011001011111010111101111110,GOCXTMCWVWCOTK-PXNSSMCTSA-N
CN(C)CCCN1C3=C(CCC2=C1C=CC=C2)C=CC(=C3)NC(C4=NOC=N4)C5=CC(=C(C=C5)F)F,12D193E542D38242_CA69074E15DDE75A_6041_UN,8.363682,00000000000000000001000000000000000000100010000000000000010000000100000100110101100101110000011111001110010110110001111011101100100001110110001011011111010110101111110,WBJUHMFBFPBJAR-UHFFFAOYSA-N
CC2=NC1=C(C=CC(=C1)CCl)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,F80A214249014F05_BBEDCBC2079FCAD8_6034_UN,7.7337427,00000000000100000000000000000000000000100000000000000000000000000110000000110101000101000000000010001101010010001000101011100100110000100110011011011110010110101111010,OSQSAYSDIMJKDD-YVZMLIKISA-N
N1CCOCC1C2=NC=C(C=N2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,C5027067445244C8_A6775F842CD165B6_6041_DP,8.778563,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101110011010111101000100111010001101011100100110111110110001011011011010011101111110,XYOOLMHORIAZAI-BLAYRMRBSA-N
CC5(C)CCC1=C(C4=C([N]1C[C@@H]2CNC[C@H]2C3=CSC=C3)C=CC(=C4)Br)C5,BBF6D60B879BCF63_45622AC7E8C5C95A_6034_DP,7.970564,00000000000000000000000000000000000010000000001000000000000000100110000000110000101101111011000010001100010100011001101011100100110000100110001011011111010110101111010,BMRBWHGIELSVSY-JXFKEZNVSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2(C)COCCC2)F)CC3,C39CFB8550354E7B_A16BD7ECD324AE28_6041_UN,7.1134653,00000000000000000001000000000000000000000010000000000000010000000010000000010001100001110011010100101000100111011001101011100000110011110110001011011111010111101111110,SLHLGPDZYBFRQA-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CCC2CCCCN2C)C(=CC(=C3)F)F)C4,752B553AD7D8A447_CF0E8324B30B5D18_6034_UN,7.110753,00000000000000000000000000000000000000000010000000000000000000000110000000110000100101110000010010101100010110011001101011100100110000100110011011011110010110101111010,PAMBDJSDOLTNNQ-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NCC3(N2CCN(C)CC2)CCCCCC3,DCBE94A353E6AA0F_EC5D56AD2E138939_7022_UN,8.229057,00000000000000000001000000000000000000000010010000000000000000100010000000010001001001110011010000111000000100011001101011100000110001100110001001011001010110101111010,JOJQURUEZKDBLS-UHFFFAOYSA-N
COC2CC(OCCCC1=CC=CC(=C1)OC(F)(F)F)C23CCC3,697DCB07DEE3690F_341AF5D7E9548D8C_6039_UN,7.9626007,00000000000100000000000000000000000000000010000000000000000000000010000000000000000000000100010000000000011111001100101000000011110010100000000100110000110101011011110,DDBASGYZIXSZBA-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NC3=CC=C(C2OCCNC2)C=C3)F)C4,2B460123DD5BB0E9_66D8D6148B625776_6041_DP,7.5002184,00000000000000000000000000000000000000000010000000000000010000100000000000010000001001110001000100101100110111010010101011100100110111110110001011011001110111101111110,MSFXNJGUSFGJFY-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)F)CC#N)NCC3OCC2(CNC2)C3,396761188E334CDD_5BC4F336625DD837_6041_DP,7.742265,00000000100100000000000000000000000000000110000000000000010000000010000000000000001100110011000111001000010101011000000011000000110111110110001010000011110111100111110,AGFDBLWOXULHCX-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(C3=C(C)C=CC=C3F)=O,70E367A450F62590_D9F708216E385CB9_6038_UN,7.5318923,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010001100010001000110100110000011000000000110000100000000011010011011110101111110,BWXWTQXSBOTKKA-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC(C4CC4)C5=C(C=CC(=C5)F)F,9DE50462E05B9B37_9BED8BCD8665BC92_6041_DP,8.193783,00000000000000000000001000000000000000100010000000000000000000000100000000000101101101110011010010101000010110000000000011100100110101110110001011011011010010101111010,MPJYWLCPFIRQAH-JNKARSBBSA-N
NCC3(OC1=C(C2=C(C=C1)N=CC=C2)Br)CCCNC3,63DA2496BD161ED6_9AE5E3562A5F9B12_6035_DP,8.19461,00000000000000000000000000000000000000000000001000000100000000000110000000000000101010110011000100101100110100011100001011000111110110100110001111010011110111100111110,BIMJOOPUPYATLA-UHFFFAOYSA-N
CN1C4CCC1CC(NC(=O)C2(CCC2)C3=C(C(=CC=C3)Cl)F)C4,A59721183B052E32_1EC951D5BECF25B7_6038_UN,7.607779,00000000000100000001000000000000000000000010000000000000000000100010000000010000100101010011110010100001110110111000111001100000110001100100001011011011001010101111110,RHGNCRYKGBREIP-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=NC=C(C=C1)NCC2=CC=CC3=C2CCNC3,0DF472606B6FF5F5_A0248777EC7F5778_6041_DP,7.649233,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100001010000101100110000011000001011000100110101010110011011011101010110101111010,DRBRGGGMVXXLGT-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NC3(CC2=C(C=CC=C2F)F)CCCCC3)F)C4,CD4AA31A2D406C17_3D203A55240B0EDA_6041_UN,7.8642225,00000000000000000000000000000000000000000010000000000000000000000010000000010000000001110011000000101100110110011010101001100100110001110110001011011011010110101111010,GDIZKXKDPGHCDE-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)COC2)[S](C4=C(Cl)C=C3[NH]C=CC3=C4)(=O)=O,1CC543E6E0DBB4A5_EED4B8712096BA8F_6029_UN,8.540854,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100111001001010000111011101001000010011001100011101111110001011101011010011110111110,NXLHQVFLYIHXJS-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC=CC3=CC(=CC=C3)F)C4CCNCC4,F60F481352EDA200_E3045549A9DFC28E_6034_UN,8.526511,00000000000000000000000000000000000000000010000000000000000000100100000000010000001101110001000010111100110100010000001011100100110000100110001001011001010110101111010,LVMYPFBCELTFFH-UHFFFAOYSA-N
ClC1=CC=C(C=C1)C=CC3C(C2=NC=C[N]2C)CC4CCC3N4,BD03254AD2200CD2_D27CB002CD7FDB11_6009_UN,8.01999,00000000000000000001000000000000000000100000000000000000000000100100000000010101000101010011010010110001110110010000001011100100110000100100001011011011000010101111010,DQIYOWQBVLDJQO-UHFFFAOYSA-N
CSCC3(C=CC2=C(C1CCNCC1)OC=N2)CCOCC3,4A695C2333375B8C_8DB0A537D543619A_7019_DP,7.963808,00000000000000000000000000000000000000000000000000000000010000100110000000000000001100101001010110111000100011111001011011000000110010000110001011010011110111111111110,UJTAFIBGOLRZOU-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC3=CC5=C(C=C3)OC4(CCCCC4)O5)F,C70DB37776BF9C1A_2AE9B0ABE392A8EE_6041_DP,8.594405,00000000000000000000000000000000000000000010000000000000010000000000000010000000001100010011000011101100110100011100001011010100110111110100001011010011110011110111110,GSIDHMUOQZZPII-UHFFFAOYSA-N
FC1=C(C(=C(C(=C1F)F)C=CC2(COC)CCCCO2)F)F,21A584799B07A347_0CF4E23DA81E6008_7019_UN,8.190334,00000000000000000000000000000000000000000010000000000000010000000010000010000000000000110000010000110000000111001001001000000010110010100110000011010010110101011011110,OQISRUWYYVHDBB-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC3CCOC2(CCC2)C3)C=CC(=C4)Cl)C5,DCAEE9A20F583DBB_71030CA62B681DB6_6034_UN,6.871456,00000000000100000000000000000000000000000000000000000000010000000110000000010000100101110000010010101101010101011001101011100100110010100110001011011000110111101111110,CMAMPKHUXXPJFA-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C(=O)C3(CCC3)C4=C(C=CC=C4F)F,F8388A34D2039DA2_F502BC3396267DE1_6038_UN,7.467928,00000000000100000001000000000000000000000010000000000000010000100010000000010001001101110011100110101000110100111000011011100000110010100110001011011011111111110111110,BHYPGQBLNMUJRF-UHFFFAOYSA-N
FC2=C[N]1C=NC=C1C=C2NC3CCN(C)C34CCCNC4,F66AAC2648016125_1265DF13F111BCD6_6041_DP,8.294721,00000000000000000000000000000000000000000010000000000100000000000110000000010101101101110011010010101100110110011001101011100100110101110110001011011011010010101111010,ZANATWXBFBZXQV-UHFFFAOYSA-N
N(C1=CC(=C(C=C1)C2=CC(=CC=C2)F)F)C(C3CC4CNCC3C4)=O,2E4224D440B6A380_B1E5250F3E24A47F_6038_DP,7.514908,00000000000000000001000000000000000000000010000000000000000000100000000000000000001000110011100010101000010100100000010001000100110101110110001011000011011010100111110,RAOHNQXCEUOXMD-UHFFFAOYSA-N
FC1=CC2=C(C=C1)SC=C2NC4=C(CN(C)C3CCCCC3)C=CC=C4,CAF6A3A66EA205CB_15B893058480432A_6041_UN,8.050366,00000000000000000000000000000000000010000010000000000000000000000000000000000000110101111010010010001100010110010001101000100100110001110100001011011011010110101111010,CNYUQBHVIDAFAP-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)F)NCC(CC)C2CCOCC2)F,7D334F5113FAB814_96556A60C4DA0543_7022_UN,7.8588824,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110011000000101000000111000010101000000000110011110110000011010111010111101111110,ZYRYRQMWTZCFRM-UHFFFAOYSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NCC3CCC2(CCNCC2)CC3,D9D2D63FBF8F8C9B_286C56A23BCFCF8A_6041_DP,7.502853,00000000000000000000100000000010000000000000000000000000000000000010000000100000001000100011010000101000110000011001001001000000110101010110011011011111010110101111010,RZTBBIZWIKXHHD-UHFFFAOYSA-N
CC1=CC=C(C=C1)C2=NC(=C(Cl)N2CC4CC3(CCN3)C4)C#N,2F82465F0938F472_3B101AB6B2DA00DA_6034_UN,7.486202,00000000100100000000000000000000000000100100000000000000000000100110000000010101101101010011000010001001110100011000001011100100110000100110001010011011010110101111010,RAJSRAFITPZAIP-UHFFFAOYSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NC[C@H]3[C@H](CCCC3)N4CCOCC4,A2099594009CD06A_D1BAD15ED7E1525B_6041_UN,7.5812254,00000000000000000000000001000000000000000010000000000000010000100100000000010101101101110011010110101100011111010000001011100100110011110110001011011011010111101111110,PEICCMGVJRIOBS-YOEHRIQHSA-N
NCC1=CC2=C(C=C1)C(=O)C=CN2CC3CCCC4=C3C=CC=C4,95D7143585EAAE08_7456F89FA450F5B4_6034_UN,8.920605,00000000000000000000000000000000000000000000000000000000000000000100000000010000001011000000000001101100010000000100001001100101110000000110001111011001111110100111110,KOYDYOLFACYJNE-UHFFFAOYSA-N
CC1=C(C=N[N]1C)C2=C5C(=CC(=C2)C=C[CH]4C[C]3(C[C](F)(F)C3)C4)OCO5,53D155AA22162AF0_33514688D22EF1AE_7019_UN,8.88861,00000000000100000000000000001000000000000010000000001000010000100110000010010000100100010000011010010100010101001100000011111100100000100100001010001110110011111111110,MSVLUKHHXIFQCS-UHFFFAOYSA-N
N4CCC1=C(C=C(C(N1CC3(C)CC2=C(C=CC=C2)N3)=O)C#N)C4,3684381EE253E70F_76EE3E456ABF4DF8_6034_DP,8.430676,00000000000000000000000000000000000000000100000000000000000000000110000000010001101101100011100011101100110000111101011011100101110100010110001111011011011110101111110,XYAFMQFLHOOZPR-UHFFFAOYSA-N
O([C@@H]([C@H]1NCCC1)C2=CC=CC=C2)C3=NC(=C(C=C3C#N)Br)C,49D4C162AE887E18_698906FE8EC6E4F5_6035_UN,7.146622,00000000000000000000000000000000000000000100001000000000000000000100000000000000101100010011100111101000100100110100011011000111010000100100001111010011110011101111110,WCVFXXYYTAVGOC-DLBZAZTESA-N
CN(C1CCCNCC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=CC=C(C=C4)F,CC7FC28864AD61B5_0776889611333AA1_6041_DP,7.8914304,00000000000000000001001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010000101011100100110101110110001001011011010010101111010,YXLISBPYOKHEDU-UQJFVLDMSA-N
N1CCCC2=C1C=C(C(=C2)NCC3(CC[Si](C)(CC3)C)C4=CC=CC=C4)F,4481EA7E26B4244B_AC62C3589863E0CC_6041_DP,7.499117,00000000000000000000100000000010000000000010000000000000000000100010000000100000001000110011010000101100110100011001101011000100110101110110001011011111010110101111010,RLPFKFFOKSMIPH-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC4=CC3=C(N(C)CCC3)C=C4)C5CCNCC5,D606B181D804CEE8_9004C9178CDB8FE7_6034_UN,8.063021,00000000000000000000000000000000000000000010000000000000000000100100000000010000001101110001010010101100110110010001101011100100110000110110001011011001010110101111010,DCCXLPNKYYHMEN-UHFFFAOYSA-N
O(CC2CCC1(CCOCC1)O2)CC3OCCN(C)C3,9095DB8B873487D7_86035CD9CA8D4F66_6039_UN,7.2358813,00000000000000000000000000000000000000000000000000000000010000000010000010010000000101100100010111101000010011011001101011100010110010000110100001111000110101111101110,NFYROOSPFULCBF-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NC[C@@H]3CC[C@@H](O3)C4CC4,7B48932C91DED55E_78A4026F9FFF6E45_6041_UN,7.7814016,00000000000000000000001000000000000000000010000000000000010000100100000000100000101100010011000110101100010100000000001011000100110011110100011011010111110111101111110,RPMHUVCUQGFXNU-MAUKXSAKSA-N
CN(C)CC1=C(C=C(C=C1)NCC2(CCNCC2)C3=C(C=NC=C3)F)F,ACA4EC1EAB6A7821_F977FE1B5F98C8DB_7022_DP,8.058842,00000000000000000000000000000000000000000010000000000000000000100110000000100000001001110011010000101000100100011001001011100100110101110110001011011111010110101111010,RCLCFJDHDQPFJI-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC34CNC(C3)CO4,BAF34B163CFA3A37_6C4B1A1EBCBA80AE_6041_DP,7.116964,00000000000000000000000000000000000000100000000000000100010000100110000000010100101101100011010111101000110011011001101011100000110111010110001011011011110111101111110,IUOZGZMZYRFNHC-UGWHAMFMSA-N
N1CC[C@@H]2CN(CC[C@H]12)C3=NC(=NC=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,A9207D008EE6CDCA_2886DBA2252E7FD0_6041_DP,8.694379,00000000000000000000000001000000000000100010000000000000000000100100000000010101101101110011010010101100111110010001101011100100110101110110001001011011010010101111010,BUQGDEVYHTVKHI-LYSIVYOWSA-N
N2CCC(OCC1=CC=CC(=C1C#N)F)CC2C3=CC=C(C=C3)F,FA295AACC1F39B23_E6E5DC97F0667B8F_6039_DP,7.744709,00000000000000000000000000000000000000000110000000000000000000100000000000000000001000010001000001101000100101010000001001000111110010100110001111010011110111100111110,PUPDIRJQAIELAB-UHFFFAOYSA-N
CC(C)C1=C(C=C(C=C1)NC[C@@H]2CNCC(O2)(C)C)F,C53C41E13828F122_DC8C774EFF9F2308_6041_DP,8.3498125,00000000000000000000000000000000000000000010000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110011011000111110111101111110,UEKWHNLNAKPUKU-ZDUSSCGKSA-N
FC1=CC=C(C=C1)C2=CN(C(=N2)C3CCCN3)C[C@H]5N[C@H]4CCO[C@H]4C5,3B88BB94522A7391_21030F786B66DD12_6034_UN,8.35615,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101010011000111001100110101010000001011100100110110100110001010011011110111100111110,QJMRSJOBOPTEKD-JYDALHQQSA-N
C(C1(CC1)C2CCCCO2)=CC4=C(N3CCN(C)CC3)C=CC=C4Cl,DD58EE79A7CD1913_1F45B5B4BC8BCF31_7019_UN,7.250602,00000000000000000000001000000000000000000000000000000000010000100010000000010001000001110000010000111001000101011001101011100000110011110110001011011010110011101111110,IMJYJHUWTLKTFA-UHFFFAOYSA-N
CC(C)C1=CC(=C(C=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4)F,4D82A83A85DBE330_1A84020AD5B31042_7022_UN,8.201138,00000000000000000000001000000000000000000010000000000000000000100100000000110101101101010011010010101000000100010000001011100100110001110110011011011111010110101111010,SVSMJXYGYDESME-VGSWGCGISA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CCOC(C)C3,A8A9E283C2F106AD_8171F456845F3DFA_6041_UN,7.598917,00000000000000000000000000000000000000100000000000000000010000000100000000000100001000000011000000101100010011000001101011000100110011010110011011010111110111101111110,HUOXNKNLKKCIAG-UHFFFAOYSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NCCOC3(C)CCOCC3)C4,9C8AE08D57CA27A5_5C6FACD530A559C3_6041_UN,8.001343,00000000000000000000000000000000000000000000000000000000010000000110000000010000101101100111010110101100110011011001101011100111110111010110001111011101110111111111110,IOQOCKIITSBSOZ-UHFFFAOYSA-N
C2(=CC1=C(C(=CC=C1)Cl)S2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=N[N]4C,E06AA665509F0265_12FF922B00211C96_7022_UN,7.660627,00000000000000000000000000000000000010000000000100001000000000100100000000010001111101111011011010101101010110010001101011101100110001110110001011011111010110101111010,NVZBQWLFKIRWHJ-KBXCAEBGSA-N
CC1=CC=C(C=C1)NC24CC3CC(C2)CC(C3(F)F)C4,3219B87001DD5A53_B4EC463B8C7FA8F6_7022_UN,8.062776,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010001000000000100110100011000000000000000100001110000000001000001000010101111010,ABURQZPHGJALOV-UHFFFAOYSA-N
C2(=CC1=C(C(=CC=C1)F)S2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=N[N]4C,3BFC96EA9BC9BE27_F5E3F7D9FFB92E66_7022_UN,7.6606097,00000000000000000000000000000000000010000010000100001000000000100100000000010001111101111011011010101100010110010001101011101100110001110110001011011111010110101111010,GZFRPXUCKLMBHC-KBXCAEBGSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NCC3CCCC(CC)CC3,298561F25A04AC0C_705C43C819679078_6041_UN,7.8887396,00000000000000000001000000000000000000000010000000000000000000000100000000100000101000010011000000101100010110000010101001000100110001110100011011010111010110101111010,MIVZMMLNTGYLJE-UHFFFAOYSA-N
FC2=C1C=C[NH]C1=CC=C2NCC3CCCC(CC)CC3,6FE5FC0A3FEE581A_B67F6F69B751F4FC_6041_UN,8.136334,00000000000000000001000000000000000000000010000000000000000000000100000000000000001100010011000010001100010110000010101001000100110101110100001010010011010110101111010,QPWYFJQTKPLMRE-UHFFFAOYSA-N
CN5CCC1=C(C4=C([N]1CC2CCC3(CN2)CCSCC3)C=CC(=C4)Cl)C5,D8195ADD022B2863_D37EAF71A618381E_6034_DP,7.088409,00000000000000000000000000000000000010000000000000000000000000000110000000010001101101111011010010101101110100011001101011100100110000100110001011011001010110101111010,XHNJBJUWXTYOKW-UHFFFAOYSA-N
CC(C)(C)C2=CC1=C(C=CC(=C1)F)N2CC3CCCCCN3,F7C49E84D9CB631F_968B09FDC5EB474F_6034_UN,7.4388223,00000000000000000001000000000000000000000010000000000000000000000110000000110001001101010011000010001100110110011000001011100100110000100110011010011111010110101111010,PTVKGXDGXHHITG-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(CCCC3)C4=C(C=CC=C4F)F,7C6F33D2C09FD790_BADBCE2C1B3E2FF6_6041_UN,7.8269925,00000000000000000000000000000000000000100010000000000000000000100110000000010100101101110011010010101000000110011001101011100100110001110110001011011011010110101111010,GRDKBHLBLOLKPC-IBGZPJMESA-N
CN4CCC1=C(C=CC=C1NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C4,74EC268035DF9488_41766380F1047107_6041_DP,7.2502637,00000000000000000000000000000000000000000010000000000100000000100000000000010000101001110011010000101100110100010001101011100100110101110110001011011011010110101111010,BOQUXQPQYXGDQF-AZUAARDMSA-N
C[N]1N=CC(=C1)C4=NC2=C(C3=C(S2)CCC3)C(=C4N5CCNCC5)C6=CC=C(C=C6)Br,E0144108C6AFEA38_6994CBE7883B0233_2201_UN,7.433312,00000000000000000000000000000000000010000000001100001000000000100100000000010001111101111001011010101100110100010000001011101100110001110110001011011011010010101111010,JOONUDUMVFPTEM-UHFFFAOYSA-N
CC1=CC(=C(C=C1)F)NCC3(C2CCNCC2)CCOCC3,5C3BF296FA1A939E_DD6FC2E5D9D6740A_6041_DP,8.436678,00000000000000000000000000000000000000000010000000000000010000100010000000000000001000110011000000101000100101011000001011000000110111110110001011010011010111101111110,LTVMOXJOZWSYHH-UHFFFAOYSA-N
FC2=C(C(=C1N=CC(=C(C1=C2)NC3COCC3CC)C#N)F)F,88F30484BE0BBE86_68108DB2848C85ED_6041_UN,7.9591107,00000000000000000000000000000000000000000110000000000000010000000100000000000000100100110011000111100100110111010010100011000100110001110110001011000011010111101111110,CFUYQKNLMHINPF-UHFFFAOYSA-N
C[N]1N=CC(=C1)C4=NC2=C(C3=C(S2)CCC3)C(=C4N5CCNCC5)C6=CC=C(C=C6)F,77E0AD9CA5FB3CAA_5C71ABAD9378CBAE_2201_UN,7.433295,00000000000000000000000000000000000010000010000100001000000000100100000000010001111101111001011010101100110100010000001011101100110001110110001011011011010010101111010,PYIWFLYCJZVILM-UHFFFAOYSA-N
C1(=NC=CC(=C1)N2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,E0512BC08D4A4721_3CF46FFA6E9CCF46_6041_UN,8.620966,00000000000000000000000000000000000000100010000000000000010000100100000000010101100101110011010110101000100111010001101011100100110011110110001011011011010011101111110,NMTDNMXRNFQTSB-QUCCMNQESA-N
C[N]1N=CC(=C1)C4=NC2=C(C3=C(S2)CCC3)C(=C4N5CCNCC5)C6=CC=C(C=C6)Cl,E0CF4E55D4B9CB33_3320BD86F6312F6E_2201_UN,7.4332933,00000000000000000000000000000000000010000000000100001000000000100100000000010001111101111001011010101101110100010000001011101100110001110110001011011011010010101111010,SLJXECLHGKSFHC-UHFFFAOYSA-N
FC2=C1C=CC=NC1=C(C=C2)NC3CCN(C)C4CCCC34,45333AF9533972C2_F52F39AB7C27D41E_6041_UN,8.541202,00000000000000000000000000000000000000000010000000000000000000000100000000010001100001110011010010101100110110010001101011100100110001110100001001011001010010101111010,YLAASSOWJFDSSK-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCCN2CCCCCC2)Cl)C3CC3,A162345E2022DC80_9CD584A9F330ACC5_7022_UN,7.473402,00000000000000000001001000000000000000000000000000000000000000100000000000010001001001110001000000001001100110010000001001100000110001110110001010011011010110101111010,HNXOAOSMMKVLOI-UHFFFAOYSA-N
N5CC1=C(C=C(C=C1)NC2=CC(=C(C=C2)F)C3CC3)C4(CC4)C5,7764EABD47C3AB3B_231D5F89CDD5C81C_6041_DP,8.876667,00000000000000000000001000000000000000000010000000000000000000100010000000000000001000110011000000101100010100001000001001000100110101110110001011010011010010100111010,PGYLOJCWWYNPGM-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC(CC2CCOCC2)C#C)Cl)C3CC3,2A8135A1C8A96906_9F51DCDC241AB8B9_7022_UN,7.9096594,00000000000000000100001000000000000000000000000000000000010000100000000000000000000000110001000000100001100111010000001000000000110011110110000011010011010111101111110,LYVLPCYFCROZFD-UHFFFAOYSA-N
CC34CC(C=CC2CCN(C1=C[N](C)N=C1)C2)(C3)CCO4,38793A9E37617528_F12A527E276718B9_7019_UN,7.8852863,00000000000100000000000000000000000000000000000000001000010000100110000000010001100101100000011010111000010011011001101011101000110011010110001001011100110011101111110,XIYIFDBZYGUOGL-UHFFFAOYSA-N
CN3CCN(CCOCC1CC2(CO1)CCOCC2)CC3,B7FA5DC7EC1F7725_9BF96812735E50F8_6039_UN,6.8399324,00000000000000000000000000000000000000000000000000000000010000000010000010010001000101100000010110101000010001011001101011100010110010000110001001111000110101111101110,CJOUCSVMNQLDRS-UHFFFAOYSA-N
CC1=C(C3=C(N1CCC(N)C2CC(F)(F)C2)C=CC=C3)C4=CCNCC4,C668970303547AE2_57F053F038A19539_6034_UN,8.546717,00000000000100000000000000000000000000000010000000100000000000100100000000011000101111110011000010111100110110011000101011100100110100100110001011011011010110101111010,VSICCQMBWOTCPD-UHFFFAOYSA-N
C2(=C1OC=CC1=CC(=C2)F)NC3=CC(=N[N]3C)C4CCCO4,66168ACD04EF5473_350663F8EA4FA519_7022_UN,8.364662,00000000000000000000000000000000000000100010000000001000010000100100000000010101100100010000011111000100010101000000001011101100010011110100001010011011110011111111110,UOVUOAIILACFOY-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC3(C)C4CCC(C3)O4,55DBDCC622D566BF_8F2DCAE3C871E04A_7022_UN,7.7876215,00000000000000000000000000000000000000000010000000001000010000000110000000010000101100010011001011001000010110011001101011101100110011110110001011011011110111101111110,CHDUZGPQMIFNJU-UHFFFAOYSA-N
CN(CC1CCNC1)CC2=NC=C(N=C2)NC(CCC)C3=C(C=C(C=C3)F)F,4818371265C1FEAB_3BA43487256C09E1_6041_DP,7.9947596,00000000000000000000000000000000000000100010000000000000000000000100000000000101101101110011010010101000100110010011001011100100110101110110001011011111010110101111010,IKKFTOOQNOFITD-UHFFFAOYSA-N
NCC3(OC1=C(C=C(C=C1)CN2CCNCC2)Cl)CCCNC3,B8099337F0068422_581D9DBC5AAE2B51_6035_DP,8.111801,00000000000000000000000000000000000000000000000000000100000000000010000000010001101011110011000100101001100100011100001011100011110110100110001111011011110101100111110,XKORXZPJRFLOFI-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NCC4=C(C=CC(=C4)C5CC5)F,98C227E845D99A28_847858F1A1895EC1_6041_DP,7.8471756,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110001010010101000010110000000000011100100110101110110001011011011010110101111010,GIYONSRDHAXWOT-NYTJIUQPSA-N
N(CCCC1=CC2=C(C=C1)OCCO2)C(C45CC3(CC(CC(C)(C3)C4)C5)F)=O,23FCBE13930182BE_07876DF4EF060FB4_6038_UN,7.18152,00000000000000000000000000000000000000000010000000000000010000000010000010000000001000010010100000101100110111111101011010000000100010100110000011110001111111111111110,YMJFDVOYZHWBTI-UHFFFAOYSA-N
CC3=C(C1=C(SC2=C1CCN(C)C2)N=C3C4CCCCN4)C5=CC=C(C=C5)C,A81AA6D6FA0BF580_F1983307439F1C41_2201_DP,7.749276,00000000000000000000000000000000000010000000000100000000000000100100000000010001011101101011010010101100110010010001101011100100110000000110011011011111010010101111010,ZMNDICQHUFZLST-UHFFFAOYSA-N
CC4(C)COC3(C[C@@H]2CC(OCC1=C(C)C=C(C=C1)F)C[C@@H]2C3)OC4,CAAF29EFF8EEF2E9_AB2ADA0ABAFEEFFB_6039_UN,8.247697,00000000000000000000000000000000000000000010000000000000010000000010000000100000000000010100000010100100010101001001100010010011110010100110010111100110110101011011110,WDRGMZKHTPHNKV-JJTKIYQPSA-N
N([C@@H]1CCO[C@H]1C2=CC(=C(C=C2)F)F)C(=O)C3C4CCC3CC4,C5E5C6BE7F959628_88058A261F55E105_6038_UN,7.372984,00000000000000000000000000000000000000000010000000000000010000100000000000000000000100010011100111000000110101110000011000000000110011100100000011010011111011110111110,ARONRCBLKFXMPW-SVWQHZFHSA-N
N([C@@H]1CCO[C@H]1C2=CC(=C(C=C2)Cl)F)C(=O)C3C4CCC3CC4,7D108C9C6CE62828_BF88F8910C067A38_6038_UN,7.372968,00000000000000000000000000000000000000000010000000000000010000100000000000000000000100010011100111000001110101110000011000000000110011100100000011010011111011110111110,PHQGQRNFQMWASB-SVWQHZFHSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)F)CC4,005518A6AEE52864_D5BC6662426B48F4_6041_DP,8.317148,00000000000000000001000000000000000000000010000000000010000000100000000000010001101001110011010000101000100110010001101011100100110101110110001011011011010110101111010,SCSBWUOAJYXSKI-HYBUGGRVSA-N
NC2=NN=C(CC1=CC=C(C=C1)F)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,2E85429DBC50D02E_879155CA03B740D5_6034_UN,7.915473,00000000000100000000000001000000000000100010000000001000000000000110000000110101100111010011001010001000011110011000101011101100110001110100001011011111010110101111010,JLTQOUGHGGIQDM-DSUHRAPHSA-N
CCC1=C(C(=CC=C1)F)NCCC3CCN(C2CCN(C)CC2)CC3,A50B6EFB12A56003_FD82E07A3EDD0431_6041_UN,7.871568,00000000000000000000000000000000000000000010000000000000000000100000000000010000101001110011010000101000100100010011101011100000110001110110001011011111010110101111010,VDNMFCUECZOGHO-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2(CCSC2)N3CCOCC3)F,7D41DE213A08A750_1B16ACA954AC77C5_7022_UN,7.7241406,00000000000000000000000000000000000010000010000000000000010000100010000000110001001101111011010110101000000101011001001011100000110011110110001011011111010111101111110,OLSJBVYQIQVYGM-UHFFFAOYSA-N
C1(=NC2=C(C=N1)C3CCC2C3)N[C@@H]4CCN(C)[C@H]4C5=CC(=C(C=C5)F)F,C35A968212E0AD01_C0FABEADA2860F95_6041_UN,8.150561,00000000000000000000000001000000000000000010000000000000000000100100000000010101100101110011010010101100111110010001101011100100010001110100001011011011010010101111010,CVXZFNDIHZMLNL-NUEMCUDVSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3CNCCC3)CC5CCCN(CC4=C(C=CC(=C4)F)F)C5,C4D8518FB2E0502C_22270136AADBCB5D_6034_UN,8.009459,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101100110100010000001011100100110000100110001011011011010110101111010,KKDPDSPUOAIDGA-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)CCOC2)[S](C4=CC3=C(C=C(C)[NH]3)C=C4)(=O)=O,479506D429EAFE9B_99E172A15C721A41_6029_UN,8.621225,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100101001001010100110011001001000011011001100111111011110001011111001010011111111110,RSEKXNQLBVCUBB-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)C2OCCO2)NCC3N(C)CC4(CC3)CC4)C#N,C42618CE5FF3C30A_A6D9DF6B063F6774_6041_UN,7.3259873,00000000000000000000001000000000000000000110000000000000010000100010000010010001101101110011010011101000010111011001101011110000110011110110001011011011010111111111110,LWAYLHKOGMQYMS-UHFFFAOYSA-N
N(C1C2CCC(CC1)CO2)C(=O)C3=C[NH]C4=C3C=C(C(=C4)Br)Br,16822EE3511E1870_8DA7391372FA123B_6038_UN,7.509863,00000000000000000001000000000000000000000000001000000100010000000100000000000000100100010011100111100100110101110000011011000100110111100100001011010011111011110111110,QCKZWADMYFGLOE-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CCC3=C(C(=CC=C3)Br)Cl,95D477258BEF174C_24B7502E67E8B445_6038_UN,7.2350326,00000000000000000001000000000000000000000000001000000000000000000000000000000000000000010011100010000001110100110000011000000000110011100000000011010011001110100111110,XRPUVMULFSQHLG-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(CN3C4=C(N(C)CC3)C=C(C=C4)F)=O,270735A2C2F3F395_7EF4FAF46C78A4E8_6038_UN,8.175703,00000000000000000000000000000000000000000010000000000000000000000000000000010001001001110011110100111100110100110001111011100000110010110110001011011001011110101111110,WIBCUBHKAJHGER-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CCC3=C(C(=CC=C3)Br)F,C55C8D45090E49F9_C14FD9B525AF8E13_6038_UN,7.2350264,00000000000000000001000000000000000000000010001000000000000000000000000000000000000000010011100010000000110100110000011000000000110011100000000011010011001110100111110,RENWZLKSXOPNQF-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CCC3=C(C(=CC=C3)F)Br,8EC81B55AAC0F8EB_E9319A258527CF68_6038_UN,7.235033,00000000000000000001000000000000000000000010001000000000000000000000000000000000000000010011100010000000110100110000011000000000110011100000000011010011001110100111110,XKNOQMYGPSJJLZ-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CCC3=C(C(=CC=C3)F)F,4AFEAE29D36BE0D4_55C03FF3C992FD64_6038_UN,7.2350225,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000010011100010000000110100110000011000000000110011100000000011010011001110100111110,AXWKBTMYLJIPNO-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CCC3=C(C(=CC=C3)Cl)Cl,3FBD29B918667998_63549B0E28580348_6038_UN,7.23502,00000000000000000001000000000000000000000000000000000000000000000000000000000000000000010011100010000001110100110000011000000000110011100000000011010011001110100111110,UWSKZRNFBCRXFS-UHFFFAOYSA-N
CCC2OC1=C(C=C(C=C1C2=O)NCC3CC4CCC3N(C)C4)F,249299701567DE2F_99E285F232B7C2F3_6041_UN,8.184379,00000000000000000000000000000000000000000010000000000000010000000000000010010000101101110111010010101100010110010111101011100001110011110110001111011111111111111111110,XJAGZOWRWKFBBP-UHFFFAOYSA-N
C(C1(CC1)C2CCCO2)=CC4=C(N3CCN(C)CC3)C=CC=C4Cl,1DCE612C7467A43E_AEFD87F4A6487E66_7019_UN,7.2396784,00000000000000000000001000000000000000000000000000000000010000100010000000010001000101110000010010111001000101011001101011100000110011110110001011011010110011101111110,ORRULMWZLDSXNA-UHFFFAOYSA-N
N(C1=CC3=C(C=C1)OC2(CCC2)C=C3)[S](C4=COC5=C4C=C(F)C=C5)(=O)=O,5E56DD1879A106C7_FCD9344D16CCB060_6029_UN,8.573453,00000000000100000000000000000000110000000010000000010001011111001011010001000000010100011100001011110110011100001100011010001100001011111100100011111001100011110111110,IJSHSYVEFCLTKR-UHFFFAOYSA-N
FC2=C1C=NC=CC1=CC(=C2)NCC3CCCN(C)C3,BCA5CD49A16FA483_E622E29826FE5571_6041_UN,8.50054,00000000000000000000000000000000000000000010000000000000000000000100000000010000101001110011010000101100010110010001101011100100110001110110001001011001010110101111010,LPQLSNYYSKTILJ-UHFFFAOYSA-N
CN(C)CC1=NC=CC(=C1)NCC2(CCNCC2)C3=C(C=NC=C3)F,471CE316C1F511CE_C7B3198123FFC43B_6041_DP,7.8531423,00000000000000000000000000000000000000000010000000000000000000100110000000100001101001110011010000101000100100011001001011100100110101110110001011011111010110101111010,QAHIYBHEEFRPJC-UHFFFAOYSA-N
CC1=C(C=C(C=C1)N[C@@H]2CCN(C)[C@H]2C3=CC=C(C=C3)F)CC=C,424F737F316CCAB0_BFA052D911303E7B_6041_UN,8.277435,00000000000000000000000000000000001000000010000000000000000000100000000000010001100101110011010010011000100110010001101001100100000001110100001011011111010110101111010,ZDYHRCHITGFIAR-RTWAWAEBSA-N
FC1=CC2=C(C=C1)N(C=C2C3=CCNCC3)C[C@H]5N[C@H]4CCO[C@H]4C5,44F3D6B2D0EB4560_F4ACB48DA369D4D0_6034_UN,8.580009,00000000000000000000000000000000000000000010000000100000010000100100000000011001001101110011000111111100110101010000001011100100110110100110001001011001110111100111110,YONRRLPQDCGZOW-QSFXBCCZSA-N
CC1=C(C=C(C(=C1)NCC2CCCCC3(C2)OCCO3)Cl)C4CC4,F5BF5565B61CD1F0_5692C3514421F874_7022_UN,7.516076,00000000000000000001001000000000000000000000000000000000010000100000000010000000001100010011000010001001010111001000001010010000110011110110000010010011110111111111110,LNPKBQSYKSUMKF-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC5=CC3=C([N](C)C(=N3)C4CC4)C=C5,28D95448CCA7C2D6_737A41BFAB0FBCB7_6041_UN,7.778128,00000000000000000000001000000000000000100010000000000000000000100100000000010101001101010000010010101100010110000000000011100100000001110100011011011111010110101111010,RLWANOCQIFBCFZ-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3C(N(C)CC3)C4=CC=CC=C4,E3A4B3FD7FC41997_A16677D907DDE0CB_6041_UN,7.986535,00000000000000000000000000000000000000000010000000000000000000100100000000010001101101110011010010101100010110010001101011100100110001110110001011011111010110101111010,NJKFVSZVBXYJBR-UHFFFAOYSA-N
CN4CCC(CNC(=O)C1CC2CC1C3CC23)C4C5=CC(=C(C=C5)Cl)F,B62D0A8B078DFD40_5262B786D8E9B69D_6038_UN,8.109564,00000000000000000001001000000000000000000010000000000000000000100000000000010000101101110011110010001001010110110001111001100000110000100110001011011011011110101111110,WYCOCLJNNNGMQH-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC(C3=N[N](C)C=C3)CC4=C(C=C(C=C4)F)F,C5C58ECBFEA61BF6_D5C78081A2CAA55A_6041_UN,8.554517,00000000000000000000001000000000000000000010000000001000000000100100000000010001100100010001011010000000100100010000000011101100001001110100001010011111000110101111010,GSHGAFKGLJBZOO-UHFFFAOYSA-N
CC1(C)O[C@@H]2CC[C@H]1C[C@H]2OC4=C3N=CC=CC3=C(C=C4)Cl,6E09CEA9D8BFFFBD_BB981614A25AE964_6035_UN,7.65517,00000000000000000000000000000000000000000000000000000000010000000110000010100000000000010000000100100101010110001100101011000111110010100100000101010100100011011111110,JBJATSFHSRXCOE-SGIREYDYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3=NC(=CC=C3)COC4COCC4,81562A3F88E99756_8C7405D7E66B04F0_6041_UN,8.383571,00000000000000000000000000000000000000100000000000000000010000000100000010000101001100100100000110101100010011010000001011000111110011010110011111010111110111111111110,LAGJYKZICMWADO-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NCC3CCSC(C)C3)C,C0AAA8360279F8D0_1AC8FB1B70A5060B_6041_UN,7.9513283,00000000000000000000000000000000000010000010000000000000000000000100000000000000111000011011000000101100010110000001101011000100110001110110011011010111010110101111010,GUSSCJOCARNXCY-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC3(CC3)C4=C(C=CC=C4)F,7FAAAB8485A3E812_66586439EFFC99FC_6041_UN,7.7143283,00000000000000000000001000000000000000000010000000001000000000100110000000010001100100010011011010000000100100011000001011101100000001110100001010011011000010101111010,VOLNFAXMQHZOJS-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NC[C@@H]3[C@H](C(C)C)CCO3)C,883BC040ACB5F0AB_B2C374E44DD8DB79_6041_UN,8.432441,00000000000000000000000000000000000000000010000000000000010000000100000000100000101100010001000110101100010111000000101011000100110011110110011011010111110111101111110,MCEHRGHZEYVMJO-MAUKXSAKSA-N
FC1=C(C=C(C=C1)C2=CN=C(N2C[C@H]3CCCC[C@H]3N(C)C)C4CCNCC4)F,6C60CC77C0FE20EE_FBE36280DA257BFD_6034_UN,8.223257,00000000000000000000000000000000000000100010000000000000000000100100000000110101101101110001010010101000100110010000101011100100110001100110001011011111010110101111010,XJINGGQBTHZDTM-WIYYLYMNSA-N
CC1=C(C2=C(C=C1)N=CC=C2)NC4=C(C=C3CCOC3=C4)[N](=O)=O,3DC99E1600F2CDC3_49E0AFB8D4B9A1D2_7022_UN,8.079939,00000000000000000000000010000000000000000000000001000000110000010100001100000001100100000000001011100110010001000100001111101100001011010100001011111011110011111111110,GLEVVAODVXEVFY-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC34CNC(C3)CO4,0F4900B3C0AAEE88_788ECB4105399B22_6041_DP,7.0154796,00000000000000000000000000000000000000100010000000000100010000000110000000000100101100010011000111101100110111011000000011000100110111110110001011000111110111101111110,HDFPUAIOUUAXJB-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCCC2CCCOC2)F)CC3,9ED60ACFD520D2D4_D4E95C66A08D374D_6041_UN,7.0581636,00000000000000000001000000000000000000000010000000000000010000000000000000010001101001110001010000101000100111010001101011100000110011110110001011011011010111101111110,UDCQERQJLGRJJT-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=CC=N2)NCC3(C(C)(C3)C)C4=C(C=C(C=C4)F)F,15CD98DAE5958641_E145DB7F9E05D734_6041_UN,8.203031,00000000000000000000001000000000000000000010000000000000000000100110000000100001001000010011000000101100010110001001100001000100010001110100011011000111010110101111010,AIFGCHCJMJCKPN-UHFFFAOYSA-N
CC1=C(C2=C(N=C1)C(=CC=C2)C)NCC3CCCC(O3)C4CC4,89A28A5968FE321D_5E663F837EAFFABA_6041_UN,7.348253,00000000000000000000001000000000000000000000000000000000010000100100000000000000101000000011000100101100010010000000001011000100110011010100001011010111110111101111110,ODCLHXGAMXFYRD-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC34CC(C3)CCO4,BF44BA4D6C7777AF_32440D21583E994C_6041_UN,7.689514,00000000000100000000000000000000000000000010000000001000010000000110000000010000101100010011011110101100010101001000001011101100110011110110001001011001110111101111110,MACVZKCBDZHGNM-UHFFFAOYSA-N
CN(C)CC[N]1C=CC2=C1C=C(C=C2)NCC3(CCC3)C4=C(C=NC=C4)F,D218C94511662442_296C652CA47454A9_6041_UN,7.9270463,00000000000100000000000000000000000000000010000000000000000000100110000000110001101101110011010010101100010100011001101011100100110001110110001011011111010110101111010,RKTUOOLAIOZCQF-UHFFFAOYSA-N
CC1(C)CCCN(C1)C2=NC(=NC=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,51D63DB3F3B5DA68_AD4436A65B8D5E3F_6041_DP,7.7010775,00000000000000000000000001000000000000100010000000000100000000100110000000110100101001110011000000101000101110011001101011100100110101110110001001011111010110101111010,HUJCRYSJGUXAAI-AZUAARDMSA-N
N(CC2=NC1=C(C=CC(=C1)F)O2)C(C45CC3(CC(CC(C)(C3)C4)C5)F)=O,D6C8C38E16F5EC87_823EF936DD23E7C6_6038_UN,8.020532,00000000000000000000000000000000000000000010000000000000010000000110000000000001001100010010100110001100010110111001010011000100100010100100001001000001111110111111110,VIWLLNGJHLGNSK-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2CCO2)NC4=C(C=C(CN3CCN(C)CC3)C=C4)F,029C67ED70120648_F118D90E3FF99177_6041_UN,7.6405883,00000000100100000000000000000000000000000010000000000000010000100000000000010001000001110000010000101000000101010001101011100100110011110110001011011011110111101111110,WVDYLPHUSNFQRK-UHFFFAOYSA-N
C1(=C(C=CC=C1)C(F)(F)F)NCC(=O)C2C4CC3CC(CC2C3)C4,4FD0ABB6BD5E6223_BB79D7D970849B56_7022_UN,7.3747888,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000000000000100001100011100001000000000000000100011110000000011000011111110100111110,CPZRYJBTRKXDAP-UHFFFAOYSA-N
FC2=C(C=C1C(=CC=NC1=C2)NC(C[N]3C=NC4=CC(=C(C=C34)C)C)C5CC5)F,50B3F0E6FCB3B39A_1C737A2B7A9A4F4F_6041_UN,8.671911,00000000000000000000001000000000000000000010000000000000000000000100000000010101100101010011000010101100110100010000000011100100110001110100001011011111010110101111010,NXDKBNZVXZSEQK-UHFFFAOYSA-N
O(C2C1CC3C(C1)C(=O)OC23)CC4=NC5=C([N]4CC)C=CC(=C5)F,2D04A75ECCC38731_0423B3E6B9A5F65E_6039_UN,8.268681,00000000000000000001000000000000000000100010000000000000010000000100000010010101000101010000000110001100010111010010000011110111110000100110001111101010111111111111110,SGVQARCLGUSPLQ-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)NCC23CC(COC)(C2)CO3)C4[C@@H]5CNC[C@H]45,288EDC1FE3846803_65BC9553E133EF45_6041_DP,7.736353,00000000000100000000001000000000000000100000000000000000010000000110000000000101101101100111010110101000010011011001000011100010110111010110001001001101110111111111110,XPEUCHSPLSGYTE-KQQLKSJTSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC4O[C@@H]3CCCC[C@H]3C4,02AB4C7C9A27915C_51F6202035F439B0_6041_UN,7.904001,00000000000000000000000000000000000000000010000000001000010000000100000000010000101100010010011110001100010100000000001011101100110011110100001001011001110111101111110,GJEJLJPCMILZKZ-ZIHDAQAOSA-N
CCC4CCC1=C(C3=C(N1CCCC2(C)CC2)C=CC(=C3)C)C4,73666E9D4A3E7AD0_1551470FEACB466D_6034_UN,8.167569,00000000000000000000001000000000000000000000000000000000000000000110000000010000000101000000000010001100010010011011101001100100110000000100010011011100010110101111010,IELOCAMYSONCMN-UHFFFAOYSA-N
FC1=CC(=CC=C1)C2=CSC(=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,159B59DCA56B77A1_37FC4B1A2598937C_6041_UN,8.267902,00000000000000000000001000000000000010000010000100001000000000100100000000010001111101011011011010101000000100010000001011101100110001110110001011011011010110101111010,TUAAMKAONLFMEH-HXOBKFHXSA-N
CC(=O)CC1=C(C=C(C=C1)F)NCC2C3CC(C2)C4CC34,A2D763FEDEF08CA4_6E65B0ED4F3A16E2_6041_UN,7.751108,00000000000000000001001000000000000000000010000000000000000000000000000000000000001000010011000010001000010100000001000000000000110011110000000011000011111110101111110,QHAFBJKEFROFQL-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NCC4(CC4)C5=C(C=CC=C5F)F,34003BA091281596_E0701A6C1E556D2B_6041_DP,8.00178,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000010110001000000011100100110101110110001011011011010110101111010,MTSGNGSFNJGNAV-ZHZUQJFRSA-N
CC1=C(C2=C(C=C1)C=C[NH]2)NCC(C)(C)C3CCOCC3,555E6A4F618E616F_F9F73270936DD483_6041_UN,7.351948,00000000000000000000000000000000000000000000000000000010010000000110000000100001001100100001000010101100010011001001101011000100110111010110011011010111010111101111110,WVXNZJVLIRTZOM-UHFFFAOYSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)C[C@@H](CC)NC4=NC=C(C=C4)Br,85BDD1910CA021B3_DA79CC87E650521A_6034_UN,8.2556305,00000000000000000000000000000000000000100000001000000000010000000100000000010101001101110001000110101100110101010010101011100100110111110110001001011001010111101111110,BZHYOUHZXAZGKM-MRTLOADZSA-N
FC1=CC2=C(C=C1)C=CC(=N2)NCC3C(CCC)CCC3,563CF1677F78271A_65980AEDA48A5889_6041_UN,8.185077,00000000000000000000000000000000000000100010000000000000000000000100000000000100001000010011000010101100010110000011001001000100110001110100001001010011010110101111010,GDHNWCSSKQNENK-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=NC=C(C=C1)NCCOC2CCCCO2,CE4A0F9116A851E1_0078EA71389A6577_6041_UN,8.360049,00000000000000000100100000000010000000000000000000000000010000000100000000100001001000100000010100101000100001011000001011010011110011010110011101011101010111111111110,WNMIDSZFLSVNHM-UHFFFAOYSA-N
C2(=C1OC=CC1=CC(=C2)F)NC5=CC3=C([N](C)C(=N3)C4CC4)C=C5,1386BCF996958234_D5E0B572C42897E8_7022_UN,8.416883,00000000000000000000001000000000000000100010000000000000010000100100000000010101100101010000010110000100010110000000000011100100000001110100001011011011100010101111110,UXTXXZUWYPGLKG-UHFFFAOYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC(C#N)C4=C(C=C(C=C4)F)F,FD58660FB8C12C1C_5D91C0E138F9C770_6041_DP,7.2935786,00000000000000000000000000000000000000100110000000000000000000100100000000000101100100010011000010100000110100010000001011000100010101110100001011010011000010100111010,CYKOZXWJUKBSBG-CWQLYJFUSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CCCN(C2)C3CCCC3)F,F974C502F1349A46_2AC2F18B179B242A_6041_UN,7.706205,00000000000000000000000000000000000000000010000000000000000000100000000000110000101001110011010010101000000100010001001001100000110001110110001011011111010110101111010,BICCMELDNLRYRW-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)N[C@@H]2CNC[C@H]2C3=CC=CC=C3)F)C#N,ABD1CFF06F1DD600_DE50DF75C3B933B2_6041_DP,7.808273,00000000000000000000000000000000000000000110000000000110000000100000000000000001101100110011000010001000100100010000000001000100010101110110001011000011010010101111010,BSLCZDXNICPMPC-DOTOQJQBSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC3C4(CC3)CCCCC4,22CB9E6C18A10A5F_E77C919278516EA9_6041_UN,8.254332,00000000000100000000000000000000000000000010000000000000000000000110000000000000100000010011000000100100110100011000001001000100110001110100001011010011000010101111010,OZMIRCNUKNONIY-UHFFFAOYSA-N
N3CCC(C[N]1C=C(C=N1)NCC(N(C)C)C2=C(C=CC=C2F)F)CC3,63CC22D58991028F_E77A06C98C5728E0_6041_DP,8.305398,00000000000000000000000000000000000000000010000000001000000000000100000000110001101101110001011010101000100100010000101011101100110101110110001011011111010110101111010,WNCWAWWIUHMBRJ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CC(C2)C3CC3)Cl)C4CC4,A2161BF16A895069_F146ED85E07A3D6C_7022_UN,7.821678,00000000000100000000001000000000000000000000000000000000000000100000000000000000001000010010000000001001000110000000001000000000110001110000000010010011010110101111010,ZIRKWXRFMPOKIW-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)COCC2)[S](C4=C3C=C[NH]C3=CC=C4)(=O)=O,39882FFD1399F154_F0E3B5A76C3A8B97_6029_UN,8.66757,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100101001001010100110011001001000011011001100111111011110001011111001010011110111110,XIWPBZNRJVIIJE-UHFFFAOYSA-N
CC1=C(C(C4=C(N1CC2=C(C=CC=C2)CC3CCNCC3)C(=CC=C4F)F)=O)C,C13FC24947E40843_B924EDEB87E5182D_6034_UN,8.603371,00000000000000000000000000000000000000000010000000000000000000000100000000010000001001110001000001101100110110010100101011100101110000100110001111011111111110101111110,GZDKQDOKVDJTCP-UHFFFAOYSA-N
C1(=N[N](C=C1)C2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,212ABC27BA069F7C_E7B33E5B87AD3045_6041_UN,8.356807,00000000000000000000000000000000000000100010000000001000010000100100000000010101100101110011011011101000100111010001101011101100110011110110001011011011010011101111110,JCPMAZBGSSFVCW-MJGOQNOKSA-N
FC1=CC2=C(C=C1)C=CC(=N2)NC3CCCC(CC)C3,3544405962A05579_ED98E7248C56BDFC_6041_UN,8.325053,00000000000000000000000000000000000000100010000000000000000000000100000000000100000000010011000000100100110110010010101001000100110001110100001001010001000110101111010,UQRDCWAJRCJAOA-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3C4(CCCC3)CCCCC4,10F2B1690A1C94D6_4EFEB09B55FB14C3_6041_UN,7.620391,00000000000000000000000001000000000000000010000000000000000000000110000000010101000101010011010010000100111100011000001011100100110001110100001011011011000010101111010,QHAYUTNBFBSLDC-UHFFFAOYSA-N
N(C1C4C2CC5C3CC(C1C23)C45)C(C6=C(CC)[N](N=C6)C7=CC=C(C=C7)F)=O,0180E1E4EC6E0C5B_BC950788CB572706_6038_UN,8.35285,00000000000000000001000000000000000000000010000000001000000000100100000000010000100100010001101011000100010100110010010011101100110001110100001011001011001110101111110,GJYZMQJXJJSSEB-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NC[C@H]4[C@H](C3=NC=C[N]3C)OCC4,7A3C3A9A966B482F_F90C8A373BB6D01C_6041_UN,7.24694,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101010011010111001100010101000000001011100100110011110110001010011011110111101111110,XOMNCQNXTLXJKG-YVEFUNNKSA-N
C1CC(CCN1)C2=CN(C3=C2C=CC=N3)CCCC#C[Si](C)(C)C,2B529E22616B970E_4C77F6A236BB808C_6034_UN,7.268736,00000000000000000100100000000010000000100000000000000000000000100100000000110100001101100001010010101100110010011000001011100100110000000110011001011101010110101111010,NZDAUJFXTQYNSA-UHFFFAOYSA-N
CCC2OC1=C(C=C(C=C1C2=O)NCC3C4CCC(C3)C=C4)F,696E3CEC1E1FE55C_03FB95DA55678A14_6041_UN,8.117148,00000000000000000000000000000000000000000010000000000000010000000000000010000000001100010111000010011100010100000110001000000001110011110100000111010011111111111111110,OXPSQZWWNXNXTQ-UHFFFAOYSA-N
COC(OC)C1=CC(=C(C=C1)F)NCC2(C)CCC3(CC2)OCCO3,68E16F1D735A55E0_351A264E53AA0429_6041_UN,7.150636,00000000000000000000000000000000000000000010000000000000010000000010000010000000001100010011010010001000010101001001101010010010110011110110110011110111110111111111110,RKWOJDNSLILTSO-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2CCCN(C)[C@H]2C3=CC=N[N]3C)Cl)C4CC4,D61DAAF6416299BF_8FD1139547D6426B_7022_UN,7.8791747,00000000000000000000001000000000000000000000000000001000000000100100000000010001101101110011011010101001000110010001101011101100110001110110011011011111010110101111010,KYXOFODGICPPCZ-HRAATJIYSA-N
CC1=C(C(=CC=C1)CC#N)NC(C2CNC2)C3=CC=C(C=C3)F,FEB0CC85F6618C3E_9D8C6FF7E9B27AE3_6041_DP,7.0362945,00000000100100000000000000000000000000000110000000000100000000000000000000000000101000110010000000001000000110010000000001000100000101110110001011000011010110101111010,OCPNKBZROGRJNT-UHFFFAOYSA-N
C1(=C(C=CC(=C1F)F)Cl)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C,6819915C51FDA227_8BD98C6AB1A31258_7022_UN,8.601141,00000000000000000000000000000000000000000010000000000000000000100100000000010101101101110011010010101001000110010001101011100100110001110110001011011111010110101111010,TZZNOWHEYNHSAJ-APPDUMDISA-N
FC1=C(C(=CC=C1)C[N]2C=C(C=N2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5)F,CBA23E9703FEB128_317BE36B317CEE0A_6041_UN,8.435211,00000000000000000000001000000000000000000010000000001000000000100100000000010101101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,YZOKQNLTZQLPFC-MWTRTKDXSA-N
FC2=C1OC=CC1=C(C=C2)NCC3CCCC(CC)CC3,6967C826655A656D_B67CE7BE06241298_6041_UN,8.110195,00000000000000000001000000000000000000000010000000000000010000000000000000000000001100010011000011001100010110000010101000000100110001110100000000010001110110101111110,KPKNNIQUMBNJHA-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCCC3CCC(C)(C)CO3,8C0303C2F4A5AC7E_3C0DF153497DDC30_6041_UN,8.059498,00000000000000000000000000000000000000100010000000000000010000000110000000100100001000010001000001101100110111011001101011000100110011110110011011010111110111101111110,GWVXBRCPJPJLFS-UHFFFAOYSA-N
CC4=CC1=C(C=C(C=C1)NCC2(CCCO2)C3CC3)[NH]4,8B6693CD331D9E75_923BB2265539BE89_6041_UN,7.715764,00000000000000000000001000000000000000000000000000000100010000100110000000000000101100000011000110001100010001001000001011000100110111010110001000010001110111101111110,MXKIIGXWEXQZQU-UHFFFAOYSA-N
CC2=C1C(=NC=CC1=CC=C2)NCC3(C(C)(C3)C)C4=C(C=C(C=C4)F)F,05ACD6E4F4141C60_E7EC7484FDCB46FE_6041_UN,8.357772,00000000000000000000001000000000000000100010000000000000000000100110000000100100001000010011000000101100010110001001100001000100010001110100011011000111010110101111010,AMKGCHHCZXRGGJ-UHFFFAOYSA-N
CCN3CCC1=C(C(=CC(=C1)NC2CCCCC2N(C)C)F)C3,1816DC78289C6B0A_F757A7CC4F1E0F01_6041_UN,7.2152634,00000000000000000000000000000000000000000010000000000000000000000000000000110001000001110011010000101100110110010010101001100000110001110110011011011111010110101111010,XWGUECSLOBZZPK-UHFFFAOYSA-N
C[N]1N=NC2=C1C=CC=C2NC3C4CC5CC3CC(C4)(F)C5,0CC22935BB437EB7_52DB3B5CE09A3F56_6041_UN,7.6678624,00000000000000000000000000000000000000000010000000001000000000000110001000010101100100010010011010000100010100001000000011101100101001110100001001001001000010101111010,LLGRNVUWNGUVDV-UHFFFAOYSA-N
C2(=C1C=CN=CC1=CC=C2)NCC3CCCN(C)C3C4=CC(=CC=C4)Cl,09B7061C18034F43_1ECE336CA332291A_7022_UN,8.379976,00000000000000000000000000000000000000000000000000000000000000100100000000010000101001110011010000101101010110010001101011100100110001110110001001011011010110101111010,STXXSXBISWFJOX-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC35CC4CC(CC(C3)C4)C5,B2E7A58A88243A06_4FD8CB21F62A6F0B_6041_UN,8.078819,00000000000000000000000000000000000000000010000000001000000000000110000000010000101100010010011010001100010100001000000011101100100001110100001001001001010110101111010,LLVIMYRQZRYNEA-UHFFFAOYSA-N
FC2=C(C=C1C=COC1=C2)NC3=CC=CC(=C3)C4CCN(C)CC4,3598D0FC737A0CEE_1E944E2293AE9735_6041_UN,7.8736715,00000000000000000000000000000000000000000010000000000000010000100000000000010000000101110000010010101100010100010001101011100100110001110110001011011011110010101111110,FBEHUVXWVDDQHC-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C(=O)OCC2)NC3=CC=CC4=C3[N](C)C=C4,2E6B02C46E0D402A_EFBFAFBF984AFB54_6041_UN,8.527678,00000000000000000000000000000000000000000000000000000000010000000100000000010001000101000001010010100100010001000000001011110101000011010100001111011001011011111111110,AUKBQASKBSMNOS-UHFFFAOYSA-N
N(CC12CCC(CC1)CO2)C(=O)C3(CCC3)C4=C(C(=CC=C4)Cl)F,99FC90F24351C382_6F7C2680A44A9BFC_6038_UN,7.505919,00000000000100000000000000000000000000000010000000000000010000100010000000000000001000010011100100101001010101101000011000000000110010100110000011010011111111110111110,AIDBNRNJZDPCIS-UHFFFAOYSA-N
COC1=CC2=C(C(=C1)F)C=CN2C[C@H]3[C@@H](CNC3)C4CCOCC4,2A76BF017BC448BC_67D49FDA5D1BFDD9_6034_UN,7.8492465,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011010011101100010101000100001011100111110010100110001101011011110111111111110,FDKJJJUKIFRRJA-YOEHRIQHSA-N
CC1=C(C=CC2=C1CCC2)NC[C@@H]3OCCN(C)[C@H]3C4=CC=CC=C4,9FE969362950110A_EE36EE26BD1A6A92_6041_UN,7.7750382,00000000000000000000000000000000000000000000000000000000010000100000000000010000101001100001010110101100010011010001101011100100110011010110001011011111110111101111110,QABHYKBKJHCJCU-VXKWHMMOSA-N
CN(C)CC1=C(C=CC(=C1)NC2C3(CCNC2)CCOCC3)F,393B6100151BA657_E28445D05F4D06D6_7022_DP,7.2231894,00000000000000000000000000000000000000000010000000000010010000000010000000100001001001110011010000101000110101011001001011100000110111110110001011011111010111101111110,DWOGAEOUOUBOOE-UHFFFAOYSA-N
C(C2=NC1=C(C=CC=C1)[N]2C35CC4CC(CC(C3)C4)C5)=CC6=C[NH]C7=CC(=C(C(=C67)F)F)F,C4733DE052704501_E621FD25C5DB7FE7_7019_UN,8.654829,00000000000000000000000000000000000000100010000000000000000000100110000000010101000101010000000010010100010100011000000011100100100001100100001011001011000010100111010,YQCFQQCDONZFJY-UHFFFAOYSA-N
C1(=CC(=CC=C1)CN2CCOCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,A165A843D5E1CC2A_678F563BCA586B92_6041_UN,8.4283695,00000000000000000000000000000000000000000010000000000000010000100000000000010001100101110011010110101000100111010001101011100100110011110110001011011011010111101111110,PNXMITXVKGEXJE-YADHBBJMSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC3CCCC(C)CC3,031766483C91AC4C_D23B01F637204378_6041_UN,8.101196,00000000000000000001000000000000000000000010000000000000000000000100000000000000101000010011000000101100010110000001101001000100110001110100001011010111010110101111010,WWGQOVLEEOUFGS-UHFFFAOYSA-N
C[C@@]2(COCC1=CC(=C(C=C1)F)C)COC[C@@H]3CCCN23,55A2411A58F947E4_234C3B5840E2B9AA_6039_UN,7.9462395,00000000000000000000000000000000000000000010000000000000010000000010000000000000000101110100000110101100010111011001101011100010110000100110000011011110010111111111110,ORWWNUWOAPMKTH-DOTOQJQBSA-N
C(C23CC1CC(CC(C1)C2)C3)=CC4=C[N](C)N=C4C5=C(C=C(C=C5)F)F,67329AC3EB0E8FCA_A820B7AC212A02D1_7019_UN,8.010738,00000000000000000000000000000000000000000010000000001000000000100110000000010000100100010000011010010100010100001000000011101100100000100100001011001010000010101111010,QFFDTLKNOVGVKZ-UHFFFAOYSA-N
NCC(COC1=C2C(=CC=C1)OCCNC2)C3=CC(=CC=C3)Cl,D980822D8DE22F61_9945FFC9E9E89AC5_6035_UN,8.075614,00000000000000000001000000000000000000000000000000000000010000000000000000000000001010110110000101001101110101010100001011000111110110100110001111010001110101110111110,HFDLMGSNVORZNI-UHFFFAOYSA-N
NCC(COC1=C2C(=CC=C1)OCCNC2)C3=CC(=CC=C3)Br,F28D07589F29EC4C_5D11BB6B0C60455E_6035_UN,8.075601,00000000000000000001000000000000000000000000001000000000010000000000000000000000001010110110000101001100110101010100001011000111110110100110001111010001110101110111110,ATUNANDYCIXQLU-UHFFFAOYSA-N
NCC(COC1=C2C(=CC=C1)OCCNC2)C3=CC(=CC=C3)F,149D18CA4E552FCA_913FABE0635680EE_6035_UN,8.075596,00000000000000000001000000000000000000000010000000000000010000000000000000000000001010110110000101001100110101010100001011000111110110100110001111010001110101110111110,ZKCYVKUMYSOGKX-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3NCCN(C)C3)Cl,BD053ECE8853ED2F_E9D4495F32BBECA7_6034_UN,7.7683573,00000000000000000000000000000000000010000000000100000000000000000100000000010111111101111011010010101001101110010001101111100100110101110110001011011111010110101111010,BMIXTDNVRACEDR-UHFFFAOYSA-N
CC3=CC1=C(C=C(C=N1)NCC2CCCCN(C)C2)[NH]3,7072F6D054C31C5B_7BA658AA8A18DDDD_6041_UN,7.656371,00000000000000000001000000000000000000000000000000000100000000000100000000010001101101100011010010101100010010010001101011100100110101010110001000011101010110101111010,JZBMCGLPUORYJI-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(C(CC)C3=CC=C(C=C3)F)=O,C4EEFB881E0BE8CB_322E506F072148C5_6038_UN,7.8919725,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001000110100110010011000000000110000100000000001010001011110101111110,MXYHHZHMDUIDKG-UHFFFAOYSA-N
CN5CCCN(CC1=C(C=C(C=C1)NCC2CC3(C2)C4CCC(C3)C4)F)CC5,3E3B4DB8D5AEC2F6_6F16FE4D05079411_6041_UN,7.5615263,00000000000100000001000000000000000000000010000000000000000000000010000000010001101001110010010010001000010110011001101011100000110001110110001011011011010110101111010,DLOZNKFDRVVONO-UHFFFAOYSA-N
C1(=CC=C(C=C1)CN2CCN(CC2)C3CC3)NC4=CC(=C(C=C4Cl)C5CC5)C,AC75E64209C80515_8A39E9FFFFC9527F_7022_UN,8.194819,00000000000000000000001000000000000000000000000000000000000000100000000000010001000001110000000000101001000110010000001011100100110001110110001011011011010110101111010,DPNFCBOJRGNTEA-UHFFFAOYSA-N
CN(C)CC1=CC(=CC=C1)NC3=CC2=C(OCCNC2)C(=C3)Br,8E72F525DC119C5C_E2B46AE932297923_7022_DP,7.1979046,00000000000000000001000000000000000000000000001000000000010000000000000000100000001001110001010101001100110101010101001011100100110111110110001011011101110111101111110,JEJNGOIOSKEREJ-UHFFFAOYSA-N
FC1=CC=C(C=C1)C3=C[N]2N=C(SC2=N3)NC[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,689BBBF7A274E9F1_D9C78675943A77A9_6041_UN,8.6665945,00000000000000000000001000000000000010000010000100001000000000100100000000010101111101011011011010101100011100010000001011101100110001110110001011011011010110101111010,WMDZHBKZCFHENM-IERDGZPVSA-N
CC1=C(N=C(S1)NCC2N(C)CC3(CC2)CCC3)C4=CC=C(C=C4)F,469A9CF31C1E2DF7_D31B301DDE712C81_6041_UN,7.3970623,00000000000100000000000000000000000010000010000100000000000000100110000000010101011101111011010010101000011110011001101011100100110001110110001011011111010110101111010,VQYBMPUJPONMML-UHFFFAOYSA-N
N4CC1=C(C=C(C=C1)NCC2(CN(C)C)CCCC2)C3(CC3)C4,9ACE43C85B6C7387_9D79A16E3A1A4E2D_6041_DP,6.7808867,00000000000000000000001000000000000000000000000000000000000000000010000000100000101001100011010010101100010010001001001001100000110101010110001011011101010110101111010,STJWELDIRFFJQC-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(=O)C[N]4C=CC5=C4C=CC(=C5)F,1D9E664E036776C0_AEAD77E9220C8F84_6038_UN,8.066973,00000000000000000001001000000000000000000010000000000000000000000100000000010001001101010011100110001100110100110000010001100100110010100110001001001001011110100111110,BGPCSSYAKLTLHM-UHFFFAOYSA-N
CN1CCC(CC1)[N]2N=CC3=C2N=CC(=C3)NC4C(C)(C4)C5=C(C=CC=C5)F,40B86E496D98B211_43208365263E8F7B_6041_UN,7.7730494,00000000000000000000001000000000000000100010000000001000000000100110000000010101100101110010011010101100110100011001101011101100110001110110001011011111010010101111010,XKGSLWBEHAISBH-UHFFFAOYSA-N
CN5CC(C1=NN=C(C)N1CC3(CC2CO2)CCCC3)C4(CNC4)C5,D1A3CAF752626CEB_FAF45CA5F1ED3BB3_6034_UN,7.038452,00000000100100001000001000000000000000100000000000001000010000100110000000010101101101100011011010001000010011001001101011101000110010000110001010011111110111101110110,BPKIRLYQLGSKPM-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[NH]C3=C2CSCC3)NC4=C(C=C(C=C4)[N](=O)=O)F,7176DEB4CC1D8858_DC443EECB4FFC7C2_6041_UN,8.116215,00000000000000000000000010000000000010000010000001000000100000010100001100000000000100111011001010100110110100010000001111101100111101110110001011011011010010110111110,FSPRUSSMOKKRFX-UHFFFAOYSA-N
C2(=C1C=C[N](C1=CC=C2)CCN3CCCC3)NC4=CN=C([Si](C)(C)C)C=C4,D1E9A53BFC4A75D8_284E87C6BA40DEDB_6041_UN,7.566701,00000000000000000000100000000010000000000000000000000000000000000100000000110001100101100000010010101100010000011000001011100100110001010110011001011101010110101111010,ZUXYLUPEWIPQAG-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC3CCCC(C)(C)O3,EF47E1682D4F4540_283FCFF30439D2E3_7022_UN,8.3543825,00000000000000000000000000000000000000000010000000001000010000000110000000110000101100010011001110101000000110011001101011101100110011110110001011011111110111101111110,MOVKXVOOOZNVAT-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3C(CC3)C4=CC=CC=C4,9EE842E13717A887_DC423C5A9633CC51_6041_UN,7.946625,00000000000100000000000000000000000000000010000000001000000000100100000000010000101100010011011010001100010100000000001011101100110001110100001001011011010110101111010,DNSQKCNPESJXMS-UHFFFAOYSA-N
CC1=NC(=C(C(=C1)C)F)N[C@@H]2[C@@H](C(C)C)CC[C@@H](C2)C,75AE141420E6E770_26FEC23D4CC951B7_6041_UN,8.783055,00000000000000000000000000000000000000100010000000000000000000000100000000100100000000010011000000100000100110010001101001000000110001110100011011010111000010101111010,DFOJBHUSQCGOHX-GLQYFDAESA-N
C1(=CC2=C(C=C1)C=C(Cl)C=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,22AF35DAD7411FA9_A66A8F156A918630_7022_UN,8.376771,00000000000000000000001000000000000000000000000000000000000000100100000000010101101101010011010010101101010100010000001011100100110001110110001011011011010110101111010,JFCLQSBMMKDPLK-JPYJTQIMSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)N[C@H]3C5=C(OC4(C3)CCCC4)C=CC(=C5)F,BF20D258B9767615_B2158DA844585A06_6041_UN,7.96772,00000000000000000000000000000000000000100010000000001000010000100110000000010101100100010001011011100100110100011100001011101100110011110100001011011111100011101111110,YPZVFBKRRPYMIC-HXUWFJFHSA-N
O(C3CCN(CC1=CC=CC=C1)C2(CC2)C3)CC4=NC(=CS4)C(C)(C)C,9677EE7E2074C1D1_3FDD41D1A7858274_6039_UN,8.227935,00000000000000000000001000000000000010000000000100000000000000000110000000110000010101101000000111101000010001011000001011100111110010000110011101011100110111101111110,KIIRLPVPVVLKBW-UHFFFAOYSA-N
N(C(CF)C1=CC=C(C=C1)F)C(=O)CC2CC3CC2C4CC34,B73440E9848F4621_25603FBEC3301C75_6038_UN,8.292703,00000000000000000001001000000000000000000010000000000000000000000000000000000000000000010001100010000000110100110000010000000000110010100000000001000001011110100111110,JIOFCGZJGPYFHC-UHFFFAOYSA-N
ClC1=CC4=C(C(=C1)C=C[C@@H]2CCCO[C@H]2C3=NC=C[N]3C)C=CC=C4,837D66777C703EE7_CF2682338D0D5EF2_7019_UN,8.449512,00000000000000000000000000000000000000100000000000000000010000100100000000010101000101010000010110110101010101000000001011100100100010100100001011011010110011101111110,SHFBPTRTTIXXDJ-MGPUTAFESA-N
CN(C)CC1=C(C=C(C=C1)NC2CCOC23CCCCC3)F,81FEBC531120BAEA_029AD0F165E9EDF8_7022_UN,7.477562,00000000000000000000000000000000000000000010000000000000010000000010000000100000000101110011010111001000110101011001001000100000110011110110001011011111110111101111110,ZYUAJWFINPGCIV-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@H]2[C@H]3O[C@@H](C2)[C@@H]4C[C@H]34)F)[N]5C=CC=C5,E7FE84BA7E2B18F2_F439BD9C5E651BA8_6041_UN,7.7164,00000000000000000001001000000000000000000010000000000000010000100100000000010000001101010010000011101000010100000000000011100100110011110100001011001011110111101111110,SCXYXDPQOBMZCK-MHPFDCNVSA-N
CCC(C)C1=CN(C2=C1C=C(C=N2)Br)CC3(F)CNCC3C4=CC=CC=C4,15A2B4FBCDDA3229_24269A5BDE360BC2_6034_UN,8.52297,00000000000000000000000000000000000000100010001000000000000000100110000000010100101101110011000010101100010100001011000011100100110000100110001001001111010110101111010,SNLOQABTIZQLET-UHFFFAOYSA-N
CN1C4CCC1CC(NC(=O)C2(CCC2)C3=C(C=CC=C3F)F)C4,0B7A39F3396DD014_FF980A7D608C40FA_6038_UN,7.660591,00000000000100000001000000000000000000000010000000000000000000100010000000010000100101010011110010100000110110111000111001100000110001100100001011011011001010101111110,RFJPUPJBIJKCJE-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3CCCCN(C)C3,6E20A78795AC32EA_492802CF3F3D2C66_6041_UN,7.595532,00000000000000000001000000000000000000100010000000000000000000000100000000010100101001110011010000101100010110010001101011100100110001110110011011011111010110101111010,PLXMKNYXQRDPGM-UHFFFAOYSA-N
CC(NC(=O)C1CC2CCC1C2)CC3=C[NH]C4=C3C=C(C(=C4)F)F,191539E0760C48EE_C2F6163E9AC5FD0B_6038_UN,7.7077703,00000000000000000000000000000000000000000010000000000000000000000100000000000000000100010011100010000100110100110001011001000100110100100100001011010011001110101111110,CTTBQPRNYLSMBC-UHFFFAOYSA-N
C(C1CCC2(CC1)OCCO2)=CC3=C([N](C)C4=C3C=CC=C4)Cl,727FBAB2709B5CCB_D19F77A8CD2428F3_7019_UN,8.505599,00000000000000000000000000000000000000000000000000000000010000000100000010010000000101010000010010010101010101001000001011110100110010100110000011011010110011111111110,UUUMFMCMSVZVAO-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CCCC3CC3(C)C)C4CCNCC4,E2B8595CCD3FF942_FAC0AA467CEDC28A_6034_UN,8.662925,00000000000000000000001000000000000000000010000000000000000000100110000000110000001101110001000010101100110110011001101011100100110000100110001001011111010110101111010,FWTMTGYKWWXKIO-UHFFFAOYSA-N
COC1=C(C=C(C=C1)NC2C5C3CC6C4CC(C2C34)C56)C(F)(F)F,D67C232A99D6B09A_85A6000EC26349AE_7022_UN,8.753117,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000000001010010000100011100001100000000000011110001110000000111000011100011101111110,QQPUXYSNMYOLKE-UHFFFAOYSA-N
N(CCC12CC(C1)CO2)C(=O)C3(CCC3)C4=C(C=CC(=C4)F)F,3AD61AB183E8F006_2D171E4016513218_6038_UN,7.5517693,00000000000100000000000000000000000000000010000000000000010000100010000000000000001100010011100011001000110101111000011000000000110010100110000010010011111111110111110,DQFKGJKMDNQMFU-UHFFFAOYSA-N
CC1=C(C(C4=C(N1CC3(CC2=CC=CC=C2)CCNC3)C(=CC=C4F)F)=O)C,CB1BA954A1A309D7_9D785580131535F4_6034_UN,8.534331,00000000000000000000000000000000000000000010000000000000000000000110000000010000101101110011000011101100110110011100101011100101110000100110001111011111111110101111110,FGIUQXIVDJDKJB-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2C[C@H]3[C@@H]4CC[C@H](C3)N4)C5=CCNCC5,4095A8557D502A25_FDE85273675C1096_6034_UN,7.4849524,00000000000000000000000000000000000000000000000000100000000000100100000000011000101101100011000010111100110000010000001011100100110100000110001001011001010110101111010,LSJFELCIRHXTTE-QKLQHJQFSA-N
O[C@H](CBr)C1=CC=C(C=C1)C2=CC=C(C=C2)NCC4C3CCC(CN3)C4,2679F5B1599ACEC5_657EC0C0C4332CA9_6041_DP,7.7575207,00000000000000000000000000000000000000000000001000000100000000100000000000000000101000000011000000101000110000010000001001000100110111110111001001010001110111100111110,IVXGDLBWPKTOPX-XZRGHYPJSA-N
[NH]1C=C(C2=C1C=CC=C2C#N)NC(C3CNC3)C4=CC=C(C=C4)F,8FABBBE5DAAD674E_35ADDEEDBA9C5742_6041_DP,7.375967,00000000100100000000000000000000000000000110000000000110000000000100000000000001101100110010000010001100010100000000000011000100000101110110001001000001010010100111010,WYHMAXJDANCWQY-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NC3C[C@H]2CCC[C@H](N2C)C3)C4=N[NH]N=N4,BB72A24CE0FE5ADB_9E7D46127C8DB27A_6041_UN,7.730345,00000000000000000000000000000000000000100010000000001000000000100100011000010101100101010001011010100100110110010000101011101100111101110100001011011011000010101111010,MNWHIJOOJPIVEU-YHWZYXNKSA-N
C2(=C1OCCCC1=CC=C2)NCC3=CC(=C(C=C3)F)CN(C)C,13209C76307E2887_0EA1E58B8650E838_7022_UN,7.461498,00000000000000000000000000000000000000000010000000000000010000000000000000100000001001110001010100101100010101000101001000100100100011110110001011011111110111101111110,VWIJQYIBAYDBLG-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCC(C)CC3,17B9B6CDC4CAFB3E_59852902086C651E_6041_UN,8.230503,00000000000000000000000000000000000000000010000000001000000000000100000000010000101100010011011010001100010100000001101011101100110001110100001001011101010110101111010,QPRMHUGUCKLDQM-UHFFFAOYSA-N
O(C(=O)C13CC(C1)(C2=CC=CC=C2)C3)CCNC4=CC(=CC(=C4)Cl)Cl,AF9500A16BF3A5EE_6BACC4A4926F7AE8_6031_UN,7.871708,00000000000100000000000000000000000000000000000000000000000000100010000000000000001000010000000100001001110101011000001000010110100011110010000001010001011111110111110,WZBIDLRJDSJLGU-UHFFFAOYSA-N
FC1=CC(=C(C(=C1)F)NC[C@@H]2CCCN(C)[C@H]2C3=C[N](N=C3)C)F,CD74E77DA50487B0_75546EC37306A939_6041_UN,8.702746,00000000000000000000000000000000000000000010000000001000000000100100000000010000101101110011011010101000000110010001101011101100110001110110001011011111010110101111010,MTCXCKLSUSINHK-APPDUMDISA-N
CC2=C(C=C1[N](C=NC1=C2)CC3=CC=C(C=C3)NCC4(COCCNC4)F)C,D513AA1EDFAF771A_B1984C08D6E5871D_6041_DP,7.8687644,00000000000000000001000000000000000000000010000000000100010000000110000000010101101101110011000111001100110101011000001011100100110111110110001011011111010111101111110,VJFKTSMPBFIXLV-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC(CN2CCCC2)C3CC3)F)F,24145AE00B71BD53_14F06F55AF8399D9_7022_UN,8.828716,00000000000000000000001000000000000000000010000000000000000000000000000000010000101101110011000010001000000100010000001001100000110001110110001010011011010110101111010,PDOCGWNJRCTJGT-UHFFFAOYSA-N
O[C@@H](CCl)C1=CC=C(C=C1)NCCC3CCN(C2CCN(C)CC2)CC3,A3DF3B25DFA2037E_D997856201B3497A_6041_UN,7.9424715,00000000000000000000000000000000000000000000000000000000000000100000000000010000101001100001010000101001100000010001101011100000110111110111001001011001110111101111110,MVYRKVNXCHYBKU-NRFANRHFSA-N
CN1CCC2=C1C=CC(=C2)NC4=NC=C(CC3COCCC3)S4,6BEE001C2EF8901B_3905FCC74328D548_7022_UN,7.3966427,00000000000000000000000000000000000010000000000100000000010000000100000000010100010101101001010010101100011011010001101011100100110011010110001011011001010111101111110,GTLMJIWEIUVEEI-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(C3=C(C)N=C(S3)C4=CC(=C(C=C4)F)F)=O,BA3715BB57595CA4_B25DCE01A3BE51AA_6038_UN,8.059511,00000000000000000000000000000000000010000010000100000000000000100100000000000000111100011011100011011000010100100000011011000100110000100100001011010011011110101111110,XKRDJXZPWOPKON-UHFFFAOYSA-N
CCC4(COC1=CC=C(C=C1)SC3=C2C=CC(=CC2=NC=C3)Cl)COC(CI)C4,05919A26B895CEC9_3341B5CD5A3AC143_6035_UN,8.266597,00000000000000000000000000010000000000000000000000000000010100001110000000000000010100011100000010100101010101001110100011000111110010100110000101000000110111011111110,SXKJNLHSJHIMMO-UHFFFAOYSA-N
CCOC(OCC)C2=NC1=C(N=CC(=C1)Br)N2CC3OCC(C)N(C3)CC4=CC=CC=C4,E95FCA6680C36475_EC9629D5B9A8835C_6034_UN,8.653626,00000000000000000000000000000000000000100000001000000000010000000100000000010101100101110000000110101100010101010011100011110110110010100110011011101110110111111111110,ZQINEUHVAXGWTL-UHFFFAOYSA-N
FC2=C(C=C1C=COC1=C2)NCC3C(N(C)CC3)C4=CC=CC=C4,7E38501BB4FE79AA_4257C44189A73CA9_6041_UN,8.415713,00000000000000000000000000000000000000000010000000000000010000100000000000010000101101110011010010001100010110010001101011100100110001110110001011011011110110101111110,CSNDONCENOGLQF-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)C2OCCO2)C)NCC5=CC3=C([N](C)C(=N3)C4CC4)C=C5,9A5E663E177C3297_4CFF126E8230CD37_6041_UN,7.26248,00000000000000000000001000000000000000100000000000000000010000100100000010010101001101000000010010001100010011000000001011110100000011010110011011011111010111111111110,MWJTWXAKAWPXOY-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)NCC6C4(C5=C(C(C)(CC4)C)C=CC=C5)C6,620E30D38C74230D_72A5543D01A86C01_6041_UN,8.413908,00000000000000000000001000000000000010100010000100000000000000100110000000100100111100011011000010101100010100001001101011000100110001110100001011010101010110101111010,XJWOPCVDTGHVMP-UHFFFAOYSA-N
C1(=CC=C(C=C1)CN2CCCCC2)NCC3CCN(C)C3C4=CC(=C(C=C4)Cl)F,512441FA5B952F77_A6ACD413D60D70D0_7022_UN,8.151055,00000000000000000000000000000000000000000010000000000000000000100000000000010000101101110011010010101001000110010001101011100100110001110110001011011011010110101111010,QWYOQXBULCZKJD-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C3=CC(=NC4=C3C=CC(=C4)F)C)=O,172312B4CA7CFF90_56B2C67FA1543788_6038_UN,7.485651,00000000000000000000000000000000000000000010000000000000010000000100000000000000001100010001100010101100110100110000011011000100110010100100001001010001111111111111110,YVZVLXHZVMXONE-UHFFFAOYSA-N
CC1=C(C=NC(=C1)C2CCC2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,309E23DAC1D3CE6F_13F027495A11EB14_6041_UN,7.6376305,00000000000100000000000000000000000000000010000000000000000000100100000000010001100101110011010010101000100110010001101011100100000001110100001011011111010010101111010,BGFCMXMJXRKKML-NQIIRXRSSA-N
C2(=C1OC=CC1=CC(=C2)F)NCC3CNCC(O3)(C)C,380F6FBBACF02F75_D0E731AC026F6CBA_7022_DP,7.6010933,00000000000000000000000000000000000000000010000000000100010000000010000000100000101100110010000110101100010110001001000011000100100111110110001001000101110111111111110,KPFNLZOOESAHPK-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)N[C@H]3[C@@H]4[C@H](C3)C5CCC4C5,B897E0A1FBCA9E6B_82E5D1DDEF457E98_6041_UN,7.6814423,00000000000100000001000000000000000000100010000000001000000000100100000000010101100100010001011010100100110100010000001011101100110001110100001011011011000010101111010,ZJQQBPQRTVWIOW-VPBJHKQGSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3=CC(=C(C=C3)C4CC4)F,9EBD254B86EB7A57_084071D45D4C20F9_6041_UN,7.4337716,00000000000000000000001000000000000000100010000000000000000000100100000000010100100101110000010010101000000110010001101011100100010001110100001011011011010010101111010,OQPVOHVPMIWCCD-SFHVURJKSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3COCCN3C,D450BD43A6348804_C96C4D6D0793B772_6041_UN,7.764518,00000000000000000000000000000000000000000010000000000000010000000100000000010001001001110011010101101100010111010001101011100100110011110110001011011111010111101111110,GJCLLBUTEYYVBO-UHFFFAOYSA-N
FC1=C(C=C(C=C1)C2=CN=C([N]2C[C@H]3NC(OC3)(C)C)C4CCNCC4)F,6AF4B666F6A264E3_F0D886F761FE3228_6034_DP,8.533751,00000000000000000000000000000000000000100010000000000000010000100100000000110101001101110011100111101000100111111000111011100100110100100110001011011111110111101111110,ZLCVSKMOBVJAJV-OAHLLOKOSA-N
CC1=C(C5=C([N]1CC34OC2(CNC2)C(C3)(N)C4)C=CC=C5)C6=CCNCC6,665F333EC97D50E1_8C820F9BE9959636_6034_DP,8.013135,00000000100100000000000000000000000000000000000000100100010000100110000000011000101111100011000111111100110010011000101011100100110111000110001011011011110111101111110,XHDIKCUVSCKDTF-UHFFFAOYSA-N
CC2=C1N=CC=C(C1=C(C=C2)NCC3N(C)CC4(CC3)CC4)F,9212A5FC863126B1_C5C43A8FC5D7D1DB_6041_UN,7.486617,00000000000000000000001000000000000000000010000000000000000000000110000000010001101001110011010000101100010110011001101011100100110001110110001001011111010110101111010,AVCSVFQLQRJPKI-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)C#N)F)NCC2CCNC(C2)(C)C,F278E9A6657CBF4D_54DA10F649ADB4B8_6041_DP,8.641423,00000000000000000000000000000000000000000110000000000000000000000010000000100000001000010011000000101000100110011001101001000000110101110110001011010111010110101111010,AMOBMNKKLUCEHZ-UHFFFAOYSA-N
FC1=C(C=C(C=C1)CC=C)NCC2CCCC(CC)CC2,7159C746BBDEB1B3_2A964D0BB1AD11B6_6041_UN,8.025856,00000000000000000001000000000000001000000010000000000000000000000000000000000000001000010011000000011000000110000010101000000000110001110000000010010011010110101111010,RBZGERNIHMSXFC-UHFFFAOYSA-N
CC(C)C1=C(C=C(C=C1)NCC2CC3CCC2N(C)C3)F,DCD5F6E6075505AE_778670955644FDF3_6041_UN,7.958968,00000000000000000000000000000000000000000010000000000000000000000000000000110000101001110011010000101000010110010001101001100000110001110110011011011111010110101111010,AFUUTPVKYWFCGJ-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC3C(C)(C3)C4=C(C=CC=C4)F,EA47088E1DC024DD_06D715BC008C0DFB_6041_DP,7.854539,00000000000000000000001000000000000000100010000000000000000000100110000000010101101101010011010010101000100110011001101011100100110101110100001011011111010010101111010,PQHVWXYITPOAFI-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)NC2CC(OCC2)C3=CC=C(C=C3)F)[C@H]4C[C@@H]5CC[C@H](C4)N5,18047891C8780824_0B1D3BE1DF4613F9_6041_DP,7.9444127,00000000000000000001000000000000000000100010000000001000010000100100000000000101100101110011011011101000110101010001101011101100110111110110001001011001110111101111110,UPEHXCAMUBRMJB-WWVOSGSCSA-N
CC1=C(N=C(C=C1)NCC[C@@H]2CC[C@H]3C[C@@H]2C3(C)C)F,758A69243B57822F_4DDF7A924156A0B1_6041_UN,7.912023,00000000000100000000000000000000000000100010000000000000000000000110000000100100001000010001000000101000110110011000101001000000110001110100011011010111010110101111010,WAKWDSZDOPHZOP-IHRRRGAJSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC3=C(C)C4=C(O3)C=CC(=C4)F,3EF983A593148403_BB4EF2F5D79A046E_7019_UN,8.523234,00000000000000000000001000000000000000000010000000000000010000100000000000000000000100010000000010010100010100000000000000000100110000100100000010010010100100001011110,FHDMCMDHJJMLFG-CJNGLKHVSA-N
O[C@H](CBr)C1=CC=C(C=C1)C2=CC=C(C=C2)NC3C4CCCC3COC4,E5ABBEFCE14A7A1C_41671CDE3D3547DE_6041_UN,7.7897162,00000000000000000000000000000000000000000000001000000000010000100000000000000000000000100011000001100100110001000000001000000100110111110111000001010001110111110111110,OHNRRHXSEZSPTG-QXXBNALYSA-N
CC1=C(C2=C([NH]1)C=CC=C2NCC3OC4(CC3)CCC4)C,F8920691A6751563_253A96334FA8E199_6041_UN,7.306205,00000000000100000000000000000000000000000000000000000100010000000110000000000000101100000011000110001100010000001000001011000100110111010100001010010111110111101111110,AOMNZCKROIPMJA-UHFFFAOYSA-N
C(CC1CCCCO1)=CC2=C[N](C)C3=C2C=CC(=C3)Cl,E623BF1CE4377252_1C4BB74E046E57E1_7019_UN,8.197997,00000000000000000000000000000000000000000000000000000000010000000100000000010000000101010000010010110101010101000000001011100100110010100100000001011000110111101111110,CBXLBDGBVKECQE-UHFFFAOYSA-N
C1(=CC3=C(C=C1)C2CC(C2)C3=O)NC4(CCCCC4)C5=C(C(=CC=C5)F)F,8000039EC0120A38_4EF0DD165305F848_6041_UN,7.5533667,00000000000100000000000000000000000000000010000000000000000000100010000000000000000000010011000000000100110100011000001000000101110001110000000111010011101010100111110,KTTXBOIWEZHVTK-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NC(CC)C3CCCOC3,DEEBD60D285EBE09_1D6C8E255012F04B_6041_UN,7.190202,00000000000000000000001000000000000000000010000000000000010000100000000000000000000000110011000001100000100111010010001000000000110011110110000011010011010111101111110,GUGRAXYYSLPOBA-UHFFFAOYSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)NC4=C(C)[N](N=C4)C5=CC=C(C=C5)F,AC0BB11541258815_ECE7D13D45533B29_6041_DP,7.5636454,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011001010100000110100010000001011101100010101110100001011011011000010101111010,GZXDSRYPTXHJEK-OHNRDTAOSA-N
BrC1=CC2=C(C=C1)N(C=C2C3CC3)C[C@]45[C@](C)(C4)CNC5,D9C24B27E8BA6144_2713329ACFC4F692_6034_UN,8.37961,00000000000000000000001000000000000000000000001000000000000000100110000000010000101101110011000010101100010110001001100011100100110000100110001001011011010110101111010,AKBVHUCMVYZTPS-MSOLQXFVSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCN2C3CCCC3)F)CC4,CB6D7E882ABC7DD1_354F22634C0D798F_6041_UN,7.67601,00000000100100000001000000000000000000000010000000000000000000100000000000010001101001110011010010001000000110010001101011100000110001110110001010011011010110101111010,QLALPTXNCWJZGN-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=NC=C2NC4=C(CN(C)C3CCCCC3)C=CC=C4,F77FFB3D0D8BAE29_5E48AC4984B32544_6041_UN,7.9657555,00000000000000000000000000000000000000000010000000000000000000000100000000000001100001110010010000101100010110010001101001100100110001110100001011011011010110101111010,VCSFTEAPLWCMKL-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NCC3CCC(C)(C)C4=C3C=CC=C4,72BF668E7992D360_8E34E5D83BEE57EC_6041_DP,7.8339033,00000000000000000000000000000000000000100000000000000000000000100110000000110101101101000011010010101100110010011001101011100100110101010110011011011111010110101111010,VCKRBZYSFHPWDL-UHFFFAOYSA-N
CC3=NC1=C(C=CC2=C1CCCN2)N3CC(CC)C4=CC5=C(C=C4)CCCC5,C2CD36F9DA4273C4_64F3727CB995FCB1_6034_UN,8.016595,00000000000000000000000000000000000000100000000000000000000000000100000000010101101101000011000010101100110000010010101011100100110000010110001011011111010110101111010,LFZROGXOCBLEQF-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@H]3[C@H]2CCCCCC[C@H]2C3)F)[N]4C=CC=C4,6E6C4614B05CBBDB_9DCA29A1FC8D8C75_6041_UN,8.306084,00000000000100000000000000000000000000000010000000000000000000100100000000010000000101010011000010000100110100010000001001100100110001110100001010011011000010101111010,YKIIULZQMOBJQP-JENIJYKNSA-N
CC1=C(C2=C([NH]1)C(=CC=C2)NCC3(CNC3)C4=NC=C(C=C4)F)C,9EBFB255AF496306_91491410ED92A088_6041_DP,8.101782,00000000100100000000000000000000000000000010000000000110000000100110000000000001101100110011000010101100010100001000000011000100100101110110001011000111010110101111010,PYUGTQGSQJDLTD-UHFFFAOYSA-N
C1(=C(C=CC=C1F)F)N[C@@]34[C@@H]2OC(C)(O[C@@H]2[C@@H](CC3)C4)C,EED32B4A41D6F050_EC45151E45733FAC_7022_UN,8.149966,00000000000000000000000000000000000000000010000000000000010000000010000010100000000100010011000111000100110100011000001010010000010001110100000011010111100011111111110,COMVXIIOIOMFJV-JBTNIPSDSA-N
FC1=C(C(=CC=C1)NCC2(CCN(C)CC2)N3CCCCC3)C4CC4,9717CDD4DB09AB10_85170AB2788091BB_6041_UN,7.8169637,00000000000000000000001000000000000000000010000000000000000000100010000000010001101001110011010000101000000100011001101011100000110001110110001011011011010110101111010,AOJCVTUMMFGBTD-UHFFFAOYSA-N
FC2=C1C=CN=CC1=CC=C2NCC3CCCCN(C)C3,371AE3CC05396AE8_5BDAACACE4417179_6041_UN,8.018215,00000000000000000001000000000000000000000010000000000000000000000100000000010000101001110011010000101100010110010001101011100100110001110110001011011011010110101111010,IZULAOPANOXZGG-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC(N3CCNCC3)C4=CC(=CC=C4)Cl)C5CCNCC5,D15213E8D45BA21E_9DF6A774C265FAEC_6034_UN,8.211227,00000000000000000000000000000000000000000000000000000000000000100100000000010001001101110001000010101101110100010000001011100100110100100110001001011001010110101111010,JFESIQYRTNNNKT-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NCC(CC)C2CCOCC2)C3CC3,F231CC27A11DE010_9658BEEE03F2C253_6041_UN,7.7501802,00000000000000000000001000000000000000000010000000000000010000100000000000000000001000110011000000101000000111000010101000000000110011110110000011010011010111101111110,BLMRUDJFTYLJME-UHFFFAOYSA-N
FC2=C1C(=C[NH]C1=CC=C2)NC[CH]4C[C]3(C[C](C)(C3)C)C4,1535C3316ADBE852_E1C6636AED6E85EC_6041_UN,8.0654545,00000000000100000000000000000000000000000010000000000110000000000110000000100001101100010011000010001100010110001001000001000100100101110100001000000101010110101111010,FRJDOHJEVHXPJK-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC34CCCNC3CCC4,40A64F083E94B4E0_94908EB428973FE5_6041_DP,7.3038535,00000000000000000000000000000000000000100000000000001100000000100110000000010101101101000011011010101100110010011000001011101100110101010110001011011111010110101111010,GXVWMONMKROJKE-UHFFFAOYSA-N
BrC2=C1C=CN(C1=CN=C2)CC4[C@@H]3C[C@@H](C3(C)C)CC4,5F306F94B5CBCE8F_AAFC6AB4F98C6991_6034_UN,7.9758234,00000000000100000000000000000000000000000000001000000000000000000110000000110001000101010000000010101100010110001000101011100100110000100100001001011100010110101111010,AHEDRHDVZDUHID-WGIUUAEBSA-N
CC1=C(C=CC(=C1)CNC(C2CC3CNC2C=C3)=O)F,AE4594ECDA14D1F4_4885019D6FFF53F4_6038_DP,7.7511635,00000000000000000000000000000000000000000010000000000100000000000000000000000000101000010010100001111000010110100000010001000000100100100110001011000011011110101111110,ZDZOPCSEBYOCGZ-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C([N]1CC[C@H]2CCCN2)C=CC(=C3)Br)C4,ECD5234E006D4D10_507F6FBA470F8794_6034_DP,7.8437934,00000000000000000000000000000000000000000000001000000000000000000110000000110000101101010011000010001100110100011001101011100100110000100110001011011101010110101111010,YUZOWZXXRZJVIJ-OAHLLOKOSA-N
CC1=NC(=NC(=C1)NCC2(CCCC2)C3=C(C=CC=C3F)F)CC4CC4,DDCD3F1EE158652D_8B8F22D69AD0658A_6041_UN,8.226834,00000000000000000000001000000000000000100010000000000000000000100110000000000100101000010011000010101000000110011000001011000100110001110100001011010011010110101111010,HLBJEPVEKOPBPO-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC(NCC)C)C3=CCNCC3,5AEEA41791B3C741_40BFF4EDCE798FCC_6034_UN,8.693102,00000000000000000000000000000000000000000010000000100000000000100100000000011001001101110001000010111100110110010011101011100100110100100110001001011101010110101111010,MVZPTKLBVPSOJR-UHFFFAOYSA-N
C[N]1C(=NC2=C1C(=CC=C2)F)NCC34CC(CO3)CCC4,FE5C234074BB1AE3_A1B51ED7E95D2377_6041_UN,7.6332073,00000000000000000001000001000000000000000010000000000000010000000110000000010101001101010011010110001100011111001000001011100100110011110110001011011011110111101111110,BCPCUEWLANZHJW-UHFFFAOYSA-N
CC2=C1OCC[C@@H](C1=C(C=C2)C)OCCC3N(C)CCC3,3B26AF517FA490E1_337D903F8592BF59_6039_UN,7.806826,00000000000000000000000000000000000000000000000000000000010000000000000000010000000101100100010011101100010011010101101011100011110010000110010111011110110111111111110,UNQLXOZLSNEOMK-LYKKTTPLSA-N
O[C@H](CBr)C1=CC=C(C=C1)C2=CC=C(C=C2)NC34CC(C)(C3)OC45CCC5,B1E98381BD177760_E7918E5CB0833218_6041_UN,8.146812,00000000000100000000000000000000000000000000001000000000010000100010000000000000000100000011000111000000110010011001001000000100110111110101000001010001110111111111110,QRBQGOMLOQTHDQ-ITAUSPCMSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NC3CC4(CCC3)CCCCC4,39DCF13DDFB335BD_60675253168B9E2F_6041_UN,7.6557817,00000000000000000000000001000000000000000010000000000000000000000110000000010101000101010011010010000100111100011000001011100100110001110100001011011011000010101111010,USDHTOIUBOXYRJ-UHFFFAOYSA-N
C1(=CN=C(S1)N2CCCCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,1CB51AEFBE64A30D_37F2CE27B8C9002C_6041_UN,8.488535,00000000000000000000000000000000000010000010000100000000000000100100000000010101110101111011010010101000101110010001101011100100110001110110001011011011010010101111010,WENKSBMFYLPRNW-AEFFLSMTSA-N
C(C1COCCN1)C2=CN(C3=C2C=CC=C3)CC4CCN4C,7EBED36B7069FF7A_F865914887F939D5_6034_UN,6.830488,00000000100100000000000000000000000000000000000000000000010000000100000000010001001101100001010110101100110001010001101011100100110010000110001001011011010111101111110,ZRBYRKBMANIHKN-UHFFFAOYSA-N
CC2=C1C=CN(C1=NC=C2Br)C[C@]35CCC[C@H]3CN(CC4=CC=CC=C4)C5,6FE5ECB57C132B4C_3E07C5F35DB84FE6_6034_UN,8.274277,00000000000000000000000000000000000000100000001000000000000000000110000000010100100101110000000010101100010100001000001011100100110000100110001011011010010110101111010,QEMRJKNHLNBVOO-WMZHIEFXSA-N
BrC1=CC(=CC=C1)N2C=CN(C2=O)C[C@H]3[C@@H](CNC3)C4CCOCC4,D62402044C7E95D0_BF56F24C0B76EE98_6034_UN,8.048182,00000000000000000000000000000000000001000000001000000000010000100100000000010101101101110011000010101000001101100100011011100101110011110110001111011011011111110111110,RMGPDCIZXFHJGL-YJBOKZPZSA-N
ClC1=CC(=CC=C1)N2C=CN(C2=O)C[C@H]3[C@@H](CNC3)C4CCOCC4,48DCB3B207844042_E8CCE08A518F9E87_6034_UN,8.04818,00000000000000000000000000000000000001000000000000000000010000100100000000010101101101110011000010101001001101100100011011100101110011110110001111011011011111110111110,UFCVLYUIYVFYHG-YJBOKZPZSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC4OC3(CCC(C)CC3)CC4,B2AA9461B7C28B4F_5313E9D87646108B_6041_UN,7.224253,00000000000000000000000000000000000000100000000000001000010000100110000000010101101101000011011110001000010010001001101011101100110011010100011011011111110111101111110,SJLIZDDTVDECMA-UHFFFAOYSA-N
FC1=C(C=CC(=C1)N[C@H]2CC[C@@H](N(C)C)C2)OC3CCOCC3,6041BA44DA4752AE_64D56F4EEC67F952_6041_UN,7.3314047,00000000000000000000000000000000000000000010000000000000010000000000000000100000100001110111010010100000100111010100101000100011110011110110001111011111110011111111110,BDSFGKAYAKTYRH-DZGCQCFKSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC4(C3CCNCC3)CCOCC4,A1CABF82609531BF_23D4475A34D1E330_6041_DP,8.496364,00000000000000000000000000000000000000000010000000000000010000100110000000000000101000110011000000101100110101011000001011000100110111110110001011010011010111101111110,CAGRAXKELOHIAX-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NC3(C)CCOC3C4CC4)C,E2B6F29A5EB5B4CD_72108E7D36988236_6041_UN,7.6907067,00000000000000000000001000000000000000000000000000000100010000100110000000000000100100000011000111000100110011011001101011000100100111010100011010010111110011101111110,KVCZKBCYCOSOGA-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)COCC2)[S](C3=C[NH]C4=C3C=C(C)C=C4)(=O)=O,6AB56E9700A197A8_1C273F6DAFCCCC19_6029_UN,8.687303,00000000000000000000000000000000110000000000000000010101011111001101010001000000110100101001001011100110011001001000011011001100111111011110001011111001010011111111110,GCJFFDVBIDMTGH-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)F)NC(C)CC2CCCCN2C)F,783EE934F32108DE_93ADF8D86BC4E204_7022_UN,8.222572,00000000000000000000000000000000000000000010000000000000000000000000000000010000100001110001010000101000100110010001101001100000110001110100011011011111010110101111010,KGDBKAIQQPCXPH-UHFFFAOYSA-N
CCN4CCC1=C(C=CC=C1NCC2(CCNCC2)C3=C(C=NC=C3)F)C4C,14926DFDA469B2AD_215107B0D68C4A52_6041_DP,8.321329,00000000000000000000000000000000000000000010000000000000000000100110000000010000001001110011000000101100110110011010101011100100110101110110001011011111010110101111010,IZUTZNJOOBXMHB-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2CCCCC23CCCC3,BDEFAC8BF2DE91CA_638053D5BA8C0496_6041_UN,7.48888,00000000000000000000100000000010000000000000000000000000000000000110000000100001000000100011010010100000110000011000001001000000110001010100011011011111000010101111010,NTQPHEDYHVHOAM-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2(CC2)C3=C(C=CC=C3)F)C4CCCC4,F3FFB5A216A9CA13_CAE6CA8BA701BD99_6041_UN,7.9280233,00000000000000000000001000000000000000100010000000001000000000100110000000010101100100010010011010000000100100011000001011101100010001110100001010011011000010101111010,SBQOKTOEIZWEMY-UHFFFAOYSA-N
CC1=CC(=N[N]1C)C(OCC3CCC2(CNC2)O3)C4CC4,754B803BC1AF4722_E9B79D0C0466BD23_6039_DP,7.555565,00000000100100000000001000000000000000000000000000001000010000000110000010010000101100100011011111001000010001001000001011101010110010000110001010011111110111111110110,GAQVNFBQNWQJIA-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)OCCC2)C(C4=CC3=C(C=C[N]3C)C=C4)=O,01FD0470BE4F0BD6_E19389375E968369_6038_UN,8.532347,00000000000000000000000000000000000000000000000000000000010000000100000000010000001101000000110010101100010001100100011011100100100010000110001011011001111111111111110,KRWYDMGPFMYCSC-UHFFFAOYSA-N
N(C1=CC3=C(C=C1)OC2(CCC2)CC3)[S](C5=CC4=C(C=C[N]4C)C=C5)(=O)=O,7DA3708F21B8E2AB_D5C43AE629AF0C52_6029_UN,8.56715,00000000000100000000000000000000110000000000000000010001011111001111010001010000010101001001011010100110011000001100011011101100111011011100001011111001100011111111110,HRALWRMQQYKPCB-UHFFFAOYSA-N
FC2=C(C=C1OC=CC1=C2)N[C@H]4CC[C@@H](N3CCN(C)CC3)CC4,3ECC291D92CB64B9_7C0509C4759C0335_6041_UN,7.6035175,00000000000000000000000000000000000000000010000000000000010000100000000000010001000101110010010011101100110100010001101011100100110001110110001011011011110010101111110,ARXSNADAWULKHH-IYBDPMFKSA-N
COC1=CC=C(C=C1)C4=CC2=C(C(=NC=N2)NCCC3OCC(C)(C)C3)S4,1BAD1CAC4086D28B_08463DA0B6110A9D_6041_UN,8.481056,00000000000000000000000000000000000010100000000000000000010000100110000000100100111100001001010011101100110011011101001011000111110011010110011101010101110111111111110,JONNNXXROFIMRB-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2CC3(C2)CCCCCC3,4D7CF451917908A5_79906A05EF0F428D_6041_UN,7.3465686,00000000000100000001100000000010000000000000000000000000000000000110000000100001000000100001010000100000110000011000001001000000110001010100011010011111000010101111010,RNIYPVDHFUTKGQ-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)NC2C(C)(C2)C3=C(C=CC=C3F)F)C4[C@@H]5CNC[C@H]45,CF4324FF24275A5B_D5D7494182929820_6041_DP,8.241846,00000000000000000000001000000000000000100010000000001000000000100110000000000101101101110011011010101000110110011001100011101100110101110110001011001111010110101111010,FNFGEHQERIDZNF-QARAPLMISA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC4=C(C=C(C(=C4)F)N5CCOCC5)F,9E78DCDB838FD0E6_ED5D61AB62230866_6041_DP,8.120522,00000000000000000001000000000000000000100010000000000000010000100100000000010101100101110011010110101000110101010000101011100100110111110110001011011011010011101111110,LFYWYQJGMFNNHI-MUJYYYPQSA-N
FC1=C(C(=CC=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)F,BAC3F2AB9FD7037E_7000A3E4FC07830E_6041_UN,8.233265,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011011010110101111010,DSFITOYPXXGMGL-YJYMSZOUSA-N
N(CCC1=CC(=CC(=C1)F)F)C(C23CCC(C)(C2)CO3)=O,A2F97345E264CA30_557635C52A26DD84_6038_UN,7.8521323,00000000000000000000000000000000000000000010000000000000010000000010000010000000001100010011100110101000110111111001111000000000110010100110000001010001111111111111110,NBFPRWPFTWGPQK-UHFFFAOYSA-N
CC1=C(C4=C(N1C[C@H]2N[C@@H]3CC[C@H]2C3)C=CC=C4)C5=CCNCC5,341B40E5FC410090_5534A1D30B22BB05_6034_UN,8.318222,00000000000000000000000000000000000000000000000000100000000000100100000000011001001101100011000010111100110010010000101011100100110100000110001011011011010110101111010,PDDRQESBWRSFEH-YQVWRLOYSA-N
CC1=C(C(=C(C=C1)F)NC2CN(C)C3(C2)CCCC3)F,DAD77DE125F701D2_88104B1CEA7D219B_7022_UN,7.377783,00000000000000000000000000000000000000000010000000000000000000000010000000010001100101110001010010001000110110011001101001100000110001110100001010011111010010101111010,OTXDCHJSEPPVJC-UHFFFAOYSA-N
CN(CC1CCNC1)C2=NC(=NC=C2)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,DF6F4A51A1CD7E66_FB77381035AC7EF9_6041_DP,7.7728786,00000000000000000000000001000000000000100010000000000000010000100100000000000100101101110011010011101000101111010001001011100100110111110110001001011011110111101111110,QSDHYJRDZSARSZ-LXKGCQHHSA-N
N5CC1=C(C=C(C=C1)NC(C)CC2=C[N](C)C3=C2C=C(C=C3)F)C4(CC4)C5,71D876C06B89EB69_1C8384ACF06A3165_6041_DP,8.059605,00000000000000000000001000000000000000000010000000000000000000000110000000010000001101110011010010101100110110011001000011100100110101110110001011011101010110101111010,ZXCBZPVYVHMUAV-UHFFFAOYSA-N
CCN3CCO[C@@H](CNC(C2CC1CCC(N1CCC)C2)=O)[C@@H]3C4=CC=CC=C4,5B659EEE127849A3_63FE3C7BFA8F3C32_6038_UN,8.230506,00000000000000000001000000000000000000000000000000000000010000100000000000010000101101100011100110101000010011110011111011100000110010000110001001011111111111111111110,FUODIDIOQHSIIT-WBLOSPSNSA-N
CN(CC1=CN=C(C=C1)NC2CCCC(C2)C3=CC(=C(C=C3)F)F)C4CC4,C1F83B2BF0D0A9D5_375F484F533162C4_6041_UN,7.7412767,00000000000000000000001000000000000000100010000000000000000000100100000000000100100001110011010000101000100100010001101001100100110001110100001011011011010110101111010,HRTFPDBFVAXLGI-UHFFFAOYSA-N
N(C1=CN=C(N=C1)N2CC3CCC(C2)O3)C(C4=C(CC)C=CC(=C4)F)=O,EF92F8AE101F8A74_8D47B48B0CF5678E_6038_UN,8.127153,00000000000000000001000001000000000000000010000000000000010000100100000000010101100101110001100110101000011100100010011011100100110011110110001011011011111111111111110,ITVJZFDLFYLEJL-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CC=C1)NCCCC3=NC2=C(CCCN2)C=C3,88CB9E51C620F912_047E9D8D4DA675C6_6041_DP,7.905996,00000000000000000100100000000010000000100000000000000000000000000100000000100100001000100011010000101100110000011000001011000100100101010110011011011101010110101111010,XUOHOOFFJAVBPR-UHFFFAOYSA-N
CN(CC1CCNC1)CC2=NN=C(C=C2)NC(CCC)C3=C(C=CC(=C3)F)F,2EC4FB85CC2B3734_577872D31C8F856A_6041_DP,8.155878,00000000000000000000000000000000000000100010000000001000000000000100000000000101101101110011011010101000100110010011001011101100110101110110001011011111010110101111010,UPCSHQRMYLLDNV-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC(C3=CC=CC=C3)C46CC5CC(CC(C4)C5)C6,404C261B08066F8B_5A34FBB4B688F7C7_6041_UN,8.029334,00000000000000000000000001000000000000000010000000000000000000000110000000010101000101010010010010000100011100001000000011100100100001110100001011001011000010101111010,ZJYMRGBQJISMLI-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NC[C@H]3[C@@H](C3)C4CCCCC4)C,D7A2ACAFDF715CC2_F541127E62FC170B_6041_UN,8.053443,00000000000000000000001000000000000000000010000000000000000000100100000000000000101000010011000000101100010110000000001001000100110001110100001011010111010110101111010,NNTQEWRSGZFOEP-WMZOPIPTSA-N
C(=CC1=CC(=CC(=C1)F)F)NC23CC(C)(C2)OC34CCOCC4,85FD6472AA05D7B4_454C0C438960B739_7022_UN,7.001772,00000000000100000000000000000000000000000010010000000000010000000010000000000000000100110111000111110000110111011001001010000000110011100110000001010001110011111111110,ZTNHYRZCHZTHSC-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3CC(OCC3)C4=CC=C(C=C4)F,9EE700CA26BDCFA9_201CE767DDBAB6FE_6041_UN,7.464174,00000000000000000000000000000000000000100010000000000000010000100100000000010100100101110010010011101000100111010001101011100100110011110110001001011011110011101111110,NLMBYSBXAOWNTM-GPJFCIFZSA-N
C1(=CC=C(C=C1)CCN2CCOCC2)NCC3C[Si](C)(CC3)C,923308215406389A_62658ACCC64A2322_6041_UN,7.97173,00000000000000000000100000000010000000000000000000000000010000000000000000110000001101100011010110101000000011011001101011100000110011010110001001011101010111101111110,JHUPUSXWAUNKAP-UHFFFAOYSA-N
CC2=C1N=CC=C(C1=C(C=C2)NCC(N3CCC(C)CC3)C4=CC=CS4)F,5F01EB154EF14356_6F4C24E96270C124_6041_UN,8.02467,00000000000000000000000000000000000010000010000000000000000000000100000000010001111101111001000010101100010100010001101011100100110001110110001001011101010110101111010,LLFKUKOHRFRTMS-UHFFFAOYSA-N
FC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCCC3)C[C@H]5C[C@@H]4NC[C@@H]4C5,6CC532D93D0F96E4_9B9B2ABC50BB26AE_6034_UN,8.742428,00000000100100000001000000000000000000100010000000000000000000100100000000010101001101010011000010101000110100010000001011100100110100100110001011011011010110100111010,VSPQSUSWOONAHL-CHLFNJESSA-N
CC1=C(C=C(C(=C1)NC23C(CC(CC2)C3)Br)Cl)C4CC4,FE6CE0592C695CC2_75813DE43EC107FD_7022_UN,7.4794707,00000000000000000000001000000000000000000000001000000000000000100010000000000000000000010011000010000001110110011000001000000000110001110000000011010011000010101111010,NOINEOPXMJHILK-UHFFFAOYSA-N
C3(=C1C=CC=C2CCC(=C12)C=C3)NC4=C[N](C[Si](C)(C)C)N=C4,8A530070CD91FB1D_5B92029A7C41776A_6041_UN,7.95472,00000000000000000000100000001010000000000000000000001000000000000100000000110001100100100001011010001100010000011001001011101100000001010100011001011101010110101111010,JJLNXQSKUGWFLQ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCNCC2C)Cl)C3CC3,EC63D3FF380F0CED_63A73A0689399667_7022_DP,8.328351,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000110011000000101001100110010001101001000000110101110110001011010111010110101111010,LCKWNXHJHYXOPE-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCCCOC3CCOCC3,323F07F06D596059_2C5DE005CABEC0BD_6041_UN,7.8973784,00000000000000000000000000000000000000100000000000000000010000000100000000000100001000100110000001101100110011010000001011000111110011010110011111010111110111111111110,INFIZIANJDQPSP-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NCC4CCCN(CC3CC3)C4,16B5559266652E3C_DD8641930BF3FE65_6041_UN,7.8726215,00000000000000000000001001000000000000000010000000000000000000000100000000010101101101110011010010101100011110010000001011100100110001110110001011011011010110101111010,BSWNXQCFYACIMC-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)C#N)N[C@H]2[C@@H](OCC2)C3=CC=NC=C3)F,6BBA3298779FFDA0_2E09C9CF16C331F0_6041_UN,7.4236975,00000000000000000000000000000000000000000110000000000000010000100100000000000000100100010011000111100000100101010000001011000100000011110100001011010011110011100111110,QYULARWLAMPLBI-CJNGLKHVSA-N
N(CC1CC2CCC(C1)O2)C(=O)C4=C3C=C[NH]C3=C(C=C4)F,ECC38514651FE4EE_26297B6DD79DCCDD_6038_UN,7.5426884,00000000000000000001000000000000000000000010000000000000010000000100000000000000001100010010100010101100010100100000011011000100110110100100001001010001111111110111110,RLUWNXPZWXPDDZ-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)N[C@H]4[C@@H](C4)C5=C(C=CC=C5)F,C3D1C898D3ADE61D_218A6804EB0414B8_6041_DP,7.8489537,00000000000000000001001000000000000000100010000000000000000000100100000000000101100101010011010010100000110100010000101011100100110101110100001011011011000010101111010,BBSASDXAZBIUDQ-AMILPRIGSA-N
C[N]1C(=NC2=C1C=CC=C2F)NCC3(CCCC3)C4CC4,275D384B3313F777_8DAB5BB2DD24DFA6_6041_UN,7.954512,00000000000000000000001001000000000000000010000000000000000000100110000000010101001101010011010010001100011110001000001011100100110001110100001010011011010110101111010,YKDOOGUTZAPVAR-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CC3=C(C=CC(=C3)F)F,B585B686970AD7FB_5DF79819DE5A32A3_6038_UN,7.3057117,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,MXSGTCXGMRLPBW-UHFFFAOYSA-N
CC(C)[N]1N=CC(=C1C)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,5BB4F10727ECB191_BBBB664D8A41F4A4_6041_DP,8.124088,00000000000000000000000000000000000000000010000000001100000000100100000000110001101100110011001010101000100110010000001011101100110101110110011011011111010110101111010,YKBLQIPHVMRRDN-FUHWJXTLSA-N
CN4CCN(CC1=C(C=CC=C1)NCC2(CCC2)C3=C(C=NC=C3)F)CC4,A993EF52B3094B0C_8D98E91CE2BEA855_7022_UN,8.315398,00000000000100000000000000000000000000000010000000000000000000100110000000010001101001110011010000101000000100011001101011100100110001110110001011011011010110101111010,IYBZYAFAKCQPRY-UHFFFAOYSA-N
CC1C(C2=C(O1)C=C(C=C2)F)NC(=O)CC3CC4CC3C5CC45,34FE16810458F10B_B6D94E2BED76FBFD_6038_UN,7.8374224,00000000000000000001001000000000000000000010000000000000010000000000000000000000000100010001100111000100110100110100010000000000110011100100000011000011101111111111110,MMBKIFJEILEOPI-UHFFFAOYSA-N
FC1=NC2=C(C=C1)C=C(C=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,FFCBD8B5306E5533_1D30E8C184E0068B_6041_UN,8.200636,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,SNOZMUKESVTVPK-ZHRRBRCNSA-N
FC2=C1CCCC1=CC(=C2)NC4CC(C3=NC=C[N]3C)OCC4,DE76F115852B078C_2C3B5A59302B2AC4_6041_UN,7.118464,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010011010111100100110111010000001011100100110011110100001011011011110011101111110,IDXIYSUOIHKMRX-UHFFFAOYSA-N
CC1=C(C4=C(N1CC2CCCN2CC3=C(C=CC=C3)Cl)C=CC=C4)C5CCNCC5,363FEAE75F345691_66BF20A26F5E1B41_6034_UN,8.461559,00000000000000000000000000000000000000000000000000000000000000100100000000010001001101110001000010101101110110010000101011100100110000100110001011011011010110101111010,VAJXOSYTQUXYRY-UHFFFAOYSA-N
FC2=C(C=C1C(=CC=NC1=C2)NCC3CCN(C)C3C4=CC=CS4)F,9B031DE6463B843B_4648D84E2ABCD79A_6041_UN,8.695152,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,MUMZFEJDHACWOQ-UHFFFAOYSA-N
C1(=NC=C(C=C1)CN2C=CC=CC2=O)NCC(C)(C)C3COCC34OCCO4,7D6CFF345E7DE6E5_0840C4C9D17FC2B2_6041_UN,8.013439,00000000000000000000000000000000000000100000000000000000010000000110000010110100101101100101100010101000010011101101111011110101110011010110101111111111111111111111110,ZTAZINFKHFVWHY-UHFFFAOYSA-N
C1(=C(C(=C(C=C1)Cl)C#N)F)N[C@H]2[C@H](CCNC2)C3=CC(=CC=C3)F,0F21197E058E156F_F35856E7115DDE67_7022_DP,7.8336473,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101001100100010000001001000100110101110110001011010011010010100111010,WYFSGGMYJZMOSR-CXAGYDPISA-N
N(C1=CC2=C(C=C1)CCOC2)[S](C4=C(Cl)C=C3[NH]C=CC3=C4)(=O)=O,221055F91614F4F9_51666CFB4B6D9013_6029_UN,8.457985,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100111001001010100111011101001000011011001100111111111110001011111011010011110111110,SBLIEYPBCUNNAX-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)CCOC2)[S](C4=C(F)C=C3[NH]C=CC3=C4)(=O)=O,9697FACF3ED96CA1_CC7838BAF4C27E11_6029_UN,8.457985,00000000000000000000000000000000110000000010000000010001011111001101010001000000010100111001001010100110011101001000011011001100111111111110001011111011010011110111110,UVRGTSBHCWVKCO-UHFFFAOYSA-N
C[N]1C=C(Cl)C(=N1)C=CC3=CC(=C2OCCCOC2=C3)C4=CC=N[N]4C,DB7788AAD948E647_3526536BD70FAB98_7019_UN,8.13078,00000000000000000001000000000000000000000000000000001000010000100100000010010000100100010100011011010101010101000100001011101100001010100110001010011110110011111111110,ZLNQIUAIJVKYEE-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC3=CC2=C(CCCN(C)C2)C=C3,7EB7A71DEC19F63D_830D8B6EE25FB18D_7022_UN,7.8108277,00000000000000000001100000000010000000000000000000000000000000000000000000110000000001100001010000001100010010011001101001100100110001010110011011011101010010101111010,AJKWMSXWTZCKHR-UHFFFAOYSA-N
[S](=O)(=O)(C1=C[NH]C2=C1C=C(C=C2)Br)N3CCC4(CC3)C=CC5=C(O4)C=CC=C5,0020F519219D5E26_C75EBA7E36C72DDA_6026_UN,9.190184,00000000000000000000000000000000110000000000001000010001011111001111000001010000110100111000001011111110011100011100011011101100111010101110001011111001110011110111110,GOELATPJVNHBML-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CCC2CCCN(C)C2)C=CC(=C3)C)C4,A16061E3D6AB9D53_B5AA0C8ED015CFD3_6034_UN,7.950215,00000000000000000000000000000000000000000000000000000000000000000100000000010000000101100000010010101100010010010011101011100100110000000110011011011100010110101111010,UMPWOACLLVYKJF-UHFFFAOYSA-N
FC1=C(C=CC=C1)C2=CC=C(C=C2)NCCC4CCN(C3CCN(C)CC3)CC4,AA420E9D0F248DD4_89DBC6165862285E_6041_UN,8.033097,00000000000000000000000000000000000000000010000000000000000000100000000000010000101001110001010000101000100100010001101011100100110001110110001011011011010110101111010,ZECOGKXHTITATH-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2C3=C(CCCC2C)C=CC=C3,1385773252897E97_74510F1B89B9BF54_6041_UN,7.8042974,00000000000000000001100000000010000000000000000000000000000000000100000000100001000000100011010000100100010010001001101001000100000001010100011011011111000010101111010,RNLASBKIBFZFAP-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2C(C)(C2)C3=C(C=C(C=C3)F)F)C4CCCC4,FE5405E08DE7FAB4_F11AAFC7A68A6616_6041_UN,8.1970415,00000000000000000000001000000000000000100010000000001000000000100110000000010101100100010010011010000000100100011001101011101100010001110100001010011111000010101111010,LRUGWENVUXOZPG-UHFFFAOYSA-N
FC2=C1C(=NC=NC1=CC=C2)NC3CCN(C)C34CCCNC4,F19920C83D3360F6_00B69CDFF9875761_6041_DP,8.245292,00000000000000000000000000000000000000100010000000000100000000000110000000010101101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,LPKPNQKQTHTNNB-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)N[C@H]2C4=C(OC3(C2)CCCC3)C=CC(=C4)F)C5[C@@H]6CNC[C@H]56,BC443AB3F02AD009_489A8D9AE15B9AB2_6041_DP,8.026825,00000000000000000000001000000000000000100010000000000000010000000110000000000101101101110001010011101100110110011101001011100100110111110110001011011001110111101111110,STQKNWKODZRFHX-MLJUJGDHSA-N
CC2OC1=C(C=C(C=C1C2=O)NC3C4CC(C3)C(C4)F)F,7FCACC12CB03BEA9_E05D16F3A682861A_6041_UN,8.287233,00000000000000000000000000000000000000000010000000000000010000000000000010000000000100010111000010000100110100010100000000000001110001110100000111000011101011111111110,CXSQIJPYEKAXEZ-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2C=CC(=CC2=NC=C3)Cl)C4,E1C015C8710644C8_4FE3D2D40CE41392_6035_UN,7.981945,00000000000000000000000000000000000000000000000000000000000000000100000000100000000001110000010011101101010100000101001001100111110000100100001101011110110111101111110,ADLZZOIJUAGVOD-LTGQISBOSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2C[C@H](CO2)C3=CC=CC=C3)Cl)C4CC4,2D57CB8CB5E17949_557C653F59FD49A3_7022_UN,8.229479,00000000000000000000001000000000000000000000000000000000010000100000000000000000001100010011000110001001000111000000000000000100110011110110000011010011110111101111110,RPFAPAKMZAIBRG-MSOLQXFVSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC3=C2C=CC(=CC2=NC=C3)Br)C4,CA0188EF1926E5F7_16F76A348EB3604F_6035_UN,7.98193,00000000000000000000000000000000000000000000001000000000000000000100000000100000000001110000010011101100010100000101001001100111110000100100001101011110110111101111110,XICGIESKELWLMC-LTGQISBOSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,D147C9AA201BE133_898D574AC6550CC5_6041_UN,8.087749,00000000000000000000001000000000000000100010000000000000010000100100000000010101101101110011010010101100010101010000001011100100110011110110001011011011010111101111110,PMRHLDYEUAMWJD-KOSHJBKYSA-N
C1(=CC2=C(N=C1)OCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,060B33BB684AD98E_23BC3739423B9108_6041_UN,8.88138,00000000000000000000000000000000000000000010000000000000010000100100000010010001100101110011110111101100110111110101111011100100000011110110001011011011110011111111110,VTBOOBSBVFIACD-WBVHZDCISA-N
C[N]1C=C(C2=C1C=CC=N2)NC4(CC3=C(C=CC=C3)F)CCCCC4,C62BF9E1247FD7A9_522728577A932358_6041_UN,8.094908,00000000000000000000000000000000000000000010000000000000000000000110000000010001100101010011010010100100110100011000001011100100110001110100001011011011000110101111010,POYDBDRTDHVZMI-UHFFFAOYSA-N
CCC(C)C1=CN(C2=C1C=C(C=N2)Br)CC4CCCN(CC3=CC=C(C=C3)I)C4,7C1FA79F7A24A35E_D1E8D5400CD0A437_6034_UN,8.902454,00000000000000000000000000010000000000100000001000000000000000000100000000010100100101110000000010101100010100010011001011100100110000100110001001011100010110101111010,YNXMHQYZNYTKHI-UHFFFAOYSA-N
C1CNCC(C1)C3=C2C=CN(C2=CC=C3)C[C@@H]4CCCO[C@H]4C5=CC=N[N]5CC,9D6F267106D0BB35_DB6EA87996BF41B7_6034_UN,8.156856,00000000000000000000000000000000000000000000000000001000010000100100000000010000101101100011001111101100110001010010001011101100110010000110001011011011110111101111110,LNSSQIDYXBWXRV-OZOSHOQESA-N
N(CCC1CC2CCC1C2)C(CN3C4=C(N(C)CC3)C=C(C=C4)F)=O,FF379A0E66A90C20_135B1E9009B8F1BB_6038_UN,7.883009,00000000000000000000000000000000000000000010000000000000000000000000000000010001001001110001110110101100110100110001111011100000110010110110001011011001011110101111110,HFKBYOFCCMRESN-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CC3=C(C=CC=C3F)F,E3C30F6FABCECA20_4A7D264FB1D83263_6038_UN,7.1908803,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000010011100010000000110100110000011000000000110011100000000011010011001110100111110,FRTKUMFQBOYQPS-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NCC2N(C)CC3(CC2)CC3)CC=C,2A983CE781EA8545_FC40FAED068CD007_6041_UN,8.009106,00000000000000000000001000000000001000000000000000000000000000000010000000010001001001100011010000111000010010011001101001100000110001010110001011011111010110101111010,XWHSYGLALRAPDO-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCOCC2C)Cl)C3CC3,F8B8353BEE17BBC8_286591B1799A0153_7022_UN,7.8365536,00000000000000000000001000000000000000000000000000000000010000100000000000000000001000110011000000101001000111000001101000000000110011110110000011010111010111101111110,VTWSWGXLJIAXMT-UHFFFAOYSA-N
C1(=CC2=C(C=C1)CC3CCC(C2)C3=O)NC4=CC(=C(C=C4)F)C#N,8103C4F312961169_CFC5BD436AB0186B_6041_UN,8.106743,00000000000000000001000000000000000000000110000000000000000000000000000000000000000000010001000010000100010100000000001000000101110001110000001111010011101010100111110,HQEHKBVPHVQZRK-UHFFFAOYSA-N
NCC34CC(COC1=C(C=CC(=C1)C2CNCCC2)F)(C3)C4,7F5A5EFE8C185086_2B9AD7C965FDCA2E_6035_DP,7.9870253,00000000000100000000000000000000000000000010000000000000000000100010000000000000001010110011000000101000110101011100001001000011110100100110001111010011110101100111110,HLYUUNNESPNOSG-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OCC2(OC(CC23CNC3)=O)F)C4,17F55C0C2A517C6E_F3C4210584C42995_6039_DP,7.5806684,00000000100100000000000000000000000000000010000000000000010000000010000010100000001101110011010011001000010101001001001011110011110010100110001100111111111101111101110,BJJYHRUIPBZCQL-CVVUUAHASA-N
C[N]2N=C1CCCCC1=C2NC(C3CCOCC3)C4=CC=C(C=C4)F,15E80213FFA4D528_570C73203DA8B4EB_6041_UN,7.118102,00000000000000000000000000000000000000100010000000001000010000000100000000010101100100110011011010100100010111010000001011101100110011110110001011011011010011101111110,LXSUEHASLHJNKM-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C=CC2=O)CC45OC3(CCNCC3)C(C4)(N)C5,AA4E1747CB11B282_CBF99BD4AD3E88BF_6034_DP,8.26014,00000000000100000000000000000000000000000000001000000000010000000110000000010000001111110011000111101100110100011100001011100101110111100110001101011001111111110111110,BQHOGLYYMAOXOJ-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC(N3CCOCC3)C4=CC(=CC=C4)F,06EE3A2744CC7C89_00D7D451B1F9CE6D_6041_UN,7.692626,00000000000000000000000000000000000000100010000000000000010000100100000000010101101101110001010110101000000111010001101011100100110011110110001011011011010111101111110,ZNZBCWLPCRNVKG-BGERDNNASA-N
O(C3CCC1=C(C2=C([NH]1)C=CC(=C2)Cl)C3)C4=C(C=C(C)C=C4)[N](=O)=O,EDED82272FC8BD04_4CB9E2A354B7EDDD_6035_UN,8.54855,00000000000000000000000010000000000000000000000001000000100000010100001100000000000100010111001110000111110100010100001101101111111011110100001111111011100011111111110,CJOYYUCCOJFRQB-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC3(CC(F)(F)C3)C4=CC=CC=C4)C5=CCNCC5,22D0AB9A9CC6B2F9_EF321DCCB30FD153_6034_UN,8.201951,00000000000100000000000000000000000000000010000000100000000000100110000000011000001101110001000010111100110100011000001011100100110000100110001001011001010110101111010,DPSWGIOSKFSFNY-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)C3=NC2=C(C=CC=C2)N3CC4CCCN4CC5CCCN5,59D967A9AAA74B95_A5B91ECD1F33328C_6034_UN,8.27382,00000000000000000000000000000000000000100010000000000000000000100100000000010101001101110011000010001100110100010000001011100100110000100110001011011011010110101111010,CEDDTEVFEQEJQX-UHFFFAOYSA-N
FC1=CN=C(C=C1)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,9546F21A5D9BD0A7_D92F46075663617B_6041_UN,8.499874,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101000000100010000001011100100110001110110001011011011010110101111010,SHUCOZSAJMWCSY-ACJLOTCBSA-N
C[Si](C)(C)C1=NC(=CS1)NC4CN(CC2=CC=CC=C2)C3(CCCC3)C4,8F51FCCA371B9B6C_AD9D42C655171AB6_6041_UN,7.9372344,00000000000000000000100000000010000010100000000100000000000000000110000000110101110101101001010010001000111000011000001011100100110001010110011000011101010110101111010,DEHWASCWGWKZSP-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC(CC2OCCC2)C#C)Cl)C3CC3,A16D1138A81C5506_8DC08E83E5AD9EF1_7022_UN,7.939598,00000000000000000100001000000000000000000000000000000000010000100000000000000000000100010001000011000001100111010000001000000000110011110100000010010011110111101111110,QFMVQNFYPSMBGN-UHFFFAOYSA-N
CN(C)C3CCN(CC1=CC=C(C=C1)NCC2(CCNCC2)F)C3,C09D21AC57E3E276_FA47A412A531B008_6041_DP,7.855615,00000000000000000000000000000000000000000010000000000000000000000010000000110001101101110011010010101000100110011000101011100000110101110110001001011101010110101111010,SDCJBMUWHYEGFU-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NCC2(CCCCC2)C3=CC=CS3)F)C4,E2643926BA347B90_CD3D0C22C4DF6DC0_6041_UN,7.427731,00000000000000000000000000000000000010000010000000000000000000100010000000010000011101111011000010101100010110011010101011100100110001110110001011011001010110101111010,KWSLNXMRDHTQKC-UHFFFAOYSA-N
C1(=CC(=CC(=C1)F)COC2CCCCC2)NCC3OC(C)(CC3)C,75210C44696429C5_E1C10143CA3BDB50_7022_UN,7.9762363,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010011000110001000000111001001101000000011110011110110000101010101110111111111110,ULFWRHDUXBRCTN-UHFFFAOYSA-N
N(C1=CC=C(C=C1)N2CC3CCC(C2)O3)C(=O)[C@@H]4CCC[C@@H]4C5=CC=C(C=C5)F,2CB45F5CA956502B_E2336968C6828B7D_6038_UN,7.84806,00000000000000000001000000000000000000000010000000000000010000100000000000010000000101110011100110101000010100100000011011100100110011110110001001011011111011110111110,XIALTXUOQSVYDZ-BWWMBTDCSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(CC)CC3)C4CCNCC4,6F157B0B27854005_04A530E6CAD813DA_6034_UN,8.666757,00000000000000000000001000000000000000000010000000000000000000100110000000010000001101110001000010101100110100011010101011100100110000100110001001011001010110101111010,JLSRXQOGRXRAHP-UHFFFAOYSA-N
C1CC(CCN1)C2=CN(C3=C2C=CC=C3)C[C@H]4[C@@H](CNC4)C5=CC=C(C=C5)Cl,B05C0A8EA8AF3F8E_8755B8FB5E18F77E_6034_UN,8.815863,00000000000000000000000000000000000000000000000000000000000000100100000000010000101101110011000010101101110100010000001011100100110100100110001001011011010110100111010,NZNJDONALGSMRE-UGKGYDQZSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCCC(CC)C3,AD811E0025536B00_0847D59574E2F831_6041_UN,7.9535375,00000000000000000000000000000000000000000010000000001000000000000100000000010000101100010011011010001100010110000010101011101100110001110100001001011101010110101111010,BQOGIKGAEIINPC-UHFFFAOYSA-N
N1CCOC(C1)C2=CC=C(C=C2)NC3=CN=C([Si](C)(C)C)C=C3,1B3CE68B40E34768_EA714310DEC4701C_6041_DP,7.2279487,00000000000000000000100000000010000000000000000000000000010000100100000000100001001000100001010100101000100001011000001011000100110111010110011001011101110011101111110,NLZVPNALMNSHRL-UHFFFAOYSA-N
CC4(C)COC3(C[C@@H]2CC(OCCC1N(C)CCC1)C[C@@H]2C3)OC4,0DCFD7DB463FE087_74CBD97CF4A797AD_6039_UN,7.3067894,00000000000000000000000000000000000000000000000000000000010000000010000000110000000101100100010011101100010011011001101011110011110010000110010100111110110111111101110,CXQZETIYFCJKOV-OQSMONGASA-N
FC1=CC2=C(C=C1)N=CC(=C2)NCC3CCN(C(CC)C)C3,8E5A7E484094BDE1_E7B7F9AD4C1087EB_6041_UN,8.520874,00000000000000000000000000000000000000000010000000000000000000000100000000010001101101110011000010101100010110010011101011100100110001110110001001011101010110101111010,OTBOHQWLISHDBY-UHFFFAOYSA-N
C(C1CCNCC1)C2=CN(C=N2)C[C@H]3[C@@H](CNC3)C4=CC(=CC=C4)F,A3849E18016523E0_C24262EF1917B9C4_6034_UN,7.9589176,00000000000000000000000000000000000000000010000000000000000000100100000000010101101101110011000010101000100100010000001011100100110100100110001001011011010110100111010,HWEGATVCNROLRV-PXNSSMCTSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC(COC)C3CCCO3,D440C7632EE82414_5D73AE0489AE2301_6041_UN,7.801619,00000000000000000000000000000000000000100010000000000000010000000100000000000100000100110111010110100100110101010001001011000110110011110110011011010111110111111111110,NJVWTRCPNJPQSC-UHFFFAOYSA-N
N5C[C@@H]4CN(CC1=NC=C(N=C1)N[C@@H]2CCN(C)[C@H]2C3=CC=C(C=C3)F)C[C@]4(C)C5,57C49BABAE03B6A7_1B61399352FFCBA8_6041_DP,8.33641,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101110011010010101100110110011001101011100100110101110110001001011111010110101111010,WHBQMQNMBPPKIY-QRRACGJLSA-N
FC1=C(C=CC=C1)C2=CN(C(=N2)C3CCCN3)C[C@H]5N[C@H]4CCCC[C@H]4C5,B5AA2F2A21510747_81FB8338F5D27056_6034_UN,8.370598,00000000000000000000000000000000000000100010000000000000000000100100000000010101001101010011000010001100110100010000001011100100110100100110001011011011010110100111010,HMXMCOPYXWEIEZ-XRBVGFERSA-N
CC3(C)[C@@H](OC2=CC(=C1OCCC1=C2)Br)[C@@H]4CCN[C@H]34,CF6DF6FD80DFB64E_C4764ED6C5194A31_6035_UN,8.249801,00000000000100000001000000000000000000000000001000000000010000000010000000100000001100010011000011001100110111011100001011000011000010100110000110010111110011111111110,AGBGYGZGRYSQQQ-UGFHNGPFSA-N
N(C1C2CCC(CC1)CO2)C(C3=C(CCC)[N](N=C3)C4=CC=C(C=C4)F)=O,C30C304CBFA26068_40F59AB8074D6514_6038_UN,7.86366,00000000000000000001000000000000000000000010000000001000010000100100000000010000100100010011101111100000110101110011011011101100110011110100001011011011111111111111110,DTXFIYKPBFFELN-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2CCC=CCCC2)F,3D37A69B6DA8E30F_F99149C10EE3F34B_7022_UN,7.9357147,00000000000000000000000000000000000000000010000000000000000000000000000000100000001001110011010000011100000100000001001000100000110001110010001010011111010110101111010,BGEXNUVTCPJGCC-UHFFFAOYSA-N
CC1=CN(C2=C1C=CC(=C2)F)C[C@H]3[C@@H](CNC3)C4CCOCC4,85FC2265F37C8878_75BEA38EF4759B7B_6034_UN,8.678646,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011000010101100010111000000001011100100110010100110001001011011010111101111110,VYDXEXNHNZRBDR-YJBOKZPZSA-N
O[C@H](CBr)C1=CC=C(C=C1)C2=CC=C(C=C2)NC34CC(OC3)CCC4,F804983BD6354812_3E155BA6E884EAE3_6041_UN,8.46961,00000000000000000001000000000000000000000000001000000000010000100010000000000000000100000011000111000000110001011000001000000100110111110111000001010001110111110111110,PSTJRCDJVKKHAL-NYLDSWQDSA-N
CC1=CN(C2=C1C=CC(=C2)Cl)C[C@H]3[C@@H](CNC3)C4CCOCC4,B8B9416C8AFDF0A4_F9FCFC34B1131028_6034_UN,8.67864,00000000000000000000000000000000000000000000000000000000010000100100000000010000101101110011000010101101010111000000001011100100110010100110001001011011010111101111110,LPMAPAPJFXEJQO-YJBOKZPZSA-N
O=[N](=O)C1=CC2=C(C=C1)C(=NC=C2)NCC3C4=C(CC3)C=C(C=C4)F,58F0217CC3941700_342BB678BD35433F_6041_UN,8.340114,00000000000000000000000010000000000000100010000001000000100000010100001100000100001000010011001010101110010100000000001101101100111001110100001011011001010110110111110,VJEVZTOLYRUBHN-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)N[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,0F184C739F910AE7_E682DE3309BBBC05_6041_UN,8.651648,00000000000000000000001000000000000000000010000000001000010000100100000000010001100100010011011111000000100101010000001011101100000011110100001010011011110011101111110,JTLXWSLUGRBHOI-PBHICJAKSA-N
CC1=CC(=C(C=C1)OC(F)F)C=CC2C3(CCNC2)CCOCC3,AA8F61AF9117C035_A98FC2B845CD36A2_7019_DP,8.564234,00000000000000000000000000000000000000000010000000000000010000000010000000000000001000100001000000111000111101011100001011000011110010100110000111010011110001111111110,POOLPQLPGDXLMF-UHFFFAOYSA-N
N(CC1CC2CCCC(C1)C2)C(=O)CC3=C(C=CC=C3F)F,CCE5E46BB9BD0E08_2303AF048CB68793_6038_UN,7.090864,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010010100000001100110100110000011000000000110010100000000011010011011110100111110,KQZCFISGWADSKH-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)C=CC2=C(C)[N](N=C2)C3CCC3)OC(OC4)C5=CSC=C5,EFE5ABAB481C7788_B11A5E15B2D60EA6_7019_UN,8.572861,00000000000100000000000000000000000010000010000000001000010000100100000000010000100100011100001010110100010111010100001011111100000001100100001011011010110011111111110,SGRVRIZGHIPVAF-UHFFFAOYSA-N
C[N]2C=C1N=CC(=CC1=N2)NCC(N3CCOCC3)C4=CC(=CC=C4)F,3A1A858D7A4B5394_F3F44718FCDAFCA4_6041_UN,7.421906,00000000000000000000000000000000000000000010000000001000010000000100000000010001101101110001011110101100010101010000001011101100110011110110001001011001010111101111110,IGCFOAPSSJCEMY-UHFFFAOYSA-N
N4CCC1=C(C(=CC=C1)NC2=CC(=C(C=C2)N3CCCCC3)F)C4,82CB9B0E0F82AB83_0C1ADA7655CB94F9_6041_DP,7.784191,00000000000000000000000000000000000000000010000000000100000000100000000000010000101001110011000000101100110100010000001011100100110101110110001011011011010010100111010,JEHSMEAHLOHCHW-UHFFFAOYSA-N
FC1=C(C=CC(=C1)NCCC2CCCN(C)C2)OC3CCOCC3,E6068E62D383F910_AFBE0BCA0F979024_6041_UN,7.362379,00000000000000000000000000000000000000000010000000000000010000000000000000010000001001110101010000101000100111010101101011100011110011110110001111011011110111111111110,PTOUCUAEDKFDHH-UHFFFAOYSA-N
CN(C1CCCNCC1)C2=NC=C(N=C2)N[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,3F36351C80163049_981C1B3E053A2DE5_6041_DP,8.289972,00000000000000000001001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010000101011100100110101110110001011011011010010101111010,NGPZAHRUPJDXKG-DTLKIFBZSA-N
CCN4CCC1=C(C=C(C=C1)NCC2(CCNCC2)C3=C(C=NC=C3)F)C4C,1C4BA08043E4FFFE_8DBAAC1D125B8345_6041_DP,8.335001,00000000000000000000000000000000000000000010000000000000000000100110000000010000001001110011000000101100110110011010101011100100110101110110001011011111010110101111010,YKBDDIPBHLHNKR-UHFFFAOYSA-N
CN3CCC1=C(C=CC=C1NCC2(CCNCC2)C)C3,5BFF045DD3C7BECC_6643C4F0FB389D29_6041_DP,7.611677,00000000000000000000000000000000000000000000000000000000000000000010000000010000001001100011010000101100110000011001101011100000110101010110001011011101010110101111010,GKVMDDGDEJRIDO-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CCCC23CCC3)Cl)C4CC4,46E0B6C5B3475F64_DFF61DBC40773A3E_7022_UN,7.543776,00000000000100000000001000000000000000000000000000000000000000100010000000000000000000010011000010000001110110011000001000000000110001110000000010010011000010101111010,BZCWBZGGVRDSPB-UHFFFAOYSA-N
O(C1CSCC2=C1C=CC=C2)CC3=CNC(=O)C4=C3C=CC=C4,3F3782C0BDFE4B05_0FB69907CA2AA389_6039_UN,8.761336,00000000000000000000000000000000000010000000000000000000000000000100000000000000000000101010100001100100010001100100010011000111110010000110000111000001111111010111110,NTFYGXHKBOPDMV-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2C3(CCCC2)CCCCC3)F,1DF0B5F4E491C6A8_0BA6123D4170A7C3_7022_UN,7.7374115,00000000000000000000000000000000000000000010000000000000000000000010000000100000000001110011010000001000110100011001001000100000110001110000001011011111010110101111010,PLHRVRMFTCXCEU-UHFFFAOYSA-N
CN(CC1CCNC1)C2=NC(=NC=C2)N[C@H]3[C@@H](C3)C4=C(C=C(C=C4)F)F,1A604F7E5B87CA31_6092A388AF47F639_6041_DP,8.191359,00000000000000000000001001000000000000100010000000000000000000100100000000000100101101110011010010101000101110010001001011100100110101110110001011011011010110101111010,DBAVCXGZZMANTA-BRCNOLGNSA-N
C[N]1N=CC=C1NC(C3CC2CCC(N2C)C3)C4=CC=C(C=C4)Cl,D87D82EB93456C61_925BA407D875C80C_7022_UN,7.873852,00000000000000000001000000000000000000100000000000001000000000000100000000010101100101010010011010100001010110010000101011101100110001110100001011011111000010101111010,MAKHWOHIVUBDBE-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C(C3=C(C)C4=C([NH]3)C=C(C=C4)F)=O,0F1E455370252EE0_A5ED7EDA0DAF1ABF_6038_UN,7.928016,00000000000000000001000000000000000000000010000000000010010000000100000000010001001101110001100110101100110100110000011011100100110110100110001011011011111111111111110,SFVCQBBHKOITJZ-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)N[C@H]4[C@H](C3=CC=N[N]3C)C4,467AA30F709FD2A5_25C587A83C178BD9_6041_UN,7.866708,00000000000000000000001000000000000000000010000000001000010000100100000010010000100100010010011010000000100111010000001011111100000011110110001010011011010011111111110,JFAUFHLIVCTRHJ-BXUZGUMPSA-N
FC2=C1N=CC(=C(C1=C(C=C2)F)NCC3CNCC(O3)(C)C)C#N,5464DBA5B82C47F6_F399706B6029CBDC_6041_DP,7.9265456,00000000000000000000000000000000000000000110000000000100010000000110000000100000101000110010000100101100010110001001000011000100100111110110001011000111110111101111110,MFGLWYFHCSZGMB-UHFFFAOYSA-N
CC(C)(C#N)C1=C(C=CC(=C1)NCC23CCCNC2C3)F,B9131F02E2F07910_17FB74293C00653D_6041_DP,7.72318,00000000000000000001001000000000000000000110000000000100000000000010000000100000101000010011000000101000110100011000001001000000110101110110001011010111010110101111010,ICCYBGQVDVDEKL-UHFFFAOYSA-N
BrC1=C(C=CC=C1)C3=NC2=C(N=CC=C2)N3CC4CNCCC45CCN(C)CC5,8BFD4673CE43BFF8_4AABEFD8D9512A1C_6034_UN,7.7930484,00000000000000000000000000000000000000100000001000000000000000100110000000010101101101110011010010101100110100011001101011100100110000100110001011011011010110101111010,NYETXQQQGZSBTB-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC2=CC=CC3=C2[N](C)C=C3)C4OCCO4,8626C68766D17ACA_E19D73F85964258C_6041_UN,8.221299,00000000000000000000000000000000000000000010000000000000010000100100000010010001000101010000010010000100010101000000001011110100000011110110001011011011010011111111110,ZMSFUHVDUFUVKF-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC(C2=NC=C[N]2CC)C3CCOCC3)F)CC4,56569FA0C15F57B3_D50E4E3B71D45F1B_6041_UN,7.941,00000000000000000001000000000000000000100010000000000000010000000100000000010101100101110011010010101000000111010011101011100100110011110110001011011111010111101111110,DKJRTLHFBKRRBV-UHFFFAOYSA-N
O(C1(CC=C)CCOCC1)CC2=C(C=CC(=C2F)C)F,F021BA8600E95BDF_4AD7BDC0599174D6_6039_UN,8.069452,00000000000000000000000000000000001000000010000000000000010000000010000000000000000000110100000000110000000111001000001000000011110010100110000111010010110101011011110,ZXHAVCVJRLFRGQ-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC(C)C2CCCNC2)F)CC3,718254525CAD57A4_55F722314A479644_6041_DP,7.9585314,00000000000000000001000000000000000000000010000000000100000000000000000000010001101001110011010000101000100110010001101011100000110101110110001011011111010110101111010,HKDITCCWNRDNAS-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CC3=C(CN2)C=CC=C3,935F69FE21B71B0B_1FBE64FE4C358876_6041_DP,7.458078,00000000000000000000100000000010000000000000000000000010000000000100000000100001001000100011010000101100110000011000000011000100010101010110011011001111010110101111010,JRZGYNPVVXZZHD-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCNC3(C2)CCC3)F)CC4,33D9371E3D030FFF_BFA4E54E9255B64B_6041_DP,7.4239664,00000000000100000001000000000000000000000010000000000100000000000010000000010001101001110011010000101000110110011001101011100000110101110110001011011011010110101111010,WFLDXGTVQARDLX-UHFFFAOYSA-N
CN5CCC1=C(C2=C([NH]1)C=CC(=C2)NC3C(CC)CN(CC3)CC4=CN=C(C)S4)C5,2586873EC14217C3_824D1102369991A6_6041_UN,8.178351,00000000000000000000000000000000000010000000000100000000000000000100000000010000110101101011010010101100110010010011101011100100110101010110011011011111010110101111010,PGBVIIMCKCXAEX-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CC(C)C2CCNCC2)C=CC(=C3)Cl)C4,66A4B9E9306467E0_89940741DB7F1696_6034_UN,8.121555,00000000000000000000000000000000000000000000000000000000000000000100000000010000001101110011000010101101110110010011101011100100110101100110001011011101010110101111010,CDAIQNRIIRPOEQ-UHFFFAOYSA-N
FC1=CC=C(C=C1)[N]2C(=NN=C2C3CC3)NC[C@@]45CCCN[C@H]4CCCC5,D11BAAD370CA8212_00F24CAB9F9D85AB_6041_DP,7.7393565,00000000000000000000001001000000000000100010000000001100000000100110000000010101101101010011001010101100111100011000001011101100110101110110001011011011010110100111010,GSEYENCIFDLZSI-GHTZIAJQSA-N
C[N]1C(=CC2=C1C(N(C=C2)CC3CNCC(O3)C(F)(F)F)=O)C4=CC=CC=C4,65918A2C405D26D5_AEFA6D1549F5CAB6_6034_UN,8.584,00000000000000000000000000000000000000000010000000000000010000100100000000010001101101100010110110101100011100101100010011100101100010100110001111001011111111111111110,VAGZYXWLGNICNE-UHFFFAOYSA-N
CC1=NC(=C(C)[N]1C)NCC2(CCCCC2)OC3CCCC3,E32E55242B8050BF_E75910F321C25B39_6041_UN,7.2130547,00000000000000000000000000000000000000100000000000000000000000000110000000010101101101000011010110001000000010001000001011100011110011010100011110011111110111101111110,PSFGAUVRSAXIEQ-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NC4C(C)(C4)C5=CC(=C(C=C5)F)F,61A266538F7CB44D_4FDE4C7578F72367_6041_DP,8.249332,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011001100011100100110101110110001011001111010010101111010,LTFKXLRHGHMOEH-PXIGHNNKSA-N
N(CCC12CC(C1)CO2)C(=O)C3(CC3)C4=CC(=C(C=C4)F)Cl,E0F2C756967D0F3F_47B5DC1BD7E63523_6038_UN,7.835507,00000000000100000000001000000000000000000010000000000000010000100010000000000000001100010011100011001001110101111000011000000000110010100110000010010011111111110111110,ZIQIMJIPRHFPSS-UHFFFAOYSA-N
N(CCC12CC(C1)CO2)C(=O)C3(CC3)C4=CC(=C(C=C4)Br)Cl,02038D9C50F46A0A_C382282CE80D28C0_6038_UN,7.83548,00000000000100000000001000000000000000000000001000000000010000100010000000000000001100010011100011001001110101111000011000000000110010100110000010010011111111110111110,AILSNORMYBIXLS-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CCCC2)N3CCOCC3)F)CC4,16A645C86DA92F56_DBAD1A2D357CD130_6041_UN,7.933148,00000000000000000001000000000000000000000010000000000000010000100010000000010001101001110011010110101000000111011001101011100000110011110110001011011011010111101111110,PNFHYSNHXCWUKU-UHFFFAOYSA-N
FC1=C(C(=CC=C1)F)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C,C1C965D0DD22DBE5_E172EAECE7568B14_6041_UN,8.517823,00000000000000000000000000000000000000000010000000000000000000100100000000010101101101110011010010101000000110010001101011100100110001110110001011011111010110101111010,QSPIEBAIMBADNQ-YVEFUNNKSA-N
O=[N](=O)C2=C1C=CC=NC1=C(C=C2)NCC3C4=C(CC3)C=C(C=C4)F,A1FDD96119D81FE9_F96F860ED4995D55_6041_UN,8.338054,00000000000000000000000010000000000000000010000001000000100000010100001100000001101000010011001010101110010100000000001101101100111001110100001011011001010110110111110,LSANUWQIZXGRBP-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)N[C@H]3[C@@H]4[C@H](C3)C5CCC4C5,4915FA144B6AB886_6DFCEF18CE19B14F_6041_UN,8.518967,00000000000100000001000000000000000000000010000000001000000000000100000000010000100100010001011010000100110100010000001011101100110001110100001001011001000010101111010,UKKFOAVMAYZYHG-OYARDAQQSA-N
FC2=C1OC(=NC1=CC=C2)NC[C@@H]4[C@@H](C3=CN=C[N]3C)N(CCC4)C5CC5,83C1915364F96659_6720113B11795821_6041_UN,8.348434,00000000000000000000001000000000000001000010000000000000010000100100000000010101101101010011010110101100011100110000011011100100110001110110001011011011110110101111110,KKAAWRZOOYTTOT-ACJLOTCBSA-N
FC5(F)CCC1(CC1C=CC4=C(OC3C2(CCC(C2(C)C)C3)C)C=CC=C4)CC5,01E49AAC73B8454B_076CF6EC5818444D_7019_UN,7.319282,00000000000000000000001000000000000000000010000000000000000000000010000000100000000000010000000010010000010110001101101000000011110010100000010111010110100001001011110,LTOCOLNDVGQZJP-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2C3=C(COC2)C=CC=C3,44B2153556849F5E_ECC721700488F281_6041_UN,7.63019,00000000000000000100100000000010000000000000000000000000010000000100000000100001001000100010010001101100010001001000000011000100100001010110011011001111010111101111110,NIYGXGWLHJNSME-UHFFFAOYSA-N
ON=CC1=C(C(=CC=C1F)C2OCCO2)NCC3(CC3)C4=CC=C(C=C4)F,B54DB82754783A0A_1B0B9B74FC212708_6041_UN,7.603819,00000000000000000000001010000000000000000010000000000000010000100010010110000010101100010011001011001010000101001000001110011100010111110111001011110011010111110111110,FAJUASLAKVAFAX-UHFFFAOYSA-N
C1(=CC2=C(N=C1)CCC2)NC3=CC=C(CC[Si](C)(C)C)C=C3,5A20DA944B3FDFB9_3954DF1BB35592A0_6041_UN,7.6488137,00000000000000000000100000000010000000000000000000000000000000000100000000100001000000100001010010100100010000011001101001000100010001010100011011011101010110101111010,YNOOENBLSCJSCJ-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NC(C3=NC=C[N]3CC)C4CCOCC4,F9679E16BAAF0C8D_0A335D62C3BE58DA_6041_UN,7.3472204,00000000000000000000000000000000000000100010000000000000010000000100000000010101000101110011000010101100010101000010001011100100110011110110001011011011010111101111110,PHIZWLFSKQPQNE-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CC2(C)CCCNC2)C=CC(=C3)C)C4,4FFAB86BC7DC173E_2DDCD82DB5A1F532_6034_UN,8.057318,00000000000000000000000000000000000000000000000000000000000000000110000000010000101101100011000010101100110010011011101011100100110000000110011011011101010110101111010,UYZAJQPFQPFCDR-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC2CCCC3=C2C=CN=C3,261EBD60BAB9E9AD_F8E32FD0B85EF801_7022_UN,7.7801876,00000000000000000000100000000010000000000000000000000000000000000100000000100000000000100011010000100100110000011000001001000100100001010100011011011101000010101111010,PLEYFDCIVKILCL-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NC2CCN(C)C23CCCNC3)C=CN=C4,8F6636A8AC37613B_BE050B11E038378D_6041_DP,8.437825,00000000000000000000000000000000000000000010000000000100000000000110000000010001101101110011010010101100110110011001101011100100110101110110001001011001010010101111010,QAINWJWWSNTREU-UHFFFAOYSA-N
O([C@@H]1COC[C@H]1N2CCOCC2)CCC(C)(C)C3CC3,5FA7CA315FA8B319_79982BB788B0EB93_6039_UN,7.168371,00000000000000000000001000000000000000000000000000000000010000100010000010110000000101100100000111101000000001011001101011100011110011000110000100111110110111111101110,VSUZDLOCYBZCKM-HUUCEWRRSA-N
NCC(COCC1CNC2(CO1)CCC2)C3=CC=C(C=C3)F,5DF2D099AC6BEC40_1C57EE657EA75435_6039_DP,8.059336,00000000000100000000000000000000000000000010000000000000010000000010000010000000001010110011000101101000110101011000001011000010110110100110001001010001110111110111110,JUHYDNVMYQZXIO-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC4CC3CCNCC3CC4,805E8DCB22FD3A0D_58DF9E803691B698_6041_DP,8.190304,00000000000000000000000000000000000000100000000000000000000000000100000000000100001000100011000000101100110010010000001011000100110101010110011011010111010110101111010,WPLGITYPQZURES-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CCN([C@H]2CCN[C@H]2C)C)C=CC(=C3)Cl)C4,9AC7A88188A14584_AD7CE06FEB8039ED_6034_UN,8.1887245,00000000000000000000000000000000000000000000000000000000000000000100000000010001101101110011010010001101110110010011101011100100110101100110011011011111010110101111010,JIQMYHXIOQHQJL-NUSPTKLCSA-N
N(C1CC2CCC(C1)O2)C(C3=CC=C(CSC)C=C3)=O,D84D0702FDC729A2_DA27B40539BC862D_6038_UN,8.236654,00000000000000000001000000000000000000000000000000000000010000000000000000000000000100101001110011100000110000110001011000000000110011000100000001010001111111111111110,IMZNEPUKYUVXMT-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N=C(CC#N)N(C2=O)CC3C(CNCC3)C4=CC=CC=C4,1531F20DECDBA4CC_C467DD1CFE52F074_6034_UN,8.287542,00000000000000000000000000000000000000100100001000000000000000100100000000010100101001110001100001101100110100110100011011100101110000100110001111011011011110100111110,KZSMRUCMEJPZFR-UHFFFAOYSA-N
N3C[C@@H]1COC[C@]1(C=CC2=C(C(=CS2)C(F)(F)F)C#N)C3,030E350B23068060_829B92CC72F13517_7019_DP,8.5616045,00000000000000000000000000000000000010000110000000000000010000000010000000000000011100101011000011011100011101001000000011000000110000100110001010000011010001100110110,JRJOFFUOIPJQEP-RNCFNFMXSA-N
CC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3CCOCC3)C=CC=C4)Br,9F46002E80321143_C53C4C6A6FA07D69_6034_UN,8.630559,00000000000000000000000000000000000000000000001000000000010000100100000000010000101101110011000010101100010101000000101011100100110010100110001011011011010111101111110,ORSUVNKMFGNJJS-RDJZCZTQSA-N
O=[N](=O)C1=C(N=C(C=C1)NCC2=CC3=C(C=C2)CCOC3)C4=CC=C(C=C4)F,37E4694A87982E55_5F0B2B0FD06DC867_6041_UN,7.7243257,00000000000000000000000010000000000000100010000001000000110000110100001100000101001000110000001001101110010101000000001111101100111011110110001011111011010111110111110,QPFGHGKRLPSMCM-UHFFFAOYSA-N
C1NCC1C3=NC2=C(C=CC=C2)N3CC4CC4(C)C5=NC=C(C=C5)F,83E02CB4E310121A_02B06EFAAB560AE3_6034_UN,8.464271,00000000100100000000001000000000000000100010000000000000000000100110000000010101101101110010000010101100010110001001100011100100110000100110001011001011010110101111010,VDHWIMKMHLHETJ-UHFFFAOYSA-N
CC1=C(C=C(C=C1)NCCC3CCN(C2CCN(C)CC2)CC3)CC=C,AAF761B1DBB5D3E8_DACD410FCA504A56_6041_UN,8.166977,00000000000000000000000000000000001000000000000000000000000000100000000000010000101001100001010000111000100000010001101011100000110001010110001011011111010110101111010,SDDGCIPVFFRIJU-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCC2(CCOCC2)C3=NC=CC=C3,1DD9866A298ED6E2_1976D5D32B79FBA4_6041_UN,7.6840463,00000000000000000000100000000010000010000000000000000000010000100110000000100000111100101011010010101000000001001000001011000100110011010110011011011111010111101111110,KSAQNTBPGMFHBI-UHFFFAOYSA-N
C(C2CCCC1(CC1)C2)=CC3=C([N](N=C3C)C4=C(C=C(C=C4)F)F)C,D2715B237E5A9767_C1CAB840A4DAA4B8_7019_UN,8.295388,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011110000010101111010,KICUGGDFKVUDND-UHFFFAOYSA-N
N(CCN1CC2C(C1)C3CCC2C=C3)C(C4=C(C=CC(=C4F)C)F)=O,13844669932EB854_BA7C802857E7D02F_6038_UN,8.36646,00000000000000000000000000000000000000000010000000000000000000000000000000010001001101110001100010011100110100110000011001100000110000100110001011011011011110101111110,XFLOQLXFTAJQRD-UHFFFAOYSA-N
CC4(C=CC1=C[N](C)C2=C1C=CC(=C2)Cl)CC3OC3C4,32F5887F5480E291_A64258A626254CA6_7019_UN,8.177466,00000000000000001000001000000000000000000000000000000000010000000110000000010000000101010000010010110101010100001001000011100100110010100100000001001100100011101111110,KLGFVTQPCQMSPD-UHFFFAOYSA-N
O=[N](=O)C1=CC2=C(C=C1)[NH]C=C2NCC3C4=C(CC3)C=C(C=C4)F,41930B83A4B07BE3_4FD1FD1429D38307_6041_UN,8.359913,00000000000000000000000010000000000000000010000001000110100000010100001100000001101100010011001010001110010100000000001101101100111101110100001011011001010110110111110,LOELSJHZVMRWJY-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC3=CC=C(C=C3)C46CC5CC(CC(C4)C5)C6)F,A2D4A14668EA6A51_17DCD2061058F5AA_6041_DP,7.8950067,00000000000000000000000000000000000000000010000000000000000000100010000000000000001000010011000000101100110100011000001001000100100101110100001011010011010010100111010,NBQHEUAIRDAVEX-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC2CCCCC23CCC3)F,FF66957D41BF2E71_C544BE775783ABFE_6041_UN,7.5645304,00000000000100000000000000000000000000000010000000000000000000000010000000100000000001110011010000001000110100011001001000100000110001110000001011011111010110101111010,INWHIPYTNOEOEZ-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C#N)[N]2C=C(C=N2)NC4COC3(CCNCC3)C4,E1A35C1DB7C47194_43D7D93BA47D4731_6041_DP,8.0957,00000000000000000000000000000000000000000110000000001000010000100110000000010001101100110001001111101000110101011000001011101100110111110110001011011011110011100111110,VOQFHAXTPGHTNO-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NCC3(C)CCC4(CC3)OCCO4,623FF1DA9CF8ACE5_6DA35EA47D62B638_6041_UN,6.990843,00000000000000000000000000000000000000100000000000000000010000100110000010010100101101100011010010101000010011011001101011110000110011010110001011011111110111111111110,GTHHECUWESAPOQ-KRWDZBQOSA-N
N3CCCCC(C=CC1=C(Cl)[N](C(=N1)N(C)C)C2=CC=C(C=C2)C)C3,E47CABFEF397B57D_5913B8D1C93F857F_7019_DP,7.4345255,00000000000000000001000001000000000000000000000000000000000000100100000000110101001101110011010010011001101100010000001011100100110001110110011010011111010010101111010,JDNLZFYEDIZILR-UHFFFAOYSA-N
C[Si](C)(C)C1=C(N=C(C=C1)NCC2CC3=C(CCC2)C=CC=C3)F,74A3EDAF14F8DCD8_CBDEE28FEFEEDD6C_6041_UN,7.2386203,00000000000000000001100000000010000000100010000000000000000000000100000000100100001000110011010000101100010100001000001001000100110001110100011011011111010110101111010,HAMDAQPFISVONQ-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCCN3CC2CC2C3,2B391F1875A7A255_E41DBC7CBDD51C80_6041_UN,7.9530616,00000000000000000100101000000010000000000000000000000000000000000100000000110001001101100001010010101000110000011000001011100000110001010110011011011111010110101111010,IKZJTJPEQRYGKB-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CC=N2)NC4CC3(CCN(C)CC3)OC5=C4C=CC=C5,D2822B16DA0320DA_6E60831D58A123D5_6041_UN,8.27416,00000000000000000000000000000000000000000010000000000000010000000110000000010001000001110001010001101100110100011101101011100100110011110110001011011011110011101111110,XIHIPNAGJKQIIK-UHFFFAOYSA-N
CCNC5CCC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3=CC=C(C=C3)Cl)C=CC(=C4)Cl)C5,5786760AEE295259_9D44D785C376FFD6_6034_UN,8.06501,00000000000000000000000000000000000000000000000000000000000000100100000000010000101101110011000010001101110110010010001011100100110101100110001011011011010110101111010,AWMOYAFOVONVQC-FLOOPIEZSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCCC(C)(C)O2)F)CC3,80271B71D4149BF3_47E061F0A27660D9_6041_UN,7.6342754,00000000000000000001000000000000000000000010000000000000010000000010000000110001101001110011010100101000000110011001101011100000110011110110011011011111110111101111110,MGOSECFPEWMDBY-UHFFFAOYSA-N
CC1(C)CCSC2=C1C=C(C=C2)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,C0C0A6F8C5FA4A8D_0A8A36107654F817_6041_UN,7.187032,00000000000000000000000000000000000010000010000000000000010100100010000000100000011100011011000011101100010101001001101010000100110011110110000011010111110111101111110,LFFQGSQEZFRCTR-KKSFZXQISA-N
CC4(C)COC3(C[C@@H]2CC(OCC1=CN=C(F)C=C1)C[C@@H]2C3)OC4,374D8A8668D73B5D_6CF97F745267C752_6039_UN,8.1699915,00000000000000000000000000000000000000000010000000000000010000000110000000100000000000010100000011100100010101001001000011010011110010100110000101100100110111011111110,YCJXHMFYJQGSEE-XYPWUTKMSA-N
CC1=CN(C2=C1C=CC(=C2)C)CC3CCCN3CC4CCCN4,590234409CB0B032_90E69626CBFB9D70_6034_UN,8.322222,00000000000000000000000000000000000000000000000000000000000000000100000000010001001101100011000010001100110010010000001011100100110000000110001000011111010110101111010,XUFSABUOBIPSAO-UHFFFAOYSA-N
C1(=CC2=C(N=C1)CCOC2)NC3=CC=C(CO[Si](C)(C)C)C=C3,366A87AF1EDA1459_AC6888CAF1A38B75_6041_UN,7.5578322,00000000000000000000100000000010000000000000000000000000010000000100000000100001000000100001010001100110010001011000101011001110110011010110011011011101010111111111110,JYLNGWSTCHBOLW-UHFFFAOYSA-N
CC(C)C1=CC(=C(C=C1)NC3CC2CCOCC2CC3)F,4316F9F5D7810C6C_1E7DFFB8EE6E1790_7022_UN,8.383851,00000000000000000000000000000000000000000010000000000000010000000000000000100000000000110011000000100100110101010000001000000000110011110110000011010111010011101111110,POZJGNBGIWKSHX-UHFFFAOYSA-N
FC1=CC2=C(C(=C1)F)C=CC(=N2)NCC(N(C)C)C3CCCCC3,5DA0D71960F8AFB3_FE1FEF65DC0982DE_6041_UN,7.8851027,00000000000000000000000000000000000000100010000000000000000000000100000000100101001001110001010000101100010110010000101001100100110001110100001001011101010110101111010,CRODWSWIIFYBRO-UHFFFAOYSA-N
C[N]1C5=C(N=C1CCNC(C24CC(OC23CNC3)(C)C4)=O)C=C(C=C5)F,FE8DE5F657A59056_40A54DB77BF7D5EB_6038_DP,8.064686,00000000100100000000000000000000000000100010000000000000010000000110000000010101101101110111110111001100110110111001111011100100110110100110001010011111111111111111110,NMNRYNWOXLDDBM-UHFFFAOYSA-N
CN(CC1CCNCC1)C2=NC=C(N=C2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,F0ED7BACC156EE3C_9F63FEE02A1323F6_6041_DP,8.026123,00000000000000000000001000000000000000100010000000000000000000100100000000000101001001110011010000101000100110010001001011100100110101110110001011011011010110101111010,VBKMBQXTJKRUTO-JKSUJKDBSA-N
FC1=CC2=C(C=C1)N=CC(=C2)NCC3CCCN(C)C3C4=CC=CS4,0AA36209CCFEB6BC_ABB280D73BD62A31_6041_UN,8.456506,00000000000000000000000000000000000010000010000000000000000000100100000000010001111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,ILBWVNJPWMZFID-UHFFFAOYSA-N
CN(C1CCCCC1)C2=NC(=NC=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,137B07A79F4EA6B8_97DFEFE8A3FA3897_6041_DP,7.8519726,00000000000000000000000001000000000000100010000000000100000000100100000000000100101001110011010000101000101110010000101011100100110101110110001001011011010110101111010,GCSYYLHHFNYPJX-GHTZIAJQSA-N
FC1=C(C2=C(C=C1)C=CC=N2)N[C@H]4[C@H](C3=NC=C[N]3C)OCCC4,DEFF49458D726EB2_169C9EC7DEFB562B_6041_UN,8.193016,00000000000000000000000000000000000000100010000000000000010000100100000000010101100101010011010110100100110101010000001011100100100011110100001011011011110011101111110,WMEYLIXLPGKIIY-RHSMWYFYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)N[C@@H]4CCN(C)[C@H]4C5=CC=C(C=C5)F,E0089EF871D2B43D_197652E4CC0EAD7A_6041_DP,8.18047,00000000000000000001000000000000000000100010000000000000000000100100000000010101100101110011010010101000110110010001101011100100110101110100001001011111010010101111010,SSNQGJWSFOVLKY-ZNOYZCKDSA-N
N(CC1=CC2=C(C=C1)OCC2)[S](C3=CC4=C(C=C3)[NH]C=C4)(=O)=O,2EF5A0F74AEA609E_70A6B086CEB558FC_6029_UN,8.769291,00000000000000000000000000000000110000000000000000010001011111001101010001000000011100001000001010001110011001001100011011001100101110001110001011111001110111110111110,BHWBIEWOHAGCMN-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4CC(CC4)C5=C(C=CC=C5)F,360C888ABEC449EF_0351C1675990BEDF_6041_DP,7.823472,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000110110010000001011100100110101110110001011011011010010101111010,RNIWQBKXFXMLNG-DMEPUFLLSA-N
CC1=C(C=CC=C1)[N]2C=C(C=N2)NC3C4CC5CC3CC(C4)(F)C5,4341849171F84467_B5F2BE48731F9CE8_6041_UN,7.883853,00000000000000000000000000000000000000000010000000001000000000100110000000010001100100010010001010000100010100001000000011101100100001110100001011001011000010101111010,HCFWRVGOWXIBMR-UHFFFAOYSA-N
CC(C)(C)C2=CC1=C(C=CC(=C1)F)N2CC3CNCC(C)O3,CC540657C03CB779_4A9B330471226387_6034_UN,8.036303,00000000000000000000000000000000000000000010000000000000010000000110000000110000101101110010000110101100010110001001000011100100100010100110011011001111110111101111110,KFPLQLWWXYKMBM-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)NC(C2CC2)C3=C(C=CC(=C3)F)F)C4[C@@H]5CNC[C@H]45,BA51A8961FCEF8D8_71E9979F836EDF36_6041_DP,7.970956,00000000000000000000001000000000000000100010000000000000000000000100000000000101101101110011010010101000010110010001000011100100110101110110001011011011010110101111010,IZHSAVHBDYLCQB-AGXSTUJCSA-N
C(C1CC2CCC1O2)=CC3=C([N](C)C4=C3C=CC=C4)Cl,B991C57A2F3482A3_5F4C7EE66A10B1BB_7019_UN,8.068796,00000000000000000000000000000000000000000000000000000000010000000100000000010000000101010000010010010101010100000000001011100100110010100100000011011010100011101111110,RCMKCIOQEMOFJG-UHFFFAOYSA-N
C[N]1C=CC2=C1N=CC(=C2)NC4(CC3=C(C=CC=C3F)F)CCCCC4,B8558EDFEDC419DC_F7281E89E73E3F1E_6041_UN,8.117899,00000000000000000000000000000000000000100010000000000000000000000110000000010101000101010011010010100100110100011000001011100100110001110100001011011011000110101111010,QUSGTDRXKZSCSX-UHFFFAOYSA-N
CC1=CC(=C(C(=C1)F)NC(COC)C2CCCOC2)F,D72491398756F453_02B2905897666755_7022_UN,7.4258814,00000000000000000000000000000000000000000010000000000000010000000000000000000000000000110011010101100000100101010001001000000010110011110110000011010111010111111111110,IRGZFFRGWBGMSE-UHFFFAOYSA-N
C(C1=NOC2=C1CCCC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,148F5EF9269E1969_3FAA912D76D10DC2_7019_UN,8.030875,00000000000000000000000000000000000000000010000000000000010000000100000100000000000101010000011011010110010110010000101011101100110011110100001011011010100010101111110,BDNQDUNCKWIFEE-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CCCN2CCCCC2C)C=CC(=C3)C)C4,B0F9DEE86577B2CF_B846D527EC4738E6_6034_UN,8.17708,00000000000000000000000000000000000000000000000000000000000000000100000000010000100101100000000010101100010010010011101011100100110000000110011011011110010110101111010,ZXOZEEYSZGLRLA-UHFFFAOYSA-N
CN(C)C4CCN(CC1=CC=C(C=C1)NCC2(CC2)C3=NC=C(C=C3)F)C4,C2F99B116C8F2D3C_7E8B838B46B6BF0D_6041_UN,8.218351,00000000000000000000001000000000000000000010000000000000000000100110000000110001101101110011010010101000000110011000101011100100110001110110001001011101010110101111010,YMRPSMPOAMWGCY-UHFFFAOYSA-N
FC2=C1C=C(N=CC1=CC=C2)NCC3CCCCN(C)C3,A448AC0C61710A22_23CD3FB5893B9BB4_6041_UN,8.073734,00000000000000000001000000000000000000100010000000000000000000000100000000010100101001110011010000101100010110010001101011100100110001110110001001011001010110101111010,RXQPYDCVTYIKPX-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC4CC3CCNCC3CC4,84E34F9CB121959F_E2AC98356A7854C4_6041_DP,8.274485,00000000000000000000000000000000000000100010000000000000000000000100000000000100001000110011000000101100110110010000001011000100110101110110001011010111010110101111010,CZJQOMPWOPXSQL-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C3=C2CCCC3)CC4=NN=C([N]4C)C5CNCCC5,0E0B8D1EC1762FAD_FA2D132B251FCDE2_6034_UN,8.147575,00000000000000000000000000000000000000100000001000001000000000100100000000010101101101110011011010101100110110010000101011101100110000100110001011011011010110101111010,HKSXGAACYUEWGJ-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3CC4CCC(C3)C4,6B8A68A1CD654210_981478D6299B8456_6041_UN,8.5236435,00000000000000000001000000000000000000000010000000001000000000000100000000010000100100010001011010000100110100010000001011101100110001110100001001011001000010101111010,BQLCLYVEIJKDSU-UHFFFAOYSA-N
N4CC[C@@H]([C@H](CNC(C12CC(C)(C1)OC23CCC3)=O)C4)C5=CC=C(C=C5)F,1A77A339A0A269E1_BFD50956D0AF57F3_6038_DP,8.136594,00000000000100000000000000000000000000000010000000000100010000100010000000000000101100110111100011101000110110111001011011000000110110100110001001010011111111111111110,LIOUPQOAKRQEKT-QVKFIVLNSA-N
N(CCC1CC2CCC1C2)C(C(C)=CC3=CC(=C(C=C3)F)F)=O,0607F83121DC4030_80CEB5C7DBB77B43_6038_UN,8.026504,00000000000000000000000000000000000000000010000000100000000000000000000000001000001000010001100010011000110110110000011000000000110000100000000011010011011110101111110,AXRZDWVXWUOVGY-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C3CCC2O3)N[C@@H]4C5=C(OC(C)(C4)C)C=CC(=C5)F,667DCDC30E07C5B4_261BB73811B50CD3_6041_UN,7.782142,00000000000000000000000000000000000000000010000000000000010000000010000000100000000100010000000011100100110100011101001010000100000011110100000011010101100011111111110,SLNMNWHOQCGCJM-VIQWUECVSA-N
N(CC1C2CCC(C1)C2)C(C3=C(C=CC(=C3)C4=C[NH]N=C4C)F)=O,8FC278890D6EBFD3_C88AFAFD59817C70_6038_UN,8.514877,00000000000000000000000000000000000000000010000000001000000000100100010000000000101100010011101010001000010100100000011011001100110100100100001011010011011110101111110,RAIUZSKWOICMIS-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)NCC2(CC2)C3=C(C=CC=C3F)F)C4[C@@H]5CNC[C@H]45,4C0117AD213FDF9C_1219308299341BA8_6041_DP,8.029212,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000010110011001000011100100110101110110001011011011010110101111010,FEUDSNLMIFKQAS-DBIVSCPCSA-N
CN(C)CC1=C(C=CC(=C1)NC3=NC=C2CCCC2=C3)F,19E4067415105FAF_D8998949B70A9306_7022_UN,7.518742,00000000000000000000000000000000000000100010000000000000000000000100000000100100000001110001010010101100010100000001001001100100010001110100001011011111010110101111010,QCHWBXLGUNUDIQ-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@@]3(CCCN3)C,33D08999541FDEC2_1002060283126E1F_6041_DP,7.7836375,00000000000000000000000000000000000000100010000000000010000000000110000000000101001100010011000010101100110110011001101011000100110101110110011011010111010110101111010,LLWWABIEYMIFOE-KRWDZBQOSA-N
C[N]1C(=NC2=C1C=CC=C2F)NCC3C4CCC(C3)C4,123088445C12FE90_2242B8096CB74BAD_6041_UN,8.228631,00000000000000000000000001000000000000000010000000000000000000000100000000010101001101010011010010001100011110000000001011100100110001110100001011011011010110101111010,ZAQOKFBWFQLWPO-UHFFFAOYSA-N
CN1CCC[C@H]1C2=C(N=CC=C2)NC3(CCCCC3)CC4=C(C=C(C=C4)F)F,012F14D55228A353_2212BE5C1B78CEAE_6041_UN,7.806181,00000000000000000000000000000000000000100010000000000000000000100110000000010100100101110011010010101000100110011001101011100100110001110100001011011011010110101111010,LVEFCSFEMNZWST-NRFANRHFSA-N
CC45CCC(C=CC2=C1C=CC=CC1=C(Cl)C3=C2C=CC=C3)(CC4)CO5,84CCFE855B60CB83_D241A3965A00CD17_7019_UN,7.3895082,00000000000000000000000000000000000000000000000000000000010000000010000000000000000000010000000000110101010101001001101000000100110010100100000001010000110001001011110,WMOUWWHINAYIPO-UHFFFAOYSA-N
CC1=C(N=C(S1)NCC2(CCCC(C)C2)N(C)C)C3=CC=C(C=C3)F,7C7D5F392F28FC28_A0404188FF1BBF3E_6041_UN,7.8974524,00000000000000000000000000000000000010000010000100000000000000100110000000100101011101111011010010001000001110011001101011100100110001110100011011011111010110101111010,VGUVIJBLTGXJFI-UHFFFAOYSA-N
CC(C)(C#N)C1=C(C=C(C=C1)NCC23CCCNC2C3)F,88956CD2D6489F89_8636397837F0C988_6041_DP,7.8842535,00000000000000000001001000000000000000000110000000000100000000000010000000100000101000010011000000101000110100011000001001000000110101110110001011010111010110101111010,OJRQVUHKZBORKZ-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NC(C3CCCCC3)C4CCCCC4,681FCA32AFE2C152_E8E9CA8A652193D1_6041_UN,7.9116564,00000000000000000000000001000000000000000010000000000000000000000100000000010101000101010011010010000100011100000000001011100100110001110100001011011011000010101111010,KGTGXAYZLLEOTQ-UHFFFAOYSA-N
O(C1C3CC2CNC1C2C3)C4=C(C=CC=C4)C(=O)CBr,FFF6764F481DADBA_C75547E0FC477DC8_6035_UN,7.974475,00000000000000000001000000000000000000000000001000000000000000000000000000000000001100000111000110001100010000000100000001000011110010100110000111000011111111110111110,GPRDHGLVGCVCMI-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2(C)CCOC2C3CC3)Cl)C4CC4,B68B3FA4F83D7B4F_E85BB44E51A3AE0D_7022_UN,7.444119,00000000000000000000001000000000000000000000000000000000010000100010000000000000000100010011000111000001100111011001101000000000100011110100000010010111110011101111110,XLYIOEWWUGBZPC-UHFFFAOYSA-N
C[N]1N=CC(=C1)C2=NC(=CS2)C=CC4=CC3=C(CCCC3)[NH]4,61D01E962DDCDA47_560F4B9238115EBB_7019_UN,8.145494,00000000000000000000000000000000000010000000000100001000000000100100000000010000110100001011011010010100110000010000001011101100110000000100001010011001000010101111010,BSXJRZFENONWAK-UHFFFAOYSA-N
ClC1=CC3=C(C=C1)C(=O)C2=C(CCCC2)N3C[C@@]45CCCN[C@H]4CCCC5,D07EA5D199D7D47D_717B412470BEB1F2_6034_DP,8.378439,00000000000000000000000000000000000000000000000000000000000000000110000000010000101001010011000001101101110100011100001011100101110000100110001111011001111110100111110,LISISAHQTQODTK-JTHBVZDNSA-N
FC1=C(C=C(C=C1)NC2CCCC3=C2C=N[N]3C)C4OCCO4,1099F5F936862647_9100312EB4E39782_6041_UN,7.9984646,00000000000000000000000000000000000000000010000000001000010000100100000010010000100100010011011010000100110111010000101011111100100011110110001011011011010011111111110,ZODGKTBLOGVMMB-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NCC3CC4(C3)C5CCC(C4)C5)C,FE4E1204FFBB3A8B_9FC18082BF46CAA1_6041_UN,7.6471562,00000000000100000000000000000000000000000010000000000000000000000110000000000000101000010010000010101100010110001000001001000100110001110100001011010111010110101111010,WJKLQENXDAFFTE-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C4=N[N](C3=C(C)C=C(C=C3)F)C=C4)=O,12BBBB19746B78B9_40D7BC4D6BBCDB36_6038_UN,7.884279,00000000000000000000000000000000000000000010000000001000010000100100000000010001101100010001101111001000110100110000011011101100110011110100001011011011111111111111110,DGNZOOIWJFXLTH-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC3CCN(C(CC)C)C3,F490ACCFC9A7170F_E96421BD0CFC9F36_6041_UN,8.109012,00000000000000000000000000000000000000000010000000000000000000000100000000010000101101110011000010101100010110010011101011100100110001110110011011011111010110101111010,QSEJJOASEGOKFJ-UHFFFAOYSA-N
C[N]1C=C(C(=N1)C2CC2)NC(C3CCCO3)C4=CC=C(C=C4)F,778F1EE8C1A8B7DB_15E98DE94F244C27_6041_UN,7.6708007,00000000000000000000001000000000000000000010000000001000010000100100000000010001100100010011011110000000000101000000001011101100010011110100001010011011110011101111110,SXCGZRIAWMBGQY-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C[N]2C=C(C=N2)NC[C@@H]3CNCC(O3)(C)C)F,8A0DB5A95C5D91A2_FACD6C12289668D3_6041_DP,8.746419,00000000000000000000000000000000000000000010000000001100010000000110000000110001101100110011001110101000000110011001000011101100100111110110001011001111110111101111110,HVXLNOGWCHKEKT-AWEZNQCLSA-N
FC1=CC2=C(C=C1)N(C(=C2)C3=CC=CC=C3)CCN(C)C4CNCCC4,4CE4D9D85D4F2B72_3E344EB3EBD2E440_6034_UN,8.102854,00000000000000000000000000000000000000000010000000000000000000100100000000010001001101110011010010101100110110010001101011100100110001100110001011011011010110101111010,FABJYIOJNYWHOM-UHFFFAOYSA-N
N1CC2CCCC1C2C=CC3=C(C)[N](C(=C3)C)C4=CC(=CC=C4)F,5E2A4625C6D8914F_48D2AD6B220BAB52_7019_DP,7.875137,00000000000000000001000000000000000000000010000000000000000000100100000000010000001101010011000010011000110100010000001011100100110001110100001011011111010010101111010,AWWVAYWWCKWWQI-UHFFFAOYSA-N
N1CC2CCCC1C2C=CC3=C(C)[N](C(=C3)C)C4=CC(=CC=C4)Cl,CA028CB74535B84B_2243AC0CC2BFE2F0_7019_DP,7.875127,00000000000000000001000000000000000000000000000000000000000000100100000000010000001101010011000010011001110100010000001011100100110001110100001011011111010010101111010,SZCYMVKJYLGOLY-UHFFFAOYSA-N
CC2=C1N=CC(=C(C1=CC(=C2)F)NC[C@@H]3CNC[C@H]3C)C#N,B4FFF639141E3E71_3854617E0D394B40_6041_DP,7.177624,00000000000000000000000000000000000000000110000000000100000000000100000000000000101100110011000010101100010110000001100011000100110101110110001011000111010110101111010,FWDRTEJQKVEFKF-YPMHNXCESA-N
BrC1=CN=C(N(C1=O)C[C@H]2[C@@H](CNC2)C3=CC(=CC=C3)F)C4CC4,7596D75DEBF20AC8_C984C896D0D8FB02_6034_UN,7.9035425,00000000000000000000001000000000000000100010001000000000000000100100000000010100101101110011100011101000000100100100010011100101110000100110001111011011011110100111110,DCLUHKPDEUBTOA-ZFWWWQNUSA-N
C[N]1N=C(N=C1NC2=CC(=C(C=C2)C3CC3)F)C4CCOCC4,C9CB541035AABF0A_B3D0BD239DC3A373_6041_UN,8.108172,00000000000000000000001001000000000000100010000000001000010000100100000000010101100100110000011010100000001101000000001011101100110011110110001011011011010011101111110,AQBHPQZMUQROND-UHFFFAOYSA-N
C(N1CCNCC1)C3=CC2=C(C=CC=C2)[N]3CC4(CCNC4)C,5F99430A8DEEB576_8B13774D78DBB66A_6034_DP,8.314597,00000000000000000000000000000000000000000000000000000000000000000110000000010001101101100011000010101100110010011001101011100100110100000110001011011011010110101111010,IMHIIHABKDCSBY-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)N[C@H]2[C@H](CC2)C3=C(C=C(C=C3)F)F)C4[C@@H]5CNC[C@H]45,EE615BA1DCA9F9A5_738CBC8AD007D8C0_6041_DP,7.639896,00000000000100000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000110110010001001011100100110101110110001011011011010110101111010,DDMFXRZOTYRHNS-GXNHEBHNSA-N
C1CC2(C1)NCCC3=C2N(C=N3)CC(C)(N4CCNCC4)C5=CC=C(C=C5)Br,64FA2C2A24DAF9D7_57962184CBC507D8_6034_UN,7.603997,00000000000100000000000000000000000000000000001000000000000000000110000000010101101101110011000010101100110110011001101011100100110100100110001011011001010110101111010,DZWBICAKBRWMJZ-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)C3(CCCC3)C4=C(C=C(C=C4)F)F,E6339944D0C051C0_DDBDF3A2813926CC_6038_UN,7.6570573,00000000000000000000000000000000000000000010000000000000000000100010000000010000101001110011110010101000010110111001111001100000110000100110001011011011011110101111110,RLLDSGVQARAUAD-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(=O)C3=CSC(=N3)C4=CC(=C(C=C4)F)F,E6491A7411C54D2E_52AAC712BFEF7294_6038_UN,7.8378935,00000000000000000000000000000000000010000010000100000000010000100100000000000001011100011001100110001000110100110000011011000100110010100100001011010011111111110111110,IGQQPEVAIJJJFQ-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(=O)C3=CSC(=N3)C4=CC(=C(C=C4)F)Cl,27A58A54C198DC19_4F8A8FD13D652D20_6038_UN,7.837859,00000000000000000000000000000000000010000010000100000000010000100100000000000001011100011001100110001001110100110000011011000100110010100100001011010011111111110111110,SZFXPVDEWGRGBC-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NCC3(C)C(OCC3)C4CC4)C,521F8942EF3B2E5E_00170818892B494E_6041_UN,8.042027,00000000000000000000001000000000000000000010000000000000010000100110000000000000101100010011000011101100010111001001101011000100110011110110011011010111110111101111110,ICAGBVXKAYXHMX-UHFFFAOYSA-N
CNC(C)C2=NC1=C(C=CC(=C1)Cl)N2C[C@H]3NCC[C@@H](CC)C3,5283C29E3F41BE87_E0C3C2F5B623D10E_6034_UN,8.441579,00000000000000000000000000000000000000100000000000000000000000000100000000010101001101010001010010101101110110010010101011100100110100100110011011011111010110101111010,FIQPPWNSLBJDLE-RLSDIYDTSA-N
FC2=C1N(C3=C(C1=CC=C2)CCCC3)CC4=NN=C([N]4C)C5CNCCC5,B6224749795BEE10_C0FC868B3BEC71E6_6034_UN,8.10714,00000000000000000000000000000000000000100010000000001000000000100100000000010101101101110011011010101100110110010000101011101100110000100110001011011011010110101111010,WSADNZREBMDHJW-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(=O)C3=CSC(=N3)C4=CC(=C(C=C4)Cl)Cl,BFE051DB01B943B7_5DDE81F0D7EA416D_6038_UN,7.8378453,00000000000000000000000000000000000010000000000100000000010000100100000000000001011100011001100110001001110100110000011011000100110010100100001011010011111111110111110,JPRABWKEKRROLG-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CCN(C)C23CCCNC3)F)F,E35A9648DD8558E0_B0AF419FA6DEEEB0_7022_DP,8.044522,00000000000000000000000000000000000000000010000000000100000000000010000000010001101101110011010010101000110110011001101011100000110101110110001011011111010010101111010,WUYXHXUXORXAMN-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NC[CH]2C[C]3(C2)C[CH2]C3,4085B8D3B599D54F_33A287478DC8E628_6041_UN,7.301631,00000000000100000100100000000010000000000000000000000000000000000110000000100001001000100010010000101000010000001000001001000000110001010100011010011111010110101111010,FEKPQUHYZHZFDJ-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)N[C@H]4[C@H](CC4)C5=C(C=C(C=C5)F)F,DB197076EE936E1E_81E596645766AE43_6041_DP,8.047826,00000000000100000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000110110010000001011100100110101110110001011011011010010101111010,BXFNUBIMURHGPB-YGFMJBJJSA-N
N(CC1C2CCC(C1)C2)C(C4=CC3=C(C)C=CC(=C3O4)F)=O,033684AD6A05F39F_B671F4AB9559AA2D_6038_UN,7.915485,00000000000000000000000000000000000000000010000000000000010000000000000010000000001100010011100110001100010100100000011000000100110000100100000001010001111110111111110,UDLPIXYHYZIQHI-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NC2=C(C=CC=C2)C3=NC=C4CCCC[N]34,6C0D25D8B29630A4_7ED5AEBDF52D7A95_6041_UN,8.057644,00000000000000000100100000000010000000100000000000000000000000100100000000100101100101100000010010101100010000011000001011100100110001010100011011011111010010101111010,FTGPCQVNBQOEHM-UHFFFAOYSA-N
N(CC1=CC2=C(N=C1)C=CS2)C(C45CC3(CC(CC(C)(C3)C4)(C)C5)F)=O,292109C6FEB2B93E_BB1B8F51CAE767FE_6038_UN,7.980299,00000000000000000000000000000000000010000010000000000000000000000110000000000000111100011010100010101100010110101001010011000100100000100100001001000101011110101111110,LVYLUALOIAIIMB-UHFFFAOYSA-N
C2(=C1OC=CC1=CC=C2F)NC[C@@H]3CCCO[C@H]3C4=CC=N[N]4C,4875465847DEAE55_1BA245EF40427F77_7022_UN,7.4020348,00000000000000000000000000000000000000000010000000001000010000100100000000010000101100010011011111101100010101000000001011101100110011110110001011011011110111111111110,DRRAVBUGYIHKSD-SUMWQHHRSA-N
C(N1CCNCC1)C2=C3C(=CC=C2)C=C[N]3CCC4CNC(C4)(C)C,697D50D4F4A5CB05_A5D0C3BF8733C5BC_6034_DP,7.94559,00000000000000000000000000000000000000000000000000000000000000000110000000110001101101100011000010101100110010011001101011100100110100000110001001011101010110101111010,AJNFZFDPQQCPTA-UHFFFAOYSA-N
C1(=CC(=CC=C1)C2(CCOCC2)C#N)N[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,B46445A791DF5936_A1C5CE2E16160D7D_6041_UN,7.647517,00000000000000000000000000000000000000000110000000000000010000100010000000000000000100110011000111100000100101011000001010000100110011110110001011010011110011110111110,MXPCLSXAEQSBLY-RTWAWAEBSA-N
CN(C)CC1=CN=C(C=C1)NCC2(CCC2)C3=C(C=CC=N3)F,FE3B0EF4E8A25FDE_45526EFAD05E635F_6041_UN,7.842304,00000000000100000000000000000000000000100010000000000000000000100110000000100100101001110011010000101000000100001001001011100100110001110110001011011111010110101111010,SBPRYZLIARYCCX-UHFFFAOYSA-N
N4CC1=C(C=C(C=C1)NC2=C(C=C(C=C2)C3CCOCC3)F)C4,3CE623E9F869440E_911B1143AEEAD783_6041_DP,7.8417225,00000000000000000000000000000000000000000010000000000000010000100000000000000000001100110001000010101100010101000000001011000100110111110110001011010011010011100111110,MSCHCOVIQXFSHG-UHFFFAOYSA-N
C[N]1C=C(C=N1)C4=NCC(C=CC3=CC(=C(N2CCN(C)CC2)C=C3)F)O4,2177FEBD060D6C6D_6D07AED6DD5C718F_7019_UN,8.506066,00000000000000000000000000000000000000000010000000001000010000100100000000010011100101110000111111111000000100110001111111101100110011110110001011011110110011101111110,CPRUNJRSFLHGQB-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)N[C@H]3[C@@H](OCC3)C4=CC=N[N]4CC5CC5)C,6CC80EED99A74BBF_04F84987E2BD243C_6041_UN,8.420657,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011001111101100110101010000001011101100010011110110001011011111110111101111110,GXCSOSDTZHRQRV-XMSQKQJNSA-N
CN3C[C@@H]2CC[C@H](OCCC(C(F)F)N1CCOCC1)[C@@H]2C3,61635D4A7FE7BE15_4DBF71F0BB381A7E_6039_UN,6.9091682,00000000000000000000000000000000000000000010000000000000010000000000000000010000000101100000010111101100010111010001001011100011110010100110001100011000110111111101110,VJRJIEBGUYGWKM-IXXDHKBRSA-N
CC1=C(C=NC(=N1)C2CC2)C3=CC=C(C=C3)NC[C@H]4[C@H](CCNC4)C5=CC=C(C=C5)F,8E9148CAF6860D3E_3893D5EDB97C9FFB_6041_DP,7.806859,00000000000000000000001000000000000000100010000000000100000000100100000000000100101000110011000000101000100100010000001011000100110101110110001011010011010110101111010,WIGSNHPJNYHESG-XUZZJYLKSA-N
CC1(C)CCCCC1C=CC3=C2OC=CC2=C(F)C=C3,AFCE0A65483F74A2_A3915B2AC8D00E92_7019_UN,8.391407,00000000000000000000000000000000000000000010000000000000010000000010000000100000000100010000000010010100010110001001101000000100110000100100000001010110100000001011110,QJQVDGMMWUNAOV-UHFFFAOYSA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=N3)CC(C)CC4=CC=C(C=C4)F,769BE4DFFAD4FF83_D35CDBA9B6ACDE24_6034_UN,8.660257,00000000000000000000000000000000000000100010000000000000000000100100000000010100001101110011000010101100110100010001001011100100110000100110001001011001010110101111010,NPUWPKKQLLYMRO-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC34CCCNC3CCC4,6AB630C336F04494_93C1D10B7629093B_6041_DP,7.6862288,00000000000000000000000000000000000000100010000000000100000000000110000000000100101000010011000010101100110110011000001011000100110101110110001011010111010110101111010,UMAIDXYLQAEGTL-UHFFFAOYSA-N
FC1=C(C=CC(=C1)NCC(N(C)C)C2=C(C=CC=C2F)F)OC3CCOCC3,D154DBBDA70A1EC9_E0927DC98BFCBC59_6041_UN,7.848565,00000000000000000000000000000000000000000010000000000000010000000000000000100001001001110100010000101000000101010100101000100111110011110110001111011111110111111111110,AASBRSPJZVMWIJ-UHFFFAOYSA-N
CN1C(=O)CCC2=C1C=CC(=C2)NC4=CC3=C([N](C)C=C3)C=C4,E70915E071DC85B1_464A8D07CAFB6430_6041_UN,9.345321,00000000000000000000000000000000000000000000000000000000000000000100000000010000000101000001110010100100010010110000111011100101000011010100001111011111001010101111110,GLUHSHRJBVCYRH-UHFFFAOYSA-N
C1(=CC(=CC=C1)C2OCCCO2)NC4=CC(=C(N(C)C3CCCCC3)C=C4)F,AADD629A2CE8ECEE_F8B4584A6500097D_6041_UN,8.052578,00000000000000000000000000000000000000000010000000000000010000100000000000000000000001010100010000100000000111010000101010110100110011110110001011011011010011111111110,BXJRFOBQOSNXDF-UHFFFAOYSA-N
CN4CCC1=C(C2=C([NH]1)C=CC(=C2)NCC3COCCN3)C4,809FD8BCCDB706E6_7A3B53EF6BF169E9_6041_DP,7.1157,00000000000000000000000000000000000000000000000000000010010000000100000000010001101101100011010111101100110001010001101011100100110111010110001011011001010111101111110,RWNYITLZFXBSGX-UHFFFAOYSA-N
C(CC2COC1(CCCC1)O2)=CC3=C(C)[N](C(=C3)C)C4=CC(=CC=C4)F,63775B13DF6B7F70_4384B12800922C1B_7019_UN,7.861611,00000000000000000000000000000000000000000010000000000000010000100100000010010000000101010000000010010000010101001000001011110100110011110100000010011110110111111111110,FDHQPGBGNQDUTR-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=C[N]2C[C@@]34CCCN[C@H]3CCCC4)C5CCNCC5,B9EDFEA70BE75E59_94FE7D3F7369253E_6034_DP,8.590484,00000000000000000000000000000000000000000010000000000000000000100110000000010000101101110011000010101100110100011000001011100100110100100110001001011001010110100111010,VBGFIBCDBGCVME-XZOQPEGZSA-N
N3=C(C1=C(C=N[N]1C)C2CCC2)[N](C4=C3C=C(C=C4)Cl)CC5CCCCC5,E7107C3327BA9E4E_850B727F75B7B3CA_7013_UN,7.9345098,00000000000100000000000000000000000000100000000000001000000000100100000000010101100101010000011010001101010100000000001011101100110000100100001011011010010110101111010,CRHCHZLNQQKMHW-UHFFFAOYSA-N
CN1C2CCC(C1)CC2NC(=O)[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)F)F,78EF719B21632B73_A97D91D3814A6B2D_6038_UN,7.9114666,00000000000000000000000000000000000000000010000000000000010000100000000000010001000101110111110011101000110111110001111011100000110011100110001011011011111011111111110,VGKZQPYOHONRCC-MMSDAREKSA-N
CN1C2CCC(C1)CC2NC(=O)[C@@H]3CCO[C@H]3C4=CC(=C(C=C4)Cl)F,B1E04058336028BF_CAE870F184AF92A8_6038_UN,7.911461,00000000000000000000000000000000000000000010000000000000010000100000000000010001000101110111110011101001110111110001111011100000110011100110001011011011111011111111110,OMZZBLBFRVQDLF-MMSDAREKSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NCC3(C)CCOCC3,E521746997998B92_6C1EDEFF43730AC8_6041_UN,7.1776204,00000000000000000000000000000000000000100000000000000000010000100110000000010100101101100011010010101000000011011001101011100000110011010110001001011111010111101111110,OCROMTPGIGKPND-HNNXBMFYSA-N
CC1=CC(=C(C=C1)NCCN(C)CC2COCCC2)Cl,03CC6E43A02C6772_933A73AFC1667227_7022_UN,7.199561,00000000000000000000000000000000000000000000000000000000010000000000000000000001001001110001010001101001100111010001101000100000110011110110001011011111010111101111110,YDGQYXVMBXGVMZ-UHFFFAOYSA-N
CC1=CC(=C(C=C1)NCCN(C)CC2COCCC2)F,7A91BFD0690B3D33_737181894332D814_6041_UN,7.199562,00000000000000000000000000000000000000000010000000000000010000000000000000000001001001110001010001101000100111010001101000100000110011110110001011011111010111101111110,SZNGDEWUZYDNJM-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CCCC3(C)CCCN3)C4CCNCC4,D9B6594A9025E18D_FE5AC7842735295B_6034_UN,8.603183,00000000000000000000000000000000000000000010000000000000000000100110000000010000001101110011000010101100110110011001101011100100110100100110001001011001010110101111010,SQNRTMILIDJRKH-UHFFFAOYSA-N
CN6CC(C1=NN=C(C)N1CC34CC(CC2=CC=CC=C2)(C3)CO4)C5(CNC5)C6,F4C665EC9202AE30_C5950F69C2C0DBAE_6034_UN,7.685629,00000000100100000000000000000000000000100000000000001000010000100110000000010101101101100011011110001000010011001001100011101100110010000110001010001111110111101111110,QEXZKOCQIZMJFR-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC2CCCC2CC3=NC=CC=C3)F)CC4,051821B6DAF11B7F_23D182EA7EF897B7_6041_UN,8.179656,00000000000000000001000000000000000000000010000000000000000000000100000000010001100001110011010010101000100110010001101011100100110001110110001011011011010110101111010,BMWJZGIXFJVFRM-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(C)CCN3CC4=CC=CC=C4)C5=CCNCC5,559FAAFE344C3720_C595C739693F343E_6034_UN,8.378188,00000000100100000000000000000000000000000010000000100000000000100110000000011001001101110001000010111100110100011001101011100100110000100110001001011011010110101111010,ZTPROIYFGGEKQN-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(C4=C[N](C)C5=C4C=C(C=C5)F)=O,19B9E52D1370BDC3_EA2640D7A083762B_6038_UN,8.075141,00000000000000000001001000000000000000000010000000000000000000000100000000010000101101010011110011001100010100100000010001100100110000100100001001001001011110101111110,VKYNPBOCRITVGW-UHFFFAOYSA-N
N1CC2CC1CC2OC(=O)C[N]3C=CC4=C3C=CC(=C4)F,F77BAB4F5EF0A664_78CB03DE5417EB63_6038_DP,8.162445,00000000000000000000000000000000000000000010000000000000000000000100000000010000001101010011000111101100110100010000000011110111110010100110001101001001111111110111110,KWDLGBQUEDUVKC-UHFFFAOYSA-N
O(C1(CNCCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Cl)F)C#N,B1A920D97F5B0345_AD977EA5AFB8B46F_6035_UN,7.492285,00000000000000000000000000000000000000000110000000000000000000100010000000000000001000110011000101101001100100011100001001000111110010100110001111010011110001100111110,YVQQIGBWPRVNEC-UHFFFAOYSA-N
O(C1(CNCCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Br)Br)C#N,457339E093E4456D_200F878BACF16593_6035_UN,7.492276,00000000000000000000000000000000000000000100001000000000000000100010000000000000001000110011000101101000100100011100001001000111110010100110001111010011110001100111110,GSUYUGNMGQACOG-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CC=N2)NC3CN(C)C4(C3)CCOCC4,DADE1D295460C351_0DB2B1A84933806B_6041_UN,8.029144,00000000000000000000000000000000000000000010000000000000010000000110000000010001100101110001010011101100110111011001101011100100110011110110001001011001010011101111110,ZZTMJXIUYGLYBP-UHFFFAOYSA-N
CC1N(CCOC1)CC=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,A8AE9690735A5C2A_429CA21096B22B87_7019_UN,7.951223,00000000000000000000000000000000000000000010000000000000010000000000000000010000000001110000010110111000000111010001101011100000110011110110001011011110010111101111110,ZPOJPWFWPQUAIE-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CC[C@H]3CNCC3)CC#N)F,9381CB35CA691E8A_2D8414807FE31675_6034_UN,8.188644,00000000000000000000000000000000000000000110000000000000000000000100000000010000001101110011000010001100110100010000001011100100110000100110001010011011010110100111010,LBXXSURZJIFPKE-NSHDSACASA-N
O(C3CCOC2(CCN(CC1=CC=CC=C1)CC2)C3)CCC(C)C(F)F,377D74654C555A77_BE0D8713A868D033_6039_UN,7.8034563,00000000000000000000000000000000000000000010000000000000010000000010000000010000000001100100000001101000010101011001101011100011110010100110000101011000110101111111110,SXDPNSYSLXXEJZ-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2C3(CC2)CCCCC3)F,3D47CEC65981D23E_DB939ED004E8E1FD_7022_UN,7.6077366,00000000000100000000000000000000000000000010000000000000000000000010000000100000000001110011010000001000110100011001001000100000110001110000001011011111010110101111010,VTUQLJWJNITYPK-UHFFFAOYSA-N
N(CC3CN1CC2CC1(C2)CO3)C(=O)C4=C[NH]C5=C4C=CC(=C5)F,4BC94E9E11109991_7FCA1398EA09DE1E_6038_UN,7.63972,00000000000100000000000000000000000000000010000000000100010000000110000000000000101101110011100111101100010101111000010011100100110110100110001001001001111111110111110,ITJWLKIMRRDTQN-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(N)CCOC4=C3C=CC=C4)C5=CCNCC5,3F2A072171AB7CEB_0121F66A6D2D893D_6034_UN,8.336637,00000000000000000000000000000000000000000010000000100000010000100110000000011001001111110011000011111100110101011100001011100100110111100110001011011001110111100111110,IOBYCFWAZLKSQL-UHFFFAOYSA-N
FC1=C(C=C(C=C1)CC=C)NC[C@@H]3[C@@H](C2=CN=C[N]2C)N(CCC3)C4CC4,64EE57DDB8282630_046C7A4E74403F03_6041_UN,8.289984,00000000000000000000001000000000001000000010000000000000000000100100000000010101101101010011010010111000000100010000001011100100110001110110001011011011010110101111010,VIYIBMMVIGYUPA-VGSWGCGISA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCCC3CCCNCC3,6237EB0A497A2B64_892046D0413B5E93_6041_DP,7.964821,00000000000000000001000000000000000000100010000000000000000000000100000000000100001000110011000000101100110110010000001011000100110101110110001011010111010110101111010,JUGJIFZIIFIPFL-UHFFFAOYSA-N
CN(CC1CC1)C2=NC(=CN=C2)N[C@@H]3C5=C(OC4(C3)CCCC4)C=CC(=C5)F,FABFD909D325BFB8_63A8406EC3A029CE_6041_UN,7.7120986,00000000000000000000001000000000000000100010000000000000010000000110000000000101100001110001010011101100110110011101001011100100110011110100001011011001110111101111110,WPPZTUCCMXIHIS-SFHVURJKSA-N
C[Si](C)(C)C#CC1=NC=C(C=C1)NCC2CCCC3CCCN23,E26A45C9729555AE_CC3890FA1F39F46F_6041_UN,8.059618,00000000000000000100100000000010000000000000000000000000000000000100000000100001001101100011010010101100010000011000001011100000110001010110011001011101010110101111010,HSAQPEINULOSKR-UHFFFAOYSA-N
FC2=C1C=NC=CC1=CC=C2NC3=CC=CC(=C3)CC4CCCN(C)C4,A1340BFC90DDB355_125F62B094F5A2F5_6041_UN,7.845152,00000000000000000000000000000000000000000010000000000000000000000100000000010000000001110001010000101100010110010001101011100100110001110110001011011011010110101111010,RUIIJHGVCLXWOK-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC4=NC2=C(CC3(CC2)CCCCC3)S4,7E8560672C259F88_774F8D71D5F37112_7022_UN,7.2308397,00000000000000000000100000000010000010000000000100000000000000000110000000100100010100101001010010000100011000011000001011000100110001010100011011011101000010101111010,WFMZASNESAWHFS-UHFFFAOYSA-N
CC1=C(C=NC(=N1)C2CC2)C3=CC=C(C=C3)NC4CC(CC)(C4)CC,A4DBEEB50DF17ABD_4365C83CBD8FD5C4_6041_UN,7.942116,00000000000100000000001000000000000000100000000000000000000000100110000000000100100000000001000000100000100000011010100011000100100001010100011011010111000110101111010,XMIVBDPZKXXEKB-UHFFFAOYSA-N
C(C2=NC1=C(C=CC=C1)[N]2C35CC4CC(CC(C3)C4)C5)=CC6=C(CC)C=CC=C6F,48DDFBA99AE84F72_768171C028F0B262_7019_UN,8.074825,00000000000000000000000000000000000000100010000000000000000000100110000000010101000101010000000010010100010100011010000011100100100001100100001011001010000110101111010,LMFLQAKVPXILGC-UHFFFAOYSA-N
CN1CCOCC1COC2=CC(=C(C)C=C2C3CNCC3)Cl,B4C1FF9191E41832_AB3811ABBE8B6AF2_6035_UN,7.863655,00000000000000000000000000000000000000000000000000000000010000100000000000010000001101110111010110101001100101010101101011100011110010100110001111011111110111111111110,RLYUDALLNUXPEB-UHFFFAOYSA-N
CCN1C(CC2=C1C=C(C=C2)F)C3=NC=CN3CCCC4(C)CC4,DD600EA1720DB3EF_F99130BB8FA90F88_6034_UN,8.553016,00000000000000000000001000000000000000100010000000000000000000100110000000010101000101010000000010001100010110011011101011100100110000110110001010011110010110101111010,GCZVSTCRQKWRAK-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3=C(ON=C3C)C=CC4=CC=C(C=C4)F,FC991C3FA8E1CF53_4FD8856F345A354C_6041_UN,8.299143,00000000000000000000000000000000000000100010000000000000010000100100000100010101100101110000011111111010000110010001101011101100010001110100001011011111110010101111110,AHOUTQWPJJKQIZ-IBGZPJMESA-N
C(C2=CC1=C(C=CC=C1)C(=O)N2)=CC4=C(SC)C=C3OCCOC3=C4,521B82B85AAEE1EA_151ADC0CE37A6B50_7019_UN,8.861041,00000000000000000000000000000000000000000000000000000000010100001100000010000000010000001000110000110100010001100100011011000101000010000110000111110011111011011111110,GWWVOGFPZQXUEN-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=C[N]2CCC3CCCNC3)C4=CCNCC4,7E749516D3FFDCEC_BEC1758E9B906A69_6034_DP,8.256399,00000000000000000000000000000000000000000000000000100000000000100100000000011000001101100011000010111100110000010000001011100100110100000110001001011001010110101111010,NAGVMVCYYDSLKE-UHFFFAOYSA-N
CN(CC1CCNC1)C2=NC=C(N=C2)N[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,293CBB385C10B50A_719416157AF80832_6041_DP,8.250303,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000100110010001001011100100110101110110001011011011010110101111010,NKFFXAIGSLNEEA-LLQOJDTPSA-N
CC2=C1[NH]C=CC1=CC(=C2)NCC3CCN(C)C3C4=CC=CS4,32C685E3632880EE_05192D22E64E59AC_6041_UN,8.385026,00000000000000000000000000000000000010000000000000000000000000100100000000010000111101101011010010001100010010010001101011100100110101010110001000011111010110101111010,FRVJQGUUCFCMRC-UHFFFAOYSA-N
N(C2=C1C3CCC(C1=CC=C2)O3)C(C4=C(C=C(C)C=C4F)F)=O,28886C767571C131_A21547C824687FC6_6038_UN,7.7107434,00000000000000000000000000000000000000000010000000000000010000000000000000000000000100010001100011000100010100100000011000000100000011110100000011010011101011111111110,GVNOBENFFGSNAK-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC3(CCOCC3)C4=CC=CS4,C079A5B3E6CF9DC9_F51598BAAC880970_6041_UN,7.7532344,00000000000000000000000000000000000010100010000000000000010000100110000000000100011100111011000010101100010111001000001011000100110011110110001011010111010111101111110,MJYUPLHRYNQBLM-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC4C3CCCCC3CCC4,3A11FB43939FEE3B_BF5A05B35EAB8EC0_6041_UN,8.408766,00000000000000000000000000000000000000000010000000001000000000000100000000010000100100010011011010000100110100010000001011101100110001110100001001011001000010101111010,OJBPKASFTVFCFT-UHFFFAOYSA-N
C(C1(CCC1)C2CCCCO2)=CC3=C(Cl)[N](C(=N3)N(C)C)C4=CC=C(C=C4)F,5D23663063DCBD1D_E294F7B0FB27D52A_7019_UN,7.5456047,00000000000100000000000001000000000000000010000000000000010000100110000000110101000101110000010010110001001101001000001011100100110011110100001011011110110011101111110,UZCLITAPAUIKBV-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC2=CC=C(C=C2)C3=NC=C4CCCC[N]34,3310DB5333670531_BE34A4D7BBE27705_6041_UN,7.888857,00000000000000000000100000000010000000100000000000000000000000100100000000100101000101100000010010101100010000011000001011100100110001010100011011011111010010101111010,BVTMFFMNKMHYDZ-UHFFFAOYSA-N
C(CC1CC2CCC1C2)=CC3=C[N](C)N=C3C4=CC=C(C=C4)F,BC174A3727A6950D_F218EEB93BC218D0_7019_UN,7.603871,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010000010100000000001011101100110000100100001011011010000110101111010,PCZBFTHQNXKFNT-UHFFFAOYSA-N
C1(=N[N](C=C1)C2CCCCO2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,75228E3CCB086AE9_7CA28E8E790481AC_6041_UN,8.273236,00000000000000000000000000000000000000100010000000001000010000100100000000010101100101110011111110101000100111110001111011101100110011110110001011011011010011101111110,YCYNOTZHYITVEJ-WDOSNPKHSA-N
FC1=CC(=C(C=C1)C2CC2)NCC3CC4CCC3N(C)C4,F339A55985B262A6_FF676E3F3A688C91_6041_UN,7.669898,00000000000000000000001000000000000000000010000000000000000000100000000000010000101001110011010000101000010110010001101001100000110001110110001011011011010110101111010,FUCPMVJMWQHRFT-UHFFFAOYSA-N
C1(=CC3=C(N=C1)[N](CC2=CN=CC=C2)N=C3)NCC4C[Si](C)(CC4)C,2C0C76C92BD3F2CD_4F3B865AA3299E42_6041_UN,8.458837,00000000000000000000100000000010000000100000000000001000000000000100000000110101101100100011011010101100010010011001101011101100110001010110001001011101010110101111010,JDQSWHDMFMODSJ-UHFFFAOYSA-N
N(CCC12CC(C1)CO2)C(=O)C3(CCOCC3)C4=C(C=C(C=C4)F)F,815D17DCC3948091_F89188FB3190A6C3_6038_UN,7.8450947,00000000000100000000000000000000000000000010000000000000010000100010000000000000001100110011100011101000110101111000011010000000110010100110000011110011111111110111110,WJFMDTANMTWMGJ-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2=NC(=CC=N2)C=CC3=CC[C@@H]4C(C)(C)[C@H]3C4,C11607E32DCFA264_E2D6D47259C7F585_7019_UN,8.579269,00000000000100000000000000000000000000100010000000100000000000100110000000101100100000010000000000110000010100001000100011000100100000100100001001000100000010001111010,AHDIGQOIFVDTTP-LPHOPBHVSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3CNCCC3)CC(N4CCNCC4)C5=CC=C(C=C5)Cl,7D47A18BA0B72112_CDBB0D2BA2E956A6_6034_UN,7.7620378,00000000000000000000000000000000000000100000000000000000000000100100000000010101101101110011000010101101110100010000001011100100110100100110001011011011010110101111010,YJJBXFWNGKTSAS-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3CNCCC3)CC(N4CCNCC4)C5=CC=C(C=C5)F,EA85E06A247EE862_BC273384132F7694_6034_UN,7.762028,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101100110100010000001011100100110100100110001011011011010110101111010,CQITZWNGMGJOFE-UHFFFAOYSA-N
CC3CCCC(CC=CC2=CC1=CC(=C(C=C1N=C2Cl)C)C)C3,B056E83BE1FBB9BC_F82E35058F7B105F_7019_UN,8.438561,00000000000000000000000000000000000000000000000000000000000000000100000000000000000000010000000000110101010110000001101001000100110000100100010011010110000110001111010,RQNBNACZHCSRIB-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)C3=NC2=C(C=CC=C2)[N]3C[C@@]45CCCN[C@H]4CCCC5,4EB76921ED21802B_2CA15C191D71EA71_6034_DP,7.830676,00000000000000000000000000000000000000100010000000000000000000100110000000010101101101010011000010101100110100011000001011100100110000100110001011011011010110101111010,ZVIVELBBLVGGLH-LADGPHEKSA-N
CN(CC1CCNC1)CC2=NC=C(N=C2)NCC(C)C3=C(C=C(C=C3)F)F,862BCD0BC864F871_54F0E846A4DBBA81_6041_DP,7.9893074,00000000000000000000000000000000000000100010000000000000000000000100000000000101101101110011010010101000100110010001001011100100110101110110001011011111010110101111010,VCJJFVHPROJARQ-UHFFFAOYSA-N
CC1=CC(=CC(=C1)C)NC[C@@]23CCCN[C@H]2CCCC3,DB6FE42D92C05F5A_8E74D8363434F8EA_6041_DP,7.4731255,00000000000000000000000000000000000000000000000000000100000000000010000000000000101000000011000000101100110000011000001001000000110101010110001001010101010110101111010,HWTGUUHTGVRIRJ-ZWKOTPCHSA-N
N(CCC1CC2CCC1C2)C(C3=CC(=C(C)C=C3F)F)=O,79A4B8EC54C0E03F_B5D894570C214BE1_6038_UN,7.6267843,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010001100010001000110100110000011000000000110000100000000011010011011110101111110,IMWWQRBUMBPEKY-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=NC=C(C=C1)NC[C@]23CC[C@H]2CCCN3,FB580A1A28369A54_78C37B2D4B1F10A3_6041_DP,8.196966,00000000000100000100100000000010000000000000000000000010000000000110000000100001001000100011010000101100110000011000001011000000110101010110011001011101010110101111010,VHKRBLCYKVVIRP-CRAIPNDOSA-N
N(C2C1C3CC4C1CC5C2C3C45)C(C6=C(C=CC(=C6OC)OC)F)=O,2F1BCAE9229D6F4D_4C5CE1A7ABA1EAE0_6038_UN,8.226496,00000000000100000001000000000000000000000010000000000000000000000000000010000000000000010101110011000100010100100100010000000011110001100000000111100111101011111111110,VCAKHWRGEHPHCV-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4CCOC(C4)C5=CC(=CC=C5)F,91B5D23D8CF00C8C_A4340B8E3061A757_6041_DP,8.181728,00000000000000000001000000000000000000100010000000000000010000100100000000000101100101010011010011100000110101010000101011100100110111110100001001011001110011101111110,ADZPYHWGBFIXMS-QLKRIMAFSA-N
COCC1=C(C=NC(=N1)C2CC2)NCC45CC(CC3=CC=CC=C3)(C4)CO5,0ED95ACEFFB07B94_F79A5CBC5E10253C_6041_UN,7.242162,00000000000100000000001000000000000000100000000000000000010000100110000000000101101100100011010111101000010001011001000011000110110011010110001011010011110111111111110,WEMCKQVLNJTHQL-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C([N]1CC[C@H]2CCCN2)C(=CC(=C3)F)F)C4,0EEB17805DADDD2D_A47C6534541D98ED_6034_DP,8.327369,00000000000000000000000000000000000000000010000000000000000000000110000000110000101101010011000010001100110100011001101011100100110000100110001011011101010110101111010,MRZCVCMWDBQQQI-CQSZACIVSA-N
CC(C)(C#N)C1=CN=C(C=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,D0836AD97FB2AA30_C915033C48F4E8CF_6041_DP,7.2542458,00000000000000000000000000000000000000100110000000000100000000100110000000100100101000110011000000101000100100011000001011000100110101110110001001010111010110101111010,JHAKRPWCWJRBLK-QFBILLFUSA-N
N5CC(CC3=C(C1=C(SC2=C1CCN(C)C2)N=C3)C4=CC=C(C=C4)C)C5,57AE8D14CA6BE7C3_95B7A1FFBD7FEE83_2201_DP,8.086905,00000000100100000000000000000000000010000000000100000000000000100100000000010000011101101010010010101100010000010001101011100100110000000110001011011111010110101111010,FBYGCADLBYVIBI-UHFFFAOYSA-N
C(CCC1CCOCC1)=CC2=C(C)[N](C(=C2)C)C3=C(C=C(C=C3)F)F,5B0614CECBEB5953_0F7AF4756827D219_7019_UN,8.076148,00000000000000000000000000000000000000000010000000000000010000100100000000010000000101110000000010110000000101000000001011100100110011110110000011011110010111101111110,RPXZHDLAWURIGL-UHFFFAOYSA-N
CC1CCOC1CC=CC2=C[N](C)C3=C2C=C(C=C3)F,951BE4DC610E5E71_5F41AD49E1E91D9F_7019_UN,7.960927,00000000000000000000000000000000000000000010000000000000010000000100000000010000000101010000010010010100010111000001101011100100110010100100000000011110110111101111110,CPTBJXZNOIQJLD-UHFFFAOYSA-N
CN(C1CCCNCC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=C(C=CC=C4)F,FA4C62BBEE93E3F9_E9D472DB8D48FA85_6041_DP,7.960438,00000000000000000001001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010000101011100100110101110110001011011011010010101111010,VTFSSTLWGHLKJI-RNYWFIABSA-N
CC3=NC1=C(C=CC2=C1CCCN2)N3CC4CCCN4CC5CCCN5,7C71F180329B7C96_D69E3A7075BE0FB3_6034_UN,7.599319,00000000000000000000000000000000000000100000000000000000000000000100000000010101101101100011000010101100110000010000101011100100110100010110001011011011010110101111010,DFJUAHWTAQDMGU-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NCC3(C)CC4CCC3C4,466FF962D64BCD09_B3725C482DD0435F_6041_UN,7.2287445,00000000000000000000000000000000000000000010000000000000000000000010000000000000001000010011000010001100010110001001101000000000110001110000000011010001010110101111010,DVPVQELWJXLUEK-UHFFFAOYSA-N
O(C2CCOC1(CCOCC1)C2)CCCN3CCN(C)CC3,5F296961CD35466F_533C3FE9257B9B45_6039_UN,7.29345,00000000000000000000000000000000000000000000000000000000010000000010000000010001000001100100010001101000010001011001101011100011110010000110001101111000110101111101110,QMXXXZTZEIKABE-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCCC(O2)C3CC3)Cl)C4CC4,B78B90F90DFCCE83_B74341B0DD96B1A9_7022_UN,7.34851,00000000000000000000001000000000000000000000000000000000010000100000000000000000001000010011000100101001000110000000001000000000110011110100000011010011110111101111110,JISKDIPUETYVJH-UHFFFAOYSA-N
CC1=C(C(=CC=C1)Cl)NCC3CCCN(CC2CC2)C3,9E5A67B3ABB1F4C9_D442679710AD87A1_7022_UN,8.375366,00000000000000000000001000000000000000000000000000000000000000000000000000010000101001110011000000101001000110010000001001100000110001110110001011011011010110101111010,CRYKNORLRKNCNH-UHFFFAOYSA-N
CC1=C(C(=CC=C1)F)NCC3CCCN(CC2CC2)C3,55C176CAE39D947B_6B4CAD65D975DD71_6041_UN,8.375361,00000000000000000000001000000000000000000010000000000000000000000000000000010000101001110011000000101000000110010000001001100000110001110110001011011011010110101111010,SBLPASUWBVDVBR-UHFFFAOYSA-N
O(C(=O)CN1C2CC(C1)C=C2)CCC3=CC(=C(C=C3)F)F,712BD52BEBA15788_3408AF31018F4640_6031_UN,7.669794,00000000000000000000000000000000000000000010000000000000000000000000000000010000000101110000000110111000010101010000001001110010110010100110000011011010011111110111110,UKXVMOGBSGIPQZ-UHFFFAOYSA-N
O(C(=O)CN1C2CC(C1)C=C2)CCC3=CC(=C(C=C3)F)Cl,98AB562EF3BA8EF7_E647B61113F21EAF_6031_UN,7.669783,00000000000000000000000000000000000000000010000000000000000000000000000000010000000101110000000110111001010101010000001001110010110010100110000011011010011111110111110,GBWJDGSSASDBNS-UHFFFAOYSA-N
O[C@@H](CF)C1=CC(=CC=C1)NC24CC(OC23CCNCC3)(C)C4,8E794B398E66C1A5_CAD838545F40AA17_6041_DP,8.52689,00000000000100000000000000000000000000000010000000000000010000000010000000000000001100100011000111101000110010011001001011000000110111110111001001010001110111111111110,CBMKHWVXGPQMKL-GTPINHCMSA-N
CCC(C)N=C1N(C(=CS1)C2=CC=C(C=C2)Cl)C[C@H]4N[C@H]3CCO[C@H]3C4,9B3FE062AEA1CF94_D56BF7DC12326431_6034_UN,8.604867,00000000000000000000000000000000000010000000000100000000010000100100000000010111010101011011000111001101111101010011001111100100110011110110001010011111110111101111110,STVDCALRUMOKRH-UCKHUVRUSA-N
CNC1CCCC2=C1N(C3=C2C=C(C=C3)C)C[C@H]4[C@@H](CNC4)C5=CC(=CC=C5)F,09E8FC6CF6D69687_DDA6E932A8FAE049_6034_UN,7.7920375,00000000000000000000000000000000000000000010000000000000000000100100000000010001101101110011010010001100110110010000101011100100110101100110001011011111010110101111010,KGYOSBCWCVLURX-OFSKKJKASA-N
FC1=C(C=CC(=C1)NCCC2CCN(C)C2)OC3CCOCC3,4B65FE2FCED9ABF7_6B88D4A0ED31846F_6041_UN,7.467417,00000000000000000000000000000000000000000010000000000000010000000000000000010000001101110101010010101000100111010101101011100011110011110110001111011011110111111111110,YBSCZIKIICPSKN-UHFFFAOYSA-N
O[C@@H](CCl)C1=CC(=CC=C1)NC24CC(OC23CCNCC3)(C)C4,86FF7889CAD82ABD_69D025DE3C9152E6_6041_DP,8.526844,00000000000100000000000000000000000000000000000000000000010000000010000000000000001100100011000111101001110010011001001011000000110111110111001001010001110111111111110,JHCJHZLHIWOECK-GTPINHCMSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NC4(CCC4)C5=C(C=CC=C5F)F,385D10D58A89B6AD_0FC4A03D013227E3_6041_DP,8.177523,00000000000100000001000000000000000000100010000000000000000000100110000000000101100101010011010010100000110100011000101011100100110101110100001011011011000010101111010,NYSDGSBYJCXQGU-MUJYYYPQSA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC2=C[N](N=C2)C3CCCCO3,7F1D7F534280A50F_5D78CC6B5D34BF85_6041_UN,7.850425,00000000000000000000100000000010000000000000000000001000010000100100000000110001100100100010111110100000000001111001011011101100110011010110011011011111010111101111110,MEFPTPXHPYKHER-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1C[C@@H]2CNC[C@H]2C)C=CC(=C3)Br)C4,83D6A32FA91FEBD4_5B95311B97B358A9_6034_UN,7.939618,00000000000000000000000000000000000000000000001000000000000000000110000000110000101101110011000010001100010110011001101011100100110000100110011011011111010110101111010,BELMTASWOQJHOL-KGLIPLIRSA-N
CSCC1=C(C=CC=C1)NC2C3(CCNC2)CCOCC3,BBF71649111BAB35_DB88FC8DD9B7FC1B_6041_DP,8.012037,00000000000000000000000000000000000000000000000000000010010000000010000000000001001000101011010000101000110001011001001011000000110111010110001011010011010111101111110,KJLHRMHMEUSSCF-UHFFFAOYSA-N
NCC3(COC1=C(C=CC(=C1)C2CNCCC2)F)CC4CC3C=C4,B869603AB00A7CD5_56F301C202F42634_6035_UN,7.507922,00000000000000000000000000000000000000000010000000000000000000100010000000000000001010110011000011111000110101011100001001000011110100100110001111010011110101100111110,WWOUQOUCAHHHNB-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1C[C@H]2[C@@H](CCNC2)C3=CC=C(C=C3)F)C(=CC(=C4)F)F)C5,449A37B56CFD8805_EDBEA5CFEA474446_6034_UN,8.061024,00000000000000000000000000000000000000000010000000000000000000100110000000110000101101110011000010101100110100011001101011100100110000100110001011011111010110101111010,OEXRRNVKWONSLT-PXNSSMCTSA-N
NC2CC(OCCN1CCN(C)CC1)C23CCOCC3,276F6DCBAA0D407F_91CE08A5F6CAAE61_6039_DP,7.4701595,00000000000100000000000000000000000000000000000000000000010000000010000000010001000011100011010101101000110001011001101011100011110011000110001101011001110111111101110,DOSREVPZALCOLN-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(C(C)C3=C(C=CC=C3F)F)=O,49AD433955C9E0A1_87A89F5F2859A091_6038_UN,7.911026,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011000010110100000011000000000110000100000000011010011011110101111110,HYTKWXZNWHPIPW-UHFFFAOYSA-N
N(CC1=CC2=C(C=C1)OCC2)[S](C3=C(C)C=CC4=C3[NH]C=C4)(=O)=O,378C8E84F3619B2A_653B54A80E4BDC68_6029_UN,8.742314,00000000000000000000000000000000110000000000000000010101011111001101010001000000111100001000001011001110011001001100011011001100101110001110001011111011110111111111110,UHDYUVBDGPVXSY-UHFFFAOYSA-N
N(CC1CC2CCC(C1)S2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)Cl,FF1C5ED79F2AD273_D03DB668FE452C64_6038_UN,7.4302654,00000000000100000001000000000000000010000000000000000000000000100010000000000000011100011011100010101001010100101000011000000000110000100100000011010011011110100111110,PIOYNEROUZCTQP-UHFFFAOYSA-N
N(CC1CC2CCC(C1)S2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)F,0CC1E2F1FCE5A728_1FD8EC6025735542_6038_UN,7.430265,00000000000100000001000000000000000010000010000000000000000000100010000000000000011100011011100010101001010100101000011000000000110000100100000011010011011110100111110,CVDDHFHUJOAAIM-UHFFFAOYSA-N
CC3(C)CCC(OCC1OCCC12CCNCC2)C(C3)C#N,20B9E03808866D92_26ADA4F0643E6004_6039_DP,8.1130705,00000000000000000000000000000000000000000100000000000000010000000010000010100000001100100001000011101000110001011001101011000011110010000110001101010111110101111101110,LEKZSXFVWOYGIT-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)C4CC3=C(C=CC(=C3)F)O4,BD75815F4F075BCE_F6DE84DB93F3939E_6038_UN,8.088111,00000000000000000000000000000000000000000010000000000000010000000000000010010000101101110011110110101100010110110101111011100000110010100110001011011001111111111111110,VRBCYXWIWISRHE-UHFFFAOYSA-N
C[N]1C=NC2=C1C=CC=C2NCC3(CCNCC3)C4=C(C=NC=C4)F,432DAFF8A2FCBD57_B4027283471FFC4F_6041_DP,7.6951528,00000000000000000000000000000000000000000010000000000000000000100110000000010101101101110011010010101100110100011000001011100100110101110110001011011011010110101111010,OXLNYLXIHGBBDT-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)N[C@H]2[C@@H](C2)C3=CC(=C(C(=C3)F)F)F)C4[C@@H]5CNC[C@H]45,016F61C11FB4F7ED_D4EEA8E3A8AD277A_6041_DP,8.32323,00000000000000000000001000000000000000100010000000001000000000100100000000000101101101110011011010101000110110010001000011101100110101110110001011001011010110101111010,JQWBAMUAEGQEGU-LGGNKSEESA-N
O([C@@H]1COC[C@H]1N2CCCC2)CCCC(C3=CC=C(F)C=C3)C4=CC=C(C=C4)F,6B1C046ECA3D78F4_71D521AF4CF7DDF2_6039_UN,8.547276,00000000000000000000000000000000000000000010000000000000010000100000000010010000000101110100000111001000000101010000001011100111110011100110000101011010110111110111110,QXQJKTDXJLXOLL-DNQXCXABSA-N
C[N]1C(=CN=C1C2CCCCN2)NC3=C(ON=C3C)C=CC4=CC=C(C=C4)F,123FD46C7C89E1B0_41B8A106B3D97655_6041_DP,8.245295,00000000000000000000000000000000000000100010000000000000010000100100000100010101101101010011011111111010100110010000001011101100110101110100001011011111110010101111110,GNXBZKPMSNHTAM-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2CCCC(CC)C2)F)CC3,949F4DE0EBC868DA_451E8AAE4EE21BFE_6041_UN,7.5530987,00000000000000000001000000000000000000000010000000000000000000000000000000010001100001110011010000001000100110010011101011100000110001110110001011011111010110101111010,DVJWJJLLSJUMEP-UHFFFAOYSA-N
CN1C(CCC1)CC=CC3=CC(=C2OCOC2=C3)C4=CN=CC(=C4)F,DB6ED149A78CFB4E_45988CA30A31F9B3_7019_UN,8.401227,00000000000000000000000000001000000000000010000000000000010000100100000010010000000101110000010010111100010111010101101011110100110000100110001011011010110111111111110,MXWNJULSLDSGTG-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC2C3(CCNC2)CCOCC3,F985FEBC3D21F816_084CF916CE8B0220_7022_DP,7.404909,00000000000000000000100000000010000000000000000000000010010000000010000000100001001000100011010000101000110001011000001011000000110111010110011001011101010011101111110,OIAUUVSSHRBBCF-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@]23CCCN[C@H]2CCCC3)F)[N]4C=CC=C4,F92F3C19E2A24667_7DCE6A0F65174E5E_6041_DP,7.867708,00000000000000000000000000000000000000000010000000000100000000100110000000010000101101010011000010101100110100011000001011100100110101110110001011011011010110101111010,RYWRLGQKRPWIBJ-LEWJYISDSA-N
FC1=C(C=CC(=C1)C2CC2)NC4CC(C3=CC=N[N]3C)OCC4,DEE2BAA2E9BFF684_98D4D8FC1B073280_6041_UN,7.8453794,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010010011111100000100111010000001011101100110011110100001011011011110011101111110,XCNVBSLBBKQCDO-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NCCN3CCC2=C(C=CS2)C3,00F43DABF3866C46_89CDFA192BE925A3_6041_UN,8.284999,00000000000000000100100000000010000010000000000000000000000000000100000000110001011101101001010010101100110000011000001011100100110001010110011011011101010110101111010,MITLPQNJFKLXLR-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)C3(CCC3)C4=C(C=C(C=C4)F)F,A0CFDA58F98DA99D_54B0AC9134910285_6038_UN,7.6758757,00000000000100000000000000000000000000000010000000000000000000100010000000010000101001110011110000101000010110111001111001100000110000100110001011011011011110101111110,ICQFGJNIPHPNQN-UHFFFAOYSA-N
CN1CCCC1C2=CC=C(C=C2)NC[C@@H]3C[C@@H](CN3CC4=NC=C[N]4C)F,16EB6C2FA33E4CF3_1010BC7D68F5FCBE_6041_UN,7.9587445,00000000000000000000000000000000000000100010000000000000000000100100000000010101001101110011010010001000000110010001101011100100110001110110001010011111010110101111010,KKTWLURXLQJZOO-CTCAENTCSA-N
FC2=C1C(=C[NH]C1=CC=C2)[S](=O)(=O)N3CCC4(CC3)CC5=C(CC4)C=CC=C5,92646662CB9B9026_814D93096CC5A048_6026_UN,8.9233,00000000000000000000000000000000110000000010000000010001001111001111000001010000110100111000001011101110011100011000011011101100111000101110001011011001010010110111110,JJPOIBMHXWNIPF-UHFFFAOYSA-N
CC1=CC(=C(C=C1)F)NC23CC(C)(C2)OC34CCOCC4,21C260E635783921_B88DD04CAFE88160_6041_UN,7.2997303,00000000000100000000000000000000000000000010000000000000010000000010000000000000000100110111000111100000110111011001001010000000110011110110000011010111110011111111110,YMNHEWLXZRXVMQ-UHFFFAOYSA-N
N(C1C2CCC(C1)CC2)C(=O)CCC3=C(C=CC=C3F)F,C28C73E6BBDC0C46_DD58AA5F1E6F282A_6038_UN,7.263981,00000000000000000000000000000000000000000010000000000000000000000000000000000000000000010011100000000000110100110000011000000000110011100000000011010011001110100111110,OGBNIFGTVWUCPI-UHFFFAOYSA-N
FC2=C1N(C3=C(C1=CC=C2)CCCC3)C[C@]4(C)COC[C@@H]5CCCN45,D1FB9B80C32C8E44_0ED330817ABE7B54_6034_UN,7.831589,00000000000000000000000000000000000000000010000000000000010000000110000000010001000101110000000111101100010111011001101011100100110000100110001011011000010111101111110,BGZZSZVSUZELTQ-YCRPNKLZSA-N
FC1=C(C2=C(C=C1)C(=NC=N2)NCCC(C3CC(C)(C)OCC3)CC4=CC=CC=C4)F,B370375D64748A35_B9C31BA52EE32DD6_6041_UN,8.020412,00000000000000000000000000000000000000100010000000000000010000000110000000100100101000010001000000101100110111011001101011000100110011110110001011010111110111101111110,LPSDLKJDWWYNDV-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC(OC)C3CCOCC3,33A98CE434662751_575C1D93D63E37A5_6041_UN,7.734048,00000000000000000000000000000000000000100010000000000000010000000100000000000100001000110001010100101100010111000000101011000110110011110110011011010111110111111111110,JKXJHZJYTSYXFO-UHFFFAOYSA-N
CCC5CCC1=C(C4=C(N1CC3CCN(CC2=CC=CO2)CC3)C=CC(=C4)C)C5,AD9592D2A6BDEEE4_4AD388F7C786D64E_6034_UN,8.0440855,00000000000000000000000000000000000000000000000000000000010000000100000000010000000101100000000110101100010010010010101011100100110010000110001011011100110110101111110,TUAVARFZKHRIMA-UHFFFAOYSA-N
CC[C@@H](OCC1OCCC12CNC2)C3=CC(=C(C=C3)F)C,9FE8A496A498B20A_32F3EC545FFD6019_6039_DP,8.387186,00000000100100000000000000000000000000000010000000000000010000000010000010000000001100110011000011001000010111001010001011000010110010100110000010010111110101111111110,YCKUZFBXVOAKOZ-AAFJCEBUSA-N
CC1=CC=C(C=C1)C2=CN(C(=N2)C3NCCCC3)CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,9EFFB522B524287D_FCA1DAE81806B29B_6034_UN,7.7736077,00000000000000000000000000000000000000100000000000000000000000100100000000010101001101010011000010101001100110010010101011100100110100100110001011011111010110101111010,MDZVMLUCOFMEAB-UHFFFAOYSA-N
C(C2COC1(CCOCC1)O2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,706347766F7A84F9_EBE587D8D9E821CC_7019_UN,7.7000384,00000000000000000000000000000000000000000010000000000000010000000000000010000000000101110100010010110000010111011000101010110000110011110110000011111010110011111111110,ORQGRKJIEXSJPY-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=C[NH]2)NC(CC)CCC3CCCCC3,25013BDABD1DD30D_B1355591B8F5A97F_6041_UN,7.8050504,00000000000000000000000000000000000000000000000000000010000000000100000000000001000100000010000010000100110010010010101001000100110101010100001011010111000110101111010,WIDDNYZFEQVXBM-UHFFFAOYSA-N
NCCC2=NC1=C(C=CC=C1Br)N2C[C@H]3[C@H](CC(C)(C)C)CNC3,F02C1469B982C492_7AA1103B9082E913_6034_UN,8.200834,00000000000000000000000000000000000000100000001000000000000000000110000000110101101111110011000010001100110110011001001011100100110100100110011010011111010110101111010,QHVKOIUDQBJLKR-KGLIPLIRSA-N
FC1(F)CC15CCC(C=CC2=C[N](N=C2C3=CC(=C(C)C=C3)C)C4=CC=CC=C4)CC5,2D08DB739C7056B1_D38DF9AAC00F7A78_7019_UN,7.9614778,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011110000010101111010,UROXWQVCKYPGCE-UHFFFAOYSA-N
FC2=C1C=C(N=CC1=CC=C2)NCC3CCCC(CC)CC3,B5D717B60B83016E_016D908647B37D06_6041_UN,8.171624,00000000000000000001000000000000000000100010000000000000000000000100000000000100001000010011000000101100010110000010101001000100110001110100001001010001010110101111010,PQULQJPLVPLRHH-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)NCC2(CC2)C3=C(C=CC=C3F)F)C4[C@@H]5CNC[C@H]45,44E288A54044F86E_DA273984AE47FC45_6041_DP,8.181867,00000000000000000000001000000000000000100010000000001000000000100110000000000101101101110011011010101000010110011001000011101100110101110110001011011011010110101111010,IUYXJTSNFXRCQM-DBIVSCPCSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC4OC3CCCC3C4,24F0AE3025ACB16F_BF94D74A1891E35B_6041_UN,8.208657,00000000000000000000000000000000000000000010000000001000010000000100000000010000101100010010011110001100010100000000001011101100110011110100001000011001110111101111110,QCNWWXIWDOOQFF-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC(CC)C3CCCCO3,1788B92F510A911A_032331E7FD6525B7_6041_UN,7.5686426,00000000000000000000000000000000000000000010000000001000010000000100000000010000100100010011011110100100110111010010001011101100110011110100001001011101110111101111110,ICNIDQKUQWXTBO-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2CC3=C(CCC2)C=CC=C3,2E692E4C61E7E1FC_6AEE39FC91244EFE_6041_UN,7.589703,00000000000000000101100000000010000000000000000000000000000000000100000000100001001000100011010000101100010000001000001001000100110001010100011011011111010110101111010,IAFZDZPUGXXPDQ-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC(C4CC4)C5=C(C=CC(=C5)F)F,7F8F87115ECF68A7_3D960774E77B0275_6041_DP,8.166704,00000000000000000001001001000000000000100010000000000000000000000100000000000100100101010011010010100000111100010000101011100100110101110100001011011011000010101111010,RNYXIADJZGFIFU-IWGXEIINSA-N
FC1=CC(=C(C=C1)NC[C@H]3[C@H](C2=NC=C[N]2C)OCC3)C4CC4,93A6733C44DF93AE_84333BD5F3FCBF02_6041_UN,8.090627,00000000000000000000001000000000000000100010000000000000010000100100000000010101001101010011010111001000000101000000001011100100110011110110001010011011110111101111110,ZCBLVEYNJHYTFE-SUMWQHHRSA-N
FC2=C1CCCC1=CC(=C2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,AC8F5F48B6E2928B_A9A195EFFC1A0E5D_6041_UN,7.62994,00000000000000000000000000000000000000000010000000000000000000000000000000000000100001110011010010001100010110010001101000100100110001110000001011011011010110101111010,BXMIHMWTSPQAKR-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2C3(CC2)CCC3)F,0AF0245472F38904_436A6065445345FA_6041_UN,7.104252,00000000000100000000000000000000000000000010000000000000000000000010000000100000001001110011010000001000010100001001001000100000110001110010001010011111010110101111010,NBYGTHBQPBZHBK-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NCC34CC(C)(CO3)CCC4,04050552EBF8530E_64E44D4B41E54544_6041_UN,7.057564,00000000000000000001000000000000000000000010000000000000010000000110000000000000101100010011000110101100010111001001101011000100110011110110001011010111110111101111110,TWGSKQPALKALJD-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCCC3(C2)OCCO3)Cl)C4CC4,AC8A513AA52766B0_84EC0EF116CBFE24_7022_UN,7.6391296,00000000000000000000001000000000000000000000000000000000010000100000000010000000001100010011000010001001010111001000001010010000110011110110000011010011110111111111110,ZGEFPAPLROQQRK-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NCC2CC3(CN2)CCC3,C32585A1C802454A_C7020D6E5D9F0AA4_6041_DP,7.229168,00000000000100000000100000000010000000000000000000000010000000000010000000100001001100100011010010001000110000011000001001000000110101010110011000011101010110101111010,VQKMBYKHJZLXIG-UHFFFAOYSA-N
N2CCC(OCCN1C(C)(COCC1)C)C(C2)C3CCOC3,E1937D7A25EF1604_EDA8E678291188D8_6039_DP,7.959166,00000000000000000000000000000000000000000000000000000000010000100010000000110000001101100001000111101000100011011001101011100011110010000110001101111111110111111101110,CZVBTVPJHCMKRX-UHFFFAOYSA-N
CCNC5CCC1=C(C4=C(N1CC3(C)CC2CC2C3)C=CC(=C4)Cl)C5,B9F824506BD2058D_7D579FBC17F5C2A6_6034_UN,7.91482,00000000000000000000001000000000000000000000000000000000000000000110000000010000001101010010000010001101110110011011001001100100110001100110001011011101010110101111010,FEPORFMPCRSZMJ-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2C(CCCN2)(C)C)F)CC3,6393B833F44E805A_2F57EA0947566C42_6041_DP,7.7867527,00000000000000000001000000000000000000000010000000000010000000000010000000110001101001110011010000101000100110011001101011100000110101110110011011011111010110101111010,TVUGXPVQLRUDFW-UHFFFAOYSA-N
O(C3CCC4C1CC(C2OC12)C34)C5=CC=C(C(=C5)C(F)(F)F)C#N,D1FBD0503463AC6D_8B766AA5D34A5336_6003_UN,8.713552,00000000000000001001001000000000000000000110000000000000010000000000000000000000000000000000000010100100011100001100001000000011110010100100000111010010100001010111110,JZUVWRCWHGJCOI-UHFFFAOYSA-N
[S](=O)(=O)(C1=CC2=C(C=C1)C=C[NH]2)N3CC4(C3)OCC=CC4,A57E855BDD2DD2B4_1D1C2B39305CE2C5_6026_UN,8.825575,00000000100100000000000000000000110000000000000000010001011111001111000001010000010100101000001110111110011001001000010011101100111010001110001001101001110011110111110,OKULVYZWGUIFCH-UHFFFAOYSA-N
CN(CC1CNC1)CC2=NN=C(C=C2)NC3C(C)OC4=C3C=CC(=C4)F,F8744F59CBE40558_CD4FBBDEFC1A1728_6041_DP,8.203355,00000000100100000000000000000000000000100010000000001000010000000100000000000101101101110010011111101100010110010101000011101100100101110110001011001111110111101111110,QZQCGRNLBCSTTA-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC3C(CCC(C)C)CCC3,B9F09B65CE779785_1E7C95B5DE3EF261_6041_UN,8.258822,00000000000000000000000000000000000000000010000000000000000000000100000000100001000000010011000010100100110100010001101001000100110001110100011011010111000110101111010,RHNXZDXLILRUHV-UHFFFAOYSA-N
N(C1=C(C=CC=C1)C2=CC(=C(C(=C2)F)F)F)C([C@@H]3CC(CN3)C45CC(C4)C5)=O,E0C383F8B8F73CC7_BA6BBF24574AEE9B_6038_DP,7.4214277,00000000000100000000000000000000000000000010000000000010000000100010000000000001001100010011100110001000110100111000010001000100010101110100001011000011011010100111110,QERDWPJRPFUXBS-FYFSOUBKSA-N
O(CC2CCOC1(CCCC1)C2)C[C@H]3CNCC(O3)(C)C,7528E90B7AACCFE8_2CCDDA659D3FF22F_6039_DP,7.1060066,00000000000000000000000000000000000000000000000000000000010000000010000010100000001000100010000111101000010011001001001011000010110010000110000001110101110101111101110,VLPBQYINAXXHJW-YSSOQSIOSA-N
FC1=C(C=CC2=C1CCC2)NC3=CC=CC(=C3)C4CCN(C)CC4,7F4E701F21B9C39B_8E6BE238153A62CE_6041_UN,7.5144863,00000000000000000000000000000000000000000010000000000000000000100000000000010000000001110001010010101100010100010001101001100100110001110110001011011011010010101111010,RIOTYXYYBGZBOS-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC(=C2)NCC3CCN(C)C3C4=CC=CS4,4DBDDF1E0B4B453D_D87F782DB05E7E8A_6041_UN,8.478363,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010001100010110010001101011100100110101110110001000011011010110101111010,QKUSYCKSIFMLEN-UHFFFAOYSA-N
ON=CC1=C(C(=CC=C1F)C2OCCO2)NCC3(CCCC3)C4=CC=C(C=C4)F,1B12CCE9FD5A1C2E_C17C9667F1412402_6041_UN,7.5825214,00000000000000000000000010000000000000000010000000000000010000100010010110000010101100010011001011001010000101001000001110011100110111110111001011110011010111110111110,CFAYIARLYJPGQG-UHFFFAOYSA-N
CC2=NC=C1C(=C(C=CC1=C2)F)NCC4OC3(CCC(C)(CC3)C)CC4,5152648683EBD379_20293121E6156CA9_6041_UN,7.465883,00000000000000000000000000000000000000000010000000000000010000000110000000100000101100010011000110101100010100001001101011000100110011110100011011010111110111101111110,SGYBDLKFNFYQPC-UHFFFAOYSA-N
C1(=CC(=CC=C1)C2CCCCC2)NC4=C3OCCCC3=CC(=C4)F,6F55D3EA3FB69315_B70AFC6D880B782F_6041_UN,8.292844,00000000000000000000000000000000000000000010000000000000010000100000000000000000000000010001000100100100010101000100001000000100110011110100000011010001110011100111110,NLYUWKCKAMDQGU-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC=C2NC4CC(C3=NC=C[N]3C)OCC4,BE9C29B71607D029_A56CCE1356417D4E_6041_UN,7.933018,00000000000000000000000000000000000000100010000000000100010000100100000000010101100101010010010111100100110111010000001011100100110111110100001011011011110011101111110,AKJJZTJQXKSFNQ-UHFFFAOYSA-N
C(C1CCCCC12CCC2)=CC3=C[N](N=C3C)C4=CC(=CC=C4)F,485E5AB07611BB2A_ED44410757272044_7019_UN,7.8452983,00000000000100000000000000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011010000010101111010,DWMGBNWRNFUZLH-UHFFFAOYSA-N
FC1=CC(=C(C=C1)C2CC2)NCC3=N[N](C)C4=C3CNCC4,625C68B7FE0997E0_7EF656D423386BDB_6041_DP,8.125408,00000000000000000000001000000000000000000010000000001000000000100100000000010001101100110001011010101100110110010000101011101100110101110110001011011011010110101111010,VSWSCJXPBXKUBW-UHFFFAOYSA-N
N(C1=CC(=CC(=C1)F)N2CCOCC2)C(C45CC(C3CNC3)(C4)C5)=O,D56937B9B7F3E997_27175BE8C38F9514_6038_DP,7.48621,00000000100100000000000000000000000000000010000000000000010000100010000000010000101001110011100100101000010101111000011011100000110111110110001001011001011011110111110,JEWJEJDQTBSTQQ-UHFFFAOYSA-N
CC1=C[NH]C2=C1C=CC(=C2)NC3CCN(C)C34CCCNC4,1674C98BFB4909CF_A284388D828423A8_6041_DP,7.8895454,00000000000000000000000000000000000000000000000000000100000000000110000000010001101101100011010010101100110010011001101011100100110101010110001001011101010010101111010,FOYVRORGRAWJLR-UHFFFAOYSA-N
COCC1=C(C2=C(N=C1C(C)(C)C)SC3=C2CCC3)C4=CC(=CC=C4)Cl,08862A80EE721D14_B3CD431E6E605396_2201_UN,7.0002756,00000000000000000000000000000000000010000000000100000000000000100110000000100000010100111000010011100101010111001001001011000110010000100100010011010110010111001111110,LLYPHTIEOLAECK-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)N[C@@H]2C3CCC(C2)CC3)Cl)C4CC4,F9C5177C49C2B378_66136B4F1653BC16_7022_UN,7.2872257,00000000000000000000001000000000000000000000000000000000000000100000000000000000000000010011000000000001110110010000001000000000110001110000000011010011000010101111010,FFNBOPPJBJQFTH-AJUCZRQESA-N
FC2=C1C=C(N=CC1=CC=C2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,05766F342737C397_1838C2E4CB8BD356_6041_UN,8.071858,00000000000000000000001000000000000000100010000000001000000000100100000000010101101101010011011010101100010100010000001011101100110001110110001011011011010110101111010,IGGHCLVEYRGMGN-ZHRRBRCNSA-N
CC1=C(C=C(C(=C1)NCC2C(C2)C3CCCC3)Cl)C4CC4,A00D01A7C240B757_03CBE1A2FBC8BAB1_7022_UN,7.2465954,00000000000000000000001000000000000000000000000000000000000000100000000000000000001000010011000010001001000110000000001000000000110001110000000010010011010110101111010,JSBKJBYTGKPCMJ-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)NCC2CCNC(C2)(C)C)F)C#N,2D36EFEE5591667A_9F078DA2266187C1_6041_DP,8.00646,00000000000000000000000000000000000000000110000000000000000000000010000000100000001000010011000000101000100110011001101001000000110101110110011011010111010110101111010,DAWZEHWSPHXFLF-UHFFFAOYSA-N
BrC1=CC2=C(C=C1)N(C3=C2CCCC3)C[C@H]4[C@@H](CNC4)C5CCOCC5,74B1C433E1EE29C4_21DAA8EEE4187181_6034_UN,8.516037,00000000000000000000000000000000000000000000001000000000010000100100000000010000101101110011000010101100010101010000001011100100110010100110001011011011010111100111110,FZXSAKQZMWFLFQ-JXFKEZNVSA-N
C1(=CC2=C(C=C1)C3CCC2O3)NC4=C(SCC)C=CC=C4F,C81CF4F6032A5B87_30CD82C0422A6E74_6041_UN,8.435789,00000000000000000000000000000000000000000010000000000000010100001000000000000000010100011001000010000100010100000010001000000100000011110100000011010011110111101111110,CRGVYDPPVAUULA-UHFFFAOYSA-N
C1CC(CCN1)C3=CC2=C(C=CC=C2)N3CC4(C)CCCNC4,1F0B143DEC2E75F0_F9B35D6A370756A0_6034_UN,7.7042365,00000000000000000000000000000000000000000000000000000000000000100110000000010000101101100011000010101100110010011001101011100100110100000110001011011011010110101111010,UASYOSIETZLWCU-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NCCC2NCCC3=C2C=CC=C3,CCE9C651A95BEA4C_0620AE69DC518E85_6041_DP,7.284083,00000000000000000100100000000010000000000000000000000100000000000100000000100001101000100011010000101100110000011000001011000100110101010110011011011101010110101111010,OLHSKQSSOFTTPG-UHFFFAOYSA-N
C1(=CC(=C(Cl)S1)Cl)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C,1AD63FAFDEF69376_89F0E962848A0704_7022_UN,8.721909,00000000000000000000000000000000000010000000000100000000000000100100000000010101111101111011010010101001000110010001101011100100110001110110001010011111010110101111010,WDMHRPWCNKUSHN-IINYFYTJSA-N
FC1=CC2=C(C=C1)C(=CN2CCC(CC)C)C3=CCNCC3,203285F36D9B9FEC_982DE37C12CFA05C_6034_UN,8.662345,00000000000000000000000000000000000000000010000000100000000000100100000000011000001101110001000010111100110110010011101011100100110000100110001001011101010110101111010,SZLPELZGIFLYJQ-UHFFFAOYSA-N
N2CC[C@@H]1CN(C[C@@H]1C2)C3=NC(=CN=C3)NC5=C(N4CCN(C)CC4)C=CC(=C5)F,69F5475F6810AEC8_5C13C2519CD667E2_6041_DP,8.208881,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011010010101100110100010001101011100100110101110110001011011011010010101111010,CMXALPZDOFEZQH-SJORKVTESA-N
C[Si](C)(C)CC1=C(C=CC=C1)NC[C@@]23CCCN[C@H]2CCCC3,04FEE0F45BB9EC48_3E64518243AB7E80_6041_DP,7.6077514,00000000000000000000100000000010000000000000000000000100000000000010000000100000101000100011010000101100110000011001001001000000110101010110011011011111010110101111010,XHLOODVVNZRPDY-VQTJNVASSA-N
FC1=CC(=C(C=C1)NCC23COC(C)(CC2)C3)C4CC4,11C6BCE77A95B3DA_91539C0DDEF4C9F0_6041_UN,6.9469404,00000000000000000000001000000000000000000010000000000000010000100010000000000000001100010011000011101000010111001001101000000000110011110110000011010011110111101111110,YSMYJYROHQKROD-UHFFFAOYSA-N
C2(=C1C=CC=CC1=CC=C2Cl)NCC3(C)CCC4(CC3)CC4,80BB898BD2E7D836_EC8F9B7D0FE200A4_7022_UN,7.575136,00000000000000000000001000000000000000000000000000000000000000000010000000000000001000010011000000001101010100001001101000000100110001110000000011010011010110101111010,FIBCIIHJUZGALU-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NCC4(CCCC4)C5=C(C=C(C=C5)F)F,E85FDEE0C7860C76_B5C312FDD4FA604A_6041_DP,7.9233184,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000010110001000001011100100110101110110001011011011010110101111010,HWLHKKMSTBQIQL-GWTOYCKXSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(CC)CCCN3C)C4=CCNCC4,467A3843BD87DEF5_7233FACA0A459129_6034_UN,8.292361,00000000000000000000000000000000000000000010000000100000000000100110000000011001001101110001010010111100110110011011101011100100110000100110001001011111010110101111010,YGJGPFSBTGKQHL-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)N[C@H]4[C@H]3CCCCCC[C@H]3C4,4920AB2EB38F219E_C7BFAC5AA60A7228_6041_UN,7.9834356,00000000000100000000000000000000000000000010000000000000000000000100000000100000100000010011000000100100110100010000001001000100110001110100011011010111000010101111010,DKPUOTLZHXGLBJ-ABSDTBQOSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCCC2(C)CCCC2)F)CC3,54A58D300548444C_00DD370C9B8A31BE_6041_UN,7.7060757,00000000000000000001000000000000000000000010000000000000000000000010000000010001101001110001010010001000100110011001101011100000110001110110001010011111010110101111010,MPPUWJXGMGTAOM-UHFFFAOYSA-N
FC2=C(C=C1C=C[NH]C1=C2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4,78AB4ADAB3CF8C3B_1CE2C3A874992950_6041_UN,8.451367,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101100010110010001101011100100110101110110001011011011010110101111010,KYYNROPZBOPFKC-UWJYYQICSA-N
CC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCC3)CC(CC)NCC4=C(C=C(C=C4)Cl)Cl,7ABDE5C18467375D_6FACBD8D73112467_6034_UN,7.822111,00000000000000000000000000000000000000100000000000000000000000100100000000010101001101010011000010001001100110010010101011100100110100100110001011011111010110101111010,YXIOCVJIOCDXJV-UHFFFAOYSA-N
NCC1=CC2=C(C=C1)C(=O)C=CN2CC3(OC)CNCC3,525C685AA796F78A_0DDC06AA9C2CE80C_6034_UN,8.978626,00000000000000000000000000000000000000000000000000000000000000000110000000010000101111100011010111101100110010011100101011100111110110000110001101011001111111111111110,KFOLMTWPIKDVBA-UHFFFAOYSA-N
CN(CC1CCNC1)C2=NC(=CN=C2)N[C@@H]3C5=C(OC4(C3)CCCC4)C=CC(=C5)F,BBB19DFCA0716E7D_F16887DAF5196A48_6041_DP,8.152422,00000000000000000000000000000000000000100010000000000000010000000110000000000101101101110011010011101100110110011101001011100100110111110110001011011001110111101111110,VTQIBNXBVAJGKM-CVMIBEPCSA-N
FC1=CC(=C(C=C1)NCCC2CCCN(C)C2)C3CC3,035DF29C646393F8_A1A294924C721BC8_6041_UN,7.6713758,00000000000000000000001000000000000000000010000000000000000000100000000000010000001001110001010000101000100110010001101001100000110001110110001011011011010110101111010,PBCMGLZGQHGMRN-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CN=C2)NCC(N3CCOCC3)C4=CC(=CC=C4)F,76E6FC1190607176_CE833CD44BC8E089_6041_UN,7.603451,00000000000000000000000000000000000000000010000000000000010000000100000000010001101101110001010110101100010101010000001011100100110011110110001001011001010111101111110,CKHUTDJRWKPYJR-UHFFFAOYSA-N
CCOC4(COCC3CC1(CC2(C1)OCCO2)CO3)CCC4,26A4FEFCEA9B36CA_7DBA9BCBDF2BF472_6039_UN,7.427945,00000000000100000000000000000000000000000000000000000000010000000010000010000000000100100000000010000000010011001010001010010011110010000110100100110000110101011000110,UJPFRNOWAWLHIF-UHFFFAOYSA-N
C1(=CC(=CC=C1)C2(CCOCC2)C#N)N[C@H]3[C@@H](C3)C4=CC(=C(C(=C4)F)F)F,551F5DC35A6D96B1_F07653701363B825_6041_UN,7.568679,00000000000000000000001000000000000000000110000000000000010000100010000000000000000000110010000000100000100101011000001000000100110011110110001011010011010011100111110,CPSFPOGVCKPRID-QFBILLFUSA-N
N(CC12CC(C1)CCO2)C(=O)C3CCCCN3CC4=CC(=CC=C4)F,6E1ABCDBCDDADC14_6CDAAFFA2496331C_6038_UN,7.9258533,00000000000100000000000000000000000000000010000000000000010000000010000000010001001001110011100100101000010101111000011011100000110010100110001001011011111111110111110,CLMMSLJLTPFRML-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CC=N2)NCC3(CCNCC3)C4=C(C=NC=C4)F,07932ED764732AAC_01FA640B6B136027_6041_DP,7.700842,00000000000000000000000000000000000000000010000000000000000000100110000000010001101101110011010010101100110100011000001011100100110101110110001011011011010110101111010,IVMADCHZTGATTK-UHFFFAOYSA-N
CC(NC(=O)C1CC2CCC1CC2)CC3=C[NH]C4=C3C=C(C(=C4)F)F,9A2052438DFFE0C7_18B1DD3376052647_6038_UN,7.6217465,00000000000000000000000000000000000000000010000000000000000000000100000000000000000100010011100010000100110100110001011001000100110100100100001011010011001110101111110,QLDRUIAPROCTHI-UHFFFAOYSA-N
N(CCC2C1CC1CCC2)C(=O)C3=CC=C(C=C3)C4=CC(=C(C(=C4)F)F)F,C6A36E18381664DE_D8B29967D7460758_6038_UN,7.8846865,00000000000000000001001000000000000000000010000000000000000000100000000000000000001000010001100000001000110100110000011000000100110000100000000011010011011110100111110,DOZSEGHOKBMKGD-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC4OC3(CCC(C)(CC3)C)CC4,C6E4B9DFA3F41EC8_8AC6DE614D8AEFD7_6041_UN,7.528372,00000000000000000000000000000000000000000010000000000000010000000110000000100001001100010011000110101100010110001001101011000100110011110100011011010111110111101111110,XCXNBKBMAPOJHB-UHFFFAOYSA-N
C2(=C1[NH]C3=C(C1=CC=N2)CCCC3)NC4=CC=C(CC[Si](C)(C)C)C=C4,82710312B5EE1452_B36AA798ABE6EEE8_6041_UN,7.5066524,00000000000000000000100000000010000000100000000000000010000000000100000000100101000100100011010010100100110000011001101011000100110101010100011011011101010110101111010,JXUBOIKEAZWAAY-UHFFFAOYSA-N
ON=CC1=C(C(=CC=C1F)C2OCCO2)NCC3(CCC3)C4=CC=C(C=C4)F,8161FF1A4C51F2E5_CEB2A529A84FEE7E_6041_UN,7.5845194,00000000000100000000000010000000000000000010000000000000010000100010010110000010101100010011001011001010000101001000001110011100110111110111001011110011010111110111110,JIWINEUJPDCDPM-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NCC2=C3C(=NC=C2)CCCC3,A5BC41FA13D11ACF_35B86E9187B2A60E_6041_UN,7.797966,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100001010000101100010000011000001011000100110001010100011011011111010110101111010,WAMWIQDPYQWHPO-UHFFFAOYSA-N
O([C@@H]1COC[C@H]1N2CCOCC2)CCC3CC(C)(C)OC3,401BE7AA6E829D58_90E24309A775833F_6039_UN,7.1761093,00000000000000000000000000000000000000000000000000000000010000100010000010110000000101100100000111101000000011011001101011100011110011000110100100111110110111111101110,LFHVZPXJPPBMAP-JVIGXAJISA-N
CCNC4CCC1=C(C3=C(N1CC2=COC(=N2)C(C)(C)C)C=CC(=C3)Cl)C4,07875D5EBCD1DF4D_C84A4F9C0A7D878F_6034_UN,8.183197,00000000000000000000000000000000000000000000000000000000010000000110000000110001001101010010100111001101110110111010011011100100110001100110011011011101010110101111110,OIRLLABLDKLLOA-UHFFFAOYSA-N
CC[C@@H](OCC1CC2(CO1)CCOCC2)C3=CC(=C(C=C3)C)F,BB0C49D47C7D63B0_91B19F611322DD70_6039_UN,7.5859685,00000000000000000000000000000000000000000010000000000000010000000010000010000000000100110000000010100000010111001010001010000010110010100110000011110110110101011011110,LOGKHPBTKYQTTG-UHUGOGIASA-N
FC1=CC2=C(C=C1)C=CC(=N2)NC4=C(CN(C)C3CCCCC3)C=CC=C4,239D125A5825FE89_93205448C105FAF1_6041_UN,7.88399,00000000000000000000000000000000000000100010000000000000000000000100000000000100100001110010010000101100010110010001101001100100110001110100001011011011010110101111010,NPISQDCZWTYAEY-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NC[C@@]34[C@@H](CCC3)OCC4)C,CA7EA4BEB9DDAB14_065A5CDD02EC05B8_6041_UN,7.597332,00000000000000000000000000000000000000000000000000000100010000000110000000000000101100000011000011001100010001001000001011000100110111010110001010010111110111101111110,RIPLQTGXECYMLB-QZTJIDSGSA-N
CN(CC1CCNC1)CC2=NC=C(N=C2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,222863008F63E274_CF77F27A78F28DF4_6041_DP,7.700236,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000100110010001001011100100110101110110001011011011010110101111010,NWODYYHVHFGTFF-IGGKNEPZSA-N
CN(C)CC1=C(C=C(C=C1)NCC3=CC2=C(CCCCC2)S3)F,93CFFB9D52003DD9_0F9B3CBC47DBABFE_7022_UN,7.4133496,00000000000000000001000000000000000010000010000000000000000000000000000000100000011101111000010010001100010100000001001000100100110001110110001010011111010110101111010,GIKOKCOFKKNAAP-UHFFFAOYSA-N
C1(=C(C=CC(=C1F)F)Cl)NCC4C2(C3=C(C(C)(CC2)C)C=CC=C3)C4,77DA51C7252C3E05_DD6E79F6CE524AA9_7022_UN,8.569084,00000000000000000000001000000000000000000010000000000000000000000010000000100000001000010011000000001101010100001001101000000100110001110000000011010111010110101111010,SKESXPBOZNWGMR-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)NC2C(C)OC3=C(C=CC=C23)F)[C@H]4C[C@@H]5CC[C@H](C4)N5,4C89A2CB36ECD445_657F1E3135D5DBF4_6041_DP,7.84869,00000000000000000001000000000000000000100010000000001000010000000100000000000101100101110011011111101100110100010101101011101100110101110100001011011111110111101111110,UQSPIMYOAJFRSB-XGCHDUHPSA-N
C[N]1N=C(N=C1NCC2(CCOCC2)C3=CC(=CC=C3)F)C4CCOCC4,BCC7446A5E06DF0F_7E22DD4E678A0E63_6041_UN,7.782049,00000000000000000000000001000000000000100010000000001000010000100110000000010101101100110011011010101000001111001000001011101100110011110110001011011011010111111111110,NQVVBWGEHDVINQ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CC3(C2)CCOC3)Cl)C4CC4,A0357042AEDEEF22_0DE1C881CBA7061A_7022_UN,7.670022,00000000000100000000001000000000000000000000000000000000010000100010000000000000000100110001000010000001110111011000001000000000110011110110000010010011010011101111110,NCVZYASVSKPELL-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC(C)C34CCC(CC3)C4,9DFFBBD1D8DEDF28_8D69876D1B4C6ACD_6041_UN,7.9198194,00000000000000000000000000000000000000100010000000001000000000100110000000010101100100010011011010100000010110001000101011101100110001110100001011011111000010101111010,SFVOKGMBHZAVIJ-UHFFFAOYSA-N
N(C1=C2C(=CC=C1)CCOC2)[S](C4=C3[NH]C=CC3=CC=C4)(=O)=O,F71FC23917B73CF1_337C238BCC4E4EE6_6029_UN,8.531551,00000000000000000000000000000000110000000000000000010101011111001101010001000000110100101011001011100110011001001000011011001100111111011110001011111001010011110111110,ROLVIWRJNPIPML-UHFFFAOYSA-N
C2(=C1CCCCC1=CC=C2)NC3=C(C=CC(=C3)CN(C)C)C,0909ADBBB5A43B6F_7F9E255328E09F49_6041_UN,7.286337,00000000000000000000000000000000000000000000000000000000000000000000000000100000000001100011010000001100010000000001001000100100110001010000011011011111010110101111010,OGCKTSLMLVMFKU-UHFFFAOYSA-N
C2(=C1CCCCC(C1=CC=C2)=O)NC3=CC4=C(C=C3)C=NC=C4F,9CEC97139F53D40A_A9F61871F686D8B8_6041_UN,8.555892,00000000000000000001000000000000000000000010000000000000000000000100000000000000000000010011000000100100010100000000001001000101110011110100001111010001101010100111110,GNGOKBWZJJBPRW-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC(C)CCC3CCCO3,E03F87735BE52DEF_238B052FFD1D04B5_6041_UN,7.7458334,00000000000000000000000000000000000000100010000000000000010000000100000000000100000100010010000010100100110101010001101011000100110011110100011011010111110111101111110,KOJUWNZJKCXQSY-UHFFFAOYSA-N
BrC1=CC2=C(N=C1)N(C=C2C3CC3)CC(CC)NCC4=C(C=CC=C4)Br,6EBAF3205DDB3408_728D0463BF08EDBC_6034_UN,8.217813,00000000000000000000001000000000000000100000001000000000000000100100000000010101001101010000000010101100110110010010100011100100010000100110001011011011010110101111010,YIQSJZSWZKKZGJ-UHFFFAOYSA-N
C1(=C[N](N=C1)CC2CCOC2)N[C@H](CC)C3=CC(=C(C=C3)C)F,8F2B96676DC5FBFD_CDBA73090F4DFE0B_6041_UN,8.459926,00000000000000000000000000000000000000000010000000001000010000000100000000010001100100110001001011001000100101010010001011101100110011110110001010011111010111101111110,WLBLZBJDYJTZQP-XPKAQORNSA-N
C[C@@H]1NCC[C@@H]1N(C)CCOC3=C(C=C2OCCOC2=C3)Br,04D74052BFA2525E_DFCBD44929D569EC_6035_UN,7.8990192,00000000000000000000000000000000000000000000001000000000010000000000000010000001101101110111010110101100110111010101101011100011110011100110001111111111110111111111110,XFSOKAPARYUJKM-AAEUAGOBSA-N
CCC(C)[N]1C=C(C=N1)N[C@@H]2CCN(C)[C@H]2C3=CC(=C(C=C3)F)F,45F90350DF429D55_30D7430D59A5CE61_6041_UN,8.546495,00000000000000000000000000000000000000000010000000001000000000100100000000010001100101110011011010001000100110010011101011101100000001110100011010011111010110101111010,GXEUPIBSXNGMKQ-ALTJMEPPSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC3C4(C3)CCOCC4,57AE1F908B03FB94_60B96C67279BE287_6041_UN,7.455069,00000000000000000000001000000000000000100000000000000000010000000110000000000100000000100011000000100100110001011000001011000100110011010110011011010111010011101111110,GSXNUOGYLBCSGK-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2(CC2)CC3=C(C=C(C=C3)F)F)C4CCCC4,41B2C5AEC98EC594_6BAC470C0C82F58E_6041_UN,8.13303,00000000000000000000001000000000000000100010000000001000000000100110000000010101100100010010011010000000100100011000001011101100010001110100001010011011000110101111010,ZEZKIWUWCMKGON-UHFFFAOYSA-N
ClC2=C1C(=CN(C1=NC=C2)CCN3CC(C)(C)SCC3)CC4=CC=CC=C4,CCFB3B08F82E4317_F88377D191E2A751_6034_UN,8.629886,00000000000000000000000000000000000010100000000000000000000000000110000000110101010101111000000010101101010110011001101011100100110000100110001001011100010110101111010,NFBAVDRPJWPOKF-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)CC4=C(C=C(C=C4)F)F,4EE953012E16C2EB_401BE64D5335E1C6_6038_UN,6.9851947,00000000000100000000000000000000000000000010000000000000000000000010000000000000001000010010100010001000110100111000011000000000110010100000000011010011011110100111110,KFOUYMXIKAGCMZ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CNCC3(O2)CCC3)Cl)C4CC4,5B72A63915E40619_A754B1BDFCAD94B0_7022_DP,7.6285934,00000000000100000000001000000000000000000000000000000100010000100010000000000000101000110011000100101001010110001000001011000000110111110110001011010011110111101111110,YLKHXZJGYHAELT-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(C(C)(F)C3=CC=C(C=C3)F)=O,A5D000199C0CC13A_F2DD7350A75AB218_6038_UN,7.9666433,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100010010100010101000010110101000011000000000110010100100000001010001111111111111110,GNRVSFVJBSZBPV-UHFFFAOYSA-N
NCC3(COC1=C(C=CC(=C1)C2CNCCC2)F)COC3,5B5405FC1FDD94D9_E2E4E6FF1D7F46E0_6035_UN,8.122921,00000000100100000000000000000000000000000010000000000000010000100010000000000000001010110111000001101000100101011100001011000011110100100110001111010011110101110111110,REHVBWVUHHNJLO-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NCC3(C)CCC4(CC3)CC4,66C7ECB324BD8E1B_79BD27AC88FF611B_6041_UN,7.641982,00000000000000000000001000000000000000000010000000000000000000000110000000000000101000010011000000101100010100001001101001000100110001110100001011010111010110101111010,UMHFPEHNCIWJAL-UHFFFAOYSA-N
FC1=CC=C(C=C1)CC2=NC4=C(C(=N2)NCC3CNCC(O3)(C)C)C(=CS4)C5=CC=C(C=C5)F,9E4B8DC361B2D94C_74BAD255A93C2473_6041_DP,8.400662,00000000000000000000000000000000000010100010000100000100010000100110000000100100111100111011000110101100010110011001000011000100100111110110001001000101110111101111110,IOKQIKPSPYUQIK-UHFFFAOYSA-N
CC2=C1C(=C(C=CC1=CC=N2)F)NC4CCOC(C3=CN=C[N]3C)C4,6CBD12E91638673C_B16F3B81B8D0EF48_6041_UN,7.791074,00000000000000000000000000000000000000000010000000000000010000100100000000010101100101010010010111100100110111010000001011100100110011110100001011011111110011101111110,FJEHSUQRYAKXRZ-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C#N)[N]2C=C(C=N2)NCC4NC3COCC3C4,701EFC442AA1ED91_FE7D71594F2B1AFA_6041_DP,8.108297,00000000000000000000000000000000000000000110000000001010010000100100000000010001101100110011001111001100110101010000000011101100110101110110001010001011010111100111110,FCROQFHIZKAFNG-UHFFFAOYSA-N
CC2=C1N(C=CC(C1=CC(=C2)Br)=O)C[C@H]3[C@@H](CNC3)C4CCOCC4,068DB91C9B00C51A_C2F152F6C8A1F1A2_6034_UN,8.561878,00000000000000000000000000000000000000000000001000000000010000100100000000010000101101110011000011101100010111000100001011100101110010100110001101011011111111111111110,PFSCSGKSZGVECX-YJBOKZPZSA-N
C[N]1C=CC2=C1C(=NC=C2)NCC(N3CCOCC3)C4=CC(=CC=C4)F,B6F711B3A5A68487_875EA72A84D68661_6041_UN,7.3211846,00000000000000000000000000000000000000100010000000000000010000000100000000010101001101110001010110101100010101010000001011100100110011110110001001011001010111101111110,RTIJSLRSRAHVQA-UHFFFAOYSA-N
C1(=C(C=CC2=C1OCO2)F)NC3=CC=C(C=C3)C4CCCC4,7661DE44DBFBD99E_BAFEBF141E175F55_7022_UN,8.695014,00000000000000000000000000001000000000000010000000000000010000100000000010000000000100010001000111000100010101000100001010010100010001110100000011010011110011110111110,YHPVZLXFOLURCA-UHFFFAOYSA-N
NCC3(OC2=C1C=C(C=CC1=CC=N2)Br)CCCNC3,0D9356AD96E4FDEF_EE82E1D0AE5D87AB_6035_DP,7.795098,00000000000000000000000000000000000000000000001000000100000000000110000000000000101010110011100100101100110100111100011011000111110110100110001101010001110111100111110,NLANRZTYSMUIAT-UHFFFAOYSA-N
NCC3(OC2=C1C=C(C=CC1=CC=N2)Cl)CCCNC3,6D5660CC542B05B4_315F49E5A5358537_6035_DP,7.795081,00000000000000000000000000000000000000000000000000000100000000000110000000000000101010110011100100101101110100111100011011000111110110100110001101010001110111100111110,QUYQZOVAHQLURT-UHFFFAOYSA-N
FC1=CC(=C(C(=C1)F)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C)C#N,BB14960F523FCD78_09DAAF024E0B9837_6041_DP,8.151464,00000000000000000000000000000000000000000110000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001011010110101111010,FIQNUHSDUQUSGC-WCQYABFASA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC(CC)C3CCCOC3,AFCAD251A5990280_F7CD2C1B46967746_6041_UN,7.738538,00000000000000000000000000000000000000100000000000000000010000000100000000000100000000100011000001100100110011010010001011000100110011010110011011010111010111101111110,QKLREWZMIGMDOG-UHFFFAOYSA-N
C(C[C@]12C[C@H]1CCC2)=CC3=C([N](N=C3C)CC4=C(C=CC=C4Cl)Cl)C,D4B59ABB071B5982_629A1D643C9E5837_7019_UN,8.030272,00000000000000000000001000000000000000000000000000001000000000000110000000010000100100010000001010011001010110011000101011101100110000100100001011011110010110101111010,HBSGCIFIUOEWDX-IIBYNOLFSA-N
CC(=O)C1=C(C=C(C(=C1)NCC2C(CCN2)C3CC3)F)F,DA72B76A95609329_48E278118933B264_6041_DP,8.216839,00000000000000000000001000000000000000000010000000000010000000100000000000000001001100010011000010001000100100010000001001000000110101110110001010010011111110101111110,ZZKOTYNGMGWLNL-UHFFFAOYSA-N
OC(CF)C1=CC=C(C=C1)NC24CC(OC23CCNCC3)(C)C4,6874B9B6A7786D4A_2F53F23737172F31_6041_DP,8.4700985,00000000000100000000000000000000000000000010000000000000010000000010000000000000001100100011000111101000110010011001001011000000110111110111001001010001110111111111110,NLTYCYLTFYZGPH-UHFFFAOYSA-N
OC(CBr)C1=CC=C(C=C1)NC24CC(OC23CCNCC3)(C)C4,C6287C884E868173_588D91B0959CF85A_6041_DP,8.470086,00000000000100000000000000000000000000000000001000000000010000000010000000000000001100100011000111101000110010011001001011000000110111110111001001010001110111111111110,PXGBGNQHCAWMEJ-UHFFFAOYSA-N
N(C1=CC(=C(C=C1)C2=CC(=CC=C2)F)F)C([C@@H]3CC(CN3)C45CC(C4)C5)=O,6BA8290A61B7EE22_99D0B275E43DE2C2_6038_DP,7.5019016,00000000000100000000000000000000000000000010000000000010000000100010000000000001001100010011100110001000110100111000010001000100010101110100001011000011011010100111110,SANNULSERQZKAD-LWRDRHHTSA-N
FC1=C(C(=CC=C1)C2CC2)NC[C@@H]3CCCN(C)[C@H]3C4=CN=C[N]4C,66980AF307CF426D_02BC62E40BB59808_6041_UN,8.044497,00000000000000000000001000000000000000000010000000000000000000100100000000010101101101110011010010101000000110010001101011100100110001110110001011011111010110101111010,JHLSXAJCIUBSAV-MGPUTAFESA-N
FC1=C(C(=CC=C1)NC[C@@H]2COC[C@H]2N(C)C)C3CC3,36B38A3A8613348E_219F11FE4248479D_6041_UN,7.6419477,00000000000000000000001000000000000000000010000000000000010000100000000000100000101101110011010111001000000111010000100000100000110001110110001010011111010111101111110,HZHQHFKNCKJHCP-IUODEOHRSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NC2=CC4=C(C=C2)[N](CCN3CCOCC3)C=C4,BC452098F469702C_A89C3846DFF78D20_6041_UN,7.9258823,00000000000000000000100000000010000010000000000000000000010000000100000000110001010101101000010110101100010001011000001011100100110011010110011011011111010111101111110,USQKQXZRNDMDJU-UHFFFAOYSA-N
CC1=C(C=CC2=C1CCC2)NC4CCOC(C3=CN=C[N]3C)C4,A281C3BFD934570D_4C1D25511B95220A_6041_UN,7.107269,00000000000000000000000000000000000000000000000000000000010000100100000000010101000101000011010111100100110011010000101011100100110011010100001011011111110011101111110,SOZQNDNRBTXLSR-UHFFFAOYSA-N
CC1(C)[C@H]4CC[C@]1(C)[C@H](OCC3CC2(CCNCC2)O3)C4,E2D05D9C7513DDEE_8F4B85BE259BFBD4_6039_DP,7.380966,00000000100100000000000000000000000000000000000000000000010000000010000010100000001000100001000011101000110011011001101011000011110010000110010101010111110101111101110,MXUBBIVUARRJGX-UNHJMDIJSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)NCC4CC4(C)C5=CC=CS5)F,43D4D0CC3C8AF329_84A4E0A5A5CDB6B9_6041_UN,7.71889,00000000000000000000001000000000000010000010000000000000000000100110000000000000111100011011000010101100010110011001101011000100110001110100001011010111010110101111010,YPKMOFINFBCQMD-UHFFFAOYSA-N
CC2=C1N(C=CC1=CC(=C2)Br)CC3CCCN3CC4CCCN4,5041CED0AC0CCBF3_8292F9553807DFBD_6034_UN,7.8320684,00000000000000000000000000000000000000000000001000000000000000000100000000010001001101110011000010001100110110010000001011100100110000100110001000011011010110101111010,ZREOFMUAWJEEFE-UHFFFAOYSA-N
C[N]1N=C(N=C1NC2=CC(=C(C=C2)SC3CCCC3)F)C4CCOCC4,E64F3BCCC3038371_B3EAD576F0995181_6041_UN,7.8022304,00000000000000000000000001000000000000100010000000001000010100101100000000010101110100111000011010100000001101000000001011101100110011110110001011011011010011101111110,BJTFCLVXHMJTDX-UHFFFAOYSA-N
CC1=C(C=NC(=N1)C2CC2)C3=CC=C(C=C3)NC[C@H]4[C@@H](C4)C5=C(C=CC=C5F)F,9DE944F689879470_42993449115C7D95_6041_UN,7.792392,00000000000000000000001000000000000000100010000000000000000000100100000000000100101000010011000000101000000100000000000011000100010001110100001011010011010110101111010,JHGHUWGPDDVVJD-PKOBYXMFSA-N
N(CC1=CC2=C(C=C1)OCC2)[S](C3=CC4=C(C=C3)SC=C4)(=O)=O,C3ED30F03912EDF3_F7CAF1F1C890EBE0_6029_UN,8.468961,00000000000000000000000000000000110010000000000000010001011111001001010001000000011100001000001010001110011001001100011010001100101010001110000011111001110111110111110,LPQJZGCTCLDMQJ-UHFFFAOYSA-N
C(CCN1CCOCC1)=CC3=C(N(C)C2CCCC2)C=CC(=C3)F,3A09DF6EEAB282BD_9364FC85320CBFFB_7019_UN,8.0091915,00000000000000000000000000000000000000000010000000000000010000000000000000010000000001110000010110111000000111010000101011100000110011110110001011011010010111101111110,NVUNSYLBZSPYHB-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC3C4(CC3)CCOCC4,CC1EB756DF06FD8F_D1EEE52966402A69_6041_UN,6.8090982,00000000000100000000000000000000000000100000000000001000010000100110000000010101101101100011011010101000010011001000001011101100110011010110001011011111010111101111110,GIFFLSMVRVFODY-UHFFFAOYSA-N
FC1=CC2=C(C=C1)N(C3=C2CCNC3)CC5COC4=C(C=C(C=C4)[N](=O)=O)O5,EF1CC1FC026EAA0B_D9CBA6A18609DA09_6034_UN,8.509049,00000000000000000000000010000000000000000010000001000000110000010100001110010001001101110001001111101110110101010100001111101100111011110110101011111001110111110111110,QCJQFJQOMJJMDW-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NC4CC(C3=CC=N[N]3C)OCC4,281713356D39D34C_B8E9D86815F9EE77_6041_UN,7.232365,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111100100110111010000001011101100110011110100001011011011110011101111110,LLRGKHNGIDXAJZ-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C([N]1CC2(CCN2)C)C=CC(=C3)Cl)C4,93D5AA6504BD49C4_380A66617396DF40_6034_DP,7.7961373,00000000100100000000000000000000000000000000000000000000000000000110000000010001001101010011000010001101110110011011101011100100110101100110001011011101010110101111010,BZGMBYFIMCEACP-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C([N]1C[C@@]23CCCN[C@H]2CCCC3)C=CC(=C4)Br)C5,F8E2D380C48F926B_B1995C97DFCC2A63_6034_DP,7.5985885,00000000000000000000000000000000000000000000001000000000000000000110000000110000101101010011000010101100110100011001101011100100110000100110001011011101010110101111010,KSOUSSFHZFFTHL-LADGPHEKSA-N
CC1=C(C=C(C(=C1)NC2CC3(CCC2)CC3)Cl)C4CC4,885494C0DA05F70A_0BEE54AF05FFB8A0_7022_UN,7.6515875,00000000000000000000001000000000000000000000000000000000000000100010000000000000000000010011000000000001110110011000001000000000110001110000000011010011000010101111010,MPVSIDHNWZMQAX-UHFFFAOYSA-N
ClC1=C(C=CC=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]5[C@@H]4CNC[C@@H]4C5,634E70A638972A3E_847CFE21BC809EC3_6034_UN,8.676951,00000000000100000001000000000000000000100000000000000000000000100100000000010101001101110011000010001001110100010000001011100100110100100110001010011011010110100111010,PBBFJQNBTXQWNH-APYAYEPDSA-N
C[N]1N=CC=C1C2CCCC3=C(C4=C(N=C23)C=C(C=C4)Cl)C5COCC5,4244350C0B7FF2E9_9619B9D9464BFC62_2201_UN,8.267248,00000000000000000000000000000000000000000000000000001000010000100100000000010000100100110000011010100101010111000000001011101100110010100110001011011010010011101111110,DPKWBTXAAYXPIJ-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(C4NC3=CC=CC(=C3C4)F)=O,1CC29C1D521A8C13_5B4C8027C0121B42_6038_DP,7.2293377,00000000000000000000000000000000000000000010000000000010000000000000000000000001001100010011100110001100110100110000011001000000110100110100001011010001011110100111110,GMXSJZHENOJSLE-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)C=CO2)NCC3CCCC(CC)CC3,4511B5D21DA49DF0_588411E90D71C3FE_6041_UN,7.923155,00000000000000000001000000000000000000000010000000000000010000000000000000000000001100010011000110001100010110000010101000000100110001110100000010010011110110101111110,LZMJEPMJUASBAK-UHFFFAOYSA-N
C[N]2N=C1CCCCC1=C2NC3CC(OCC3)C4=CC=C(C=C4)F,9D1AB9B2BCC4E452_5A78C4F84E02BE7F_6041_UN,7.019312,00000000000000000000000000000000000000100010000000001000010000100100000000010101100100010011011011100100110111010000001011101100110011110100001011011011110011101111110,AASYFQFCRWZKCC-UHFFFAOYSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=NOC3=C2C=C(C=C3)Cl)C4,291ADC729BCF05F2_57CA7D7D4512D05D_6035_UN,7.665963,00000000000000000000000000000000000000000000000000000000010000000100000110100000000101110100111011001111010100100101011011101111110000100100001101011110110111111111110,GKYNBZIFEQABCO-FJXFWJLJSA-N
C1CC(CCN1)C3=CC2=C(C=CC=C2)N3CC4(CN(C)C)CCCC4,E7D850CB1F18C076_1E3A3595CD543556_6034_UN,7.2789116,00000000000000000000000000000000000000000000000000000000000000100110000000110000101101100001010010101100110010011001001011100100110000000110001011011111010110101111010,AFPOXUCXHYPNHH-UHFFFAOYSA-N
CC1=C(N(C(=N1)C2CNCCC2)CC(CC3=C(C=CC=C3)Br)C#N)C,73A8DDC03BE1CE80_CDFBD5384ECFA72C_6034_UN,8.167643,00000000000000000000000000000000000000100100001000000000000000100100000000010101101101110011000010101000100110010000101011100100110000100110001011011111010110101111010,NDRRUAWKFUPQOM-UHFFFAOYSA-N
CN(C1CCCNCC1)C2=NC=C(N=C2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,50944F355264C015_E12A804BC493622C_6041_DP,8.165106,00000000000000000001000000000000000000100010000000000000000000100100000000010101101101110011010010101000100110010001101011100100110101110110001001011111010010101111010,ONDSTFLCZILRPA-MDKRWRRSSA-N
C1(=C(C#N)C=N[N]1C2=CC=CC=C2)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F,10A5C6D12860FCA6_2B9487FBC6AA3D01_6041_DP,7.2614236,00000000000000000000000000000000000000100110000000001010000000100100000000010101101100110011001010101000100100010000001011101100110101110110001011011011010010100111010,LGVGPRDCBURPGP-YLJYHZDGSA-N
C2(=CC1=C(C=C(C=C1)Cl)O2)NCCC4CCN(C3CCN(C)CC3)CC4,BFCBF13A1BDF98C0_1E7D3BFE96577659_7022_UN,7.2905774,00000000000000000000000000000000000000000000000000000000010000100000000000010000101101110001110010101101110100110001111011100100110001110110001001011001110110101111110,WBGBPHQCASFTNB-UHFFFAOYSA-N
C2(=CC1=C(C=C(C=C1)F)O2)NCCC4CCN(C3CCN(C)CC3)CC4,F2A1128494EC01B7_0DD14A3C24210838_7022_UN,7.2905836,00000000000000000000000000000000000000000010000000000000010000100000000000010000101101110001110010101100110100110001111011100100110001110110001001011001110110101111110,HKBKVRQPRGCPGK-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)[S](C4=CC(=CC5=C4[NH]C=C5)Cl)(=O)=O,17A35FBD6DAC9BD2_3BE1B6B53671D14A_6029_UN,8.795382,00000000000000000001001000000000110000000000000000010101001111001101010001000000111100011011001011001111011100001000010001001100111100101100001001001001010110110111110,VDPGOXJZYLFGHJ-UHFFFAOYSA-N
CC1=C(C=NC(=C1)C2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,2577228477167157_35B08B978975F7D9_6041_UN,8.404166,00000000000000000000001000000000000000000010000000000000000000100100000000010001100101110011010010101000100110010001101011100100000001110100001011011111010010101111010,KZWQWWORWIMBPL-XLIONFOSSA-N
FC1=C(C=CC=C1)C2=CN(C(=N2)C3CCCN3)CCC4=CC[C@@H]5C(C)(C)[C@H]4C5,118488E627969A87_69F3091F706628C1_6034_UN,8.159774,00000000000100000000000000000000000000100010000000100000000000100110000000111101001101010011000010011000110110011000101011100100110000100110001011011111010110101111010,UHQMJHANLNXLOL-PZFGBKGUSA-N
FC1=C(C2=C(C=C1)C=CO2)NCCC3CCCN(C)C3,5B8841B12DD86566_4DBA270B2B9C4160_6041_UN,7.9157567,00000000000000000000000000000000000000000010000000000000010000000000000000010000001101110001010110101100110110010001101011100100110001110110001011011011110110101111110,ZTFNPXOMELRJCC-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3(CNC3)C)Cl,367EFA4550A27D2F_A68732590595D099_6034_DP,7.7522917,00000000100100000000000000000000000010000000000100000000000000000110000000010110111101111011000010001001001100001001000111100100100101110110001010001111010110101111010,RWNSUMPSAYHWFX-UHFFFAOYSA-N
NCCC(OC1=CC=C(C=C1)C2CNCCC2)C3=CC=C(C=C3)Br,F0FCED1AA385C7FE_FD6DB0DDA3A2DE0A_6035_UN,8.195315,00000000000000000000000000000000000000000000001000000000000000100000000000000000001010110011000001101000100100010100001001000111110110100110001101010001110101100111110,KLTLCZJKBJKXPB-UHFFFAOYSA-N
C2(=C1OC=CC1=CC=C2F)NC3=C[N](C)N=C3C4CCCCC4,741452BD69F61A8E_B8E5FD0CF8790B30_7022_UN,7.5668607,00000000000000000000000000000000000000000010000000001000010000100100000000010001100100010001011110000100010100000000001011101100110001110100001011011011100010101111110,VOFGCXJZLBQEFY-UHFFFAOYSA-N
CCN1C(CC2=C1C=C(C=C2)F)C3=NC=CN3C[C@H]4[C@@H](CNC4)C5=CC(=CC=C5)F,36C5972C44F545CF_C74676CE1DA8A703_6034_UN,7.8434987,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010001100010110010010000011100100110000110110001011001011010110101111010,ZLWHAERTQOKPKI-FJOSRBEHSA-N
C(C1COC2=C1C=CC=C2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,7E8149482CF164E1_586370B07F75C609_7019_UN,8.25875,00000000000000000000000000000000000000000010000000000000010000000000000000000000000101010000010010010100010111010100101000100100010001110100000011011010110011101111110,NIWMVTHGQAXIFP-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC4=CC3=C(CCC(C)(C)C3)S4,9B5C3347DEB32041_965D619E80A48D0E_6041_UN,8.006807,00000000000000000000000000000000000010100010000000000000000000000110000000100100011100011000000010101100010110001001101011000100110001110100011011010111010110101111010,XOLAVQLEIIUTAJ-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(=O)C3=NC4=C(C=C3)C=CC(=C4Br)F,753BA68DFE398D91_71EAA3223DDBC1E5_6038_UN,7.9101977,00000000000000000001000000000000000000000010001000000000010000000100000000000001001100010010100110101100010100100000011011000100110010100100001011010011111111110111110,XWBKFOROJFERCG-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CCOCC2)N3CCCCC3)F)CC4,16D2E6333F06F66B_FF8C7E7AEBAFC5E5_6041_UN,7.7935166,00000000000000000001000000000000000000000010000000000000010000100010000000010001101001110011010001101000000111011001101011100000110011110110001011011011010111101111110,XLWKYYZJILOWFN-UHFFFAOYSA-N
CC(C)(C#N)C1=C(C=C(C=C1)NCC2CC3(CN2)CCC3)F,DB68EFECC18E0D91_F44012768E10127C_6041_DP,7.7849865,00000000000100000000000000000000000000000110000000000010000000000010000000100001001100010011000010001000110100011000001001000000110101110110001010010111010110101111010,IFLHLKRJOJZXSQ-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(=O)C3=NC4=C(C=C3)C=CC(=C4F)Br,D14C6D797279D53F_A60A383974B924FE_6038_UN,7.9101915,00000000000000000001000000000000000000000010001000000000010000000100000000000001001100010010100110101100010100100000011011000100110010100100001011010011111111110111110,SGSLVOFRHNMVOL-UHFFFAOYSA-N
CC2=C(C(=C1C=CC=C(C1=N2)F)NC[C@@H]3CN[C@@H]4CCCC[C@H]34)C,6E728BA017115A30_9248560134402D3A_6041_DP,8.224907,00000000000000000000000000000000000000000010000000000100000000000100000000000000101100010011000010101100110110010000001011000100110101110110001011010111010110101111010,VWACOLGKNKZLMQ-HDMKZQKVSA-N
C[N]1C=C(C(=N1)C2CC2)NC3=CC(=CC(=C3)F)N4C[C@H](C)O[C@@H](C4)C,BE3E2D03FEE59E19_72BF6A7A5B0E9E8C_6041_UN,8.014179,00000000000000000000001000000000000000000010000000001000010000100100000000010001100101110001011110101000000110000001000011101100100011110110011011011111110011101111110,KTTBYUHLNXHOOP-BETUJISGSA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=N3)CCC4CCCN4C,942A3D6CF5AC9A6E_2171CA7568C6FDE9_6034_UN,7.531473,00000000000000000000000000000000000000100000000000000000000000100100000000010100101101100011010010101100110010010001101011100100110000000110001001011011010110101111010,INQPMHOXNVDIPU-UHFFFAOYSA-N
CN1CCOCC1COCC2CC3(CO2)CCOCC3,763CAF57A53706DA_79E432F3BF7DCBDA_6039_UN,6.9333515,00000000000000000000000000000000000000000000000000000000010000000010000010010000000101100100010110101000010001011001101011100010110010000110100001111010110111111101110,SQZWCISNJUSOGD-UHFFFAOYSA-N
CC1=C(C(=CC=C1)F)NCC2CCCN2CC3CCCCC3,8280ACA702536FD4_B4C4097F66D40492_6041_UN,8.078348,00000000000000000000000000000000000000000010000000000000000000000000000000010001001101110011000010001000000110010000001001100000110001110110001011011011010110101111010,QOJNSDWBWMDFEK-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CCCCC2CC=C)Cl)C3CC3,CC34E8BD4CD1BD45_266130E34E0B5C2F_7022_UN,7.7309256,00000000000000000000001000000000001000000000000000000000000000100000000000000000000000010011000000010001100110010000001000000000110001110000000011010011000110101111010,RJEBNMIBHSPDLA-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NC[C@@H]3CCO[C@H]3C4=CC=N[N]4C,F5610ED88764B811_3F8178AC19030DBC_6041_UN,7.736321,00000000000000000000001000000000000000000010000000001000010000100100000000010000101100010011011111001000000101000000001011101100110011110110001010011011110111101111110,YVZTYIQSOHYKMW-SCLBCKFNSA-N
FC1=C(C2=C(C=C1)OCO2)NCC3=C(C=N[N]3C)C4CCC4,7249FE09CB96AF0B_ACCA450B21D558E1_6041_UN,8.355006,00000000000100000000000000001000000000000010000000001000010000100100000010010001101100010001011111001100010101010100101011111100100001110110001010011011110111111111110,UWWSEJAZMFESTH-UHFFFAOYSA-N
CC1=CC(=C(S1)[Si](C)(C)C)NCC3=CC=C(CN2CCNCC2)C=C3,931A21B87DD823E1_186E5683A351D4D7_6041_DP,8.052852,00000000000000000000100000000010000010000000000000000000000000000000000000110001011101101001010010101000100000011000001011100100110101010110011011011111010110101111010,COIUXVREBBQFPZ-UHFFFAOYSA-N
C[Si](C)(C)CCOC[N]1C=CC2=C1N=CC=C2C4=C3OCCCC3=CC=C4,922E0B7022563F64_23F334538D50C87F_6004_UN,8.410644,00000000000000000000100000001010000000100000000000000000010000100100000000110100000101100000010011101100010001101101111011100110110010000110011011011100110111111111110,QRADAIVIILHPLI-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CN(C2=O)C[C@H]4[C@H]3CNC[C@H]3C4,8135142F52980820_56096CCBE55569C9_6034_UN,8.709413,00000000000100000001000000000000000000000010000000000000000000000100000000010000001101110011100010101100010100100100010011100101110000100110001111001011011110100111110,SBZYSELKWGDJSG-XUJVJEKNSA-N
FC2=C1CCCC1=C(C=C2)NCC3CCN(C(CC)C)CC3,2EF4CB316EF20D4C_3ABE517E33E0ADBA_6041_UN,7.426836,00000000000000000000000000000000000000000010000000000000000000000000000000010000001001110011000010101100010110010011101001100000110001110110001011011101010110101111010,FXYBCYKUVKANHZ-UHFFFAOYSA-N
CSCC3(C=CC1=CC=CC2=C1NCC2)CCOCC3,441DA5EB416E17C7_BFFAA2531B71E3AC_7019_DP,7.6646967,00000000000000000000000000000000000000000000000000000000010000000010000000000000001100101011010010111100110011011001001011000000110010010110000011010001010111101111110,YSBHVPDCEHQUNA-UHFFFAOYSA-N
C1CC(CNC1)C2=CN(C3=C2C=CC=N3)CC4(N)CC5=C(CC4)C=C(C=C5)Br,71E3C9FCDE93BB04_541625DC44EB18B1_6034_UN,7.885968,00000000000000000000000000000000000000100000001000000000000000100110000000010101001111110011000010101100110100011000001011100100110101100110001011011001010110100111010,DACLSIXZNGPPKZ-UHFFFAOYSA-N
N3CCCC(C=CC2=CC=C(C1=CC=CC(=C1F)F)O2)(C3)C#N,0112ED09E45542C6_7F29AE8F8DC9ECB5_7019_DP,8.325205,00000000000000000000000000000000000000000110000000000000010000100010000000000000101100110011000010111000100100011000001011000100110000100110001011010011110000100111110,KZRZXSHDYLRBAO-UHFFFAOYSA-N
N3CCCC(C=CC2=CC=C(C1=CC=CC(=C1Cl)Cl)O2)(C3)C#N,57C8B2464998E441_A8DC99EADC3F4A9D_7019_DP,8.325186,00000000000000000000000000000000000000000100000000000000010000100010000000000000101100110011000010111001100100011000001011000100110000100110001011010011110000100111110,ASETULGBJJLJAT-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC3CC4CCC(C3)O4,0A56FF06986DEA09_4541F840A889E634_6041_UN,7.558512,00000000000000000001000000000000000000100010000000001000010000100100000000010101100100010001011011100000110100010000001011101100110011110100001011011011100011101111110,URLNMLGUUWUBNZ-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)[S](C4=C[NH]C5=CC=CC(=C45)F)(=O)=O,CDAB92CDD971E9D9_ED4C5CE7F5D42B4D_6029_UN,8.614613,00000000000000000001001000000000110000000010000000010101001111001101010001000000111100011011001011001110011100001000010001001100111100101100001001001001010110110111110,HXIQEIZGHPOGGO-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2(CCCC2)N3CCSCC3)F,3526B07568D05223_AFF25913E7422561_7022_UN,8.229915,00000000000000000000000000000000000010000010000000000000000000100010000000110001001001111011010010101000000100011001001011100000110001110110001011011111010110101111010,LAXWMDZWTUUTOF-UHFFFAOYSA-N
C(C2CCCC1(CC1)C2)=CC3=C[N](N=C3C)C4=CC=C(C=C4)Cl,A5C3675E4B038788_2EEE9FB445B05DFA_7019_UN,7.942384,00000000000000000000001000000000000000000000000000001000000000100110000000010000100100010000001010010001010100001000001011101100110001110100001011011010000010101111010,AHJREPWXVRUEMD-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC#CC3CCCCO3,8FB57FD5D16CF16D_17F1FC77CFCD8FFC_6041_UN,7.110862,00000000000000000100000000000000000000100010000000000000010000000100000000000100001000010000000000101100010111000000001011000100110011110110001011010111110111101111110,YLODZVPCFJRXKP-UHFFFAOYSA-N
C(C2CCCC1(CC1)C2)=CC3=C[N](N=C3C)C4=CC=C(C=C4)F,DA4C76C434231E98_0C11262A88B6B9FA_7019_UN,7.9423785,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011010000010101111010,PCBFKUBAQAYZPV-UHFFFAOYSA-N
CN(C1CCNC1)C2=NC(=CN=C2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,E285D79E49417A05_312681FACCD82CE0_6041_DP,8.163896,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110011010010101000100110010000101011100100010101110110001011011011010110101111010,CIGKARNTVAVSOH-SMEJFCCLSA-N
CN(CC1CCNC1)CC2=NC=C(N=C2)NC3CCCC4=C3C=C(C)[N]4C,B2D2FDD255ECEFC3_590F66EDCB262EEE_6041_DP,8.019701,00000000000000000000000000000000000000100000000000000000000000000100000000010101101101100011010010101100110010010001101011100100110101010110011011011111010110101111010,NKKABIVRVWBZFN-UHFFFAOYSA-N
NCC3(OC1=C2C(=CC=C1)CNCC2)CCC4=C3C=CC(=C4)F,903D9A6569D3F7B0_CCC471122B73025C_6035_UN,7.5015144,00000000000000000000000000000000000000000010000000000000000000000010000000000000001010110011000110101100110100011100001001000111110110100110001111010001110101100111110,PZQLAFWLIZKWMF-UHFFFAOYSA-N
N1CCC4(C1)CCN(CC2=NC=C(N=C2)NCC(N(C)C)C3=C(C=CC=C3F)F)CC4,9EFDD6D8DFE81B1D_698D59DF94D0E8A0_6041_DP,8.355473,00000000000000000000000000000000000000100010000000000000000000000110000000110101101101110011010010101000110100011000101011100100110101110110001011011111010110101111010,AAEXIJSXVXHEPJ-UHFFFAOYSA-N
FC1=C(C(=CC=C1)F)NC[C@@H]2CCCN(C)[C@H]2C3=C[N](N=C3)C,D3F6F7F032E9EE0C_9548636242801022_6041_UN,8.386852,00000000000000000000000000000000000000000010000000001000000000100100000000010000101101110011011010101000000110010001101011101100110001110110001011011111010110101111010,NFGYUZKWCOZMDE-YVEFUNNKSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NCC34CCCNC3CCC4,782F624385CE4A68_86F8F73647528EDA_6041_DP,7.5429797,00000000000000000000000000000000000000100000000000001100000000100110000000010101101100000011011010101100110010011000001011101100110101010110001011011111010110101111010,REFLZSUPMGSNCK-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2CCC(C(C)C)CC2CC3=CC=C(C=C3)Cl)Cl)C4CC4,58C8ADBE24F889D5_B126125A0B2C29C0_7022_UN,8.217704,00000000000000000000001000000000000000000000000000000000000000100000000000100000000000010010000000000001100110010000101000000100110001110000010011010111000110101111010,ATAOWIUPDFOMIQ-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NCC3CCC=CCCC3,DB487B260B48F3B8_4CE7D096617A5B95_6041_UN,8.248283,00000000000000000000000000000000000000000010000000000000000000000100000000000001001000010011000000111100010110000000001001000100110001110100001011010011010110101111010,IYPRQFFDRYABNO-UHFFFAOYSA-N
S(C1=CC2=C(C=C1)CCCC2)C(C4=CC3=C(C=C[N]3C)C=C4)=O,630F7C4C55D7BBD7_E449F0B1F8AD14FA_6038_UN,9.165575,00000000000000000000000000000000000000000000000000000000000100001100000000010000010101001000010010000100010000000000001001100100110000000100000011011000001010101111110,JBCDSOXYMJWMFG-UHFFFAOYSA-N
N(CC1CC2CCC(C1)O2)C(=O)C3CCCCN3CC4=CC=C(C=C4)F,02CC5A06F555032E_FD14396B8E9EF3F6_6038_UN,7.616967,00000000000000000001000000000000000000000010000000000000010000000000000000010001001101110011100110101000010100110000011011100000110010100110001001011011111111110111110,GUHYYSJWPOYRAR-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)C#N,DFE0A77CA7EFAE1B_4C297F27448BDD9A_6041_DP,7.9831257,00000000000000000000000000000000000000000110000000000010000000100000000000000001101000110011000000101000100100010000001001000100110101110110001011010011010010101111010,MXPUTTZIVISHLY-AUUYWEPGSA-N
C2(=C1OC=CC1=CC=C2F)C4=CC3=C(CCCC3)NC4=O,A67CD3F38BCD2141_17F7FED9E06FD5C4_6008_UN,8.797009,00000000000000000000000000000000000000000010000000000000010000100100000000000000000100010011100010100100110100110100011011000101110000100100000111010011101010010111110,PDAZPAXHRRVNCV-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3CC(C3)C4CC4,5DFED98F364DB7CF_CA8ED33F0D7E1151_6041_UN,7.7412252,00000000000100000000001000000000000000100000000000000000000000100100000000000100001000000010000000101100010010000000000001000100110001010100011011010111010110101111010,LPPMGPVHGMBUSN-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2C3(CCC2)CCCCC3)F,186D7EF75B8548D7_022A0986CD34913A_7022_UN,7.7853594,00000000000000000000000000000000000000000010000000000000000000000010000000100000000001110011010010001000110100011001001000100000110001110000001011011111010110101111010,WLDNEZBUKVHDSN-UHFFFAOYSA-N
CC1=C(C=N[N]1C)C2=C4C(=CC(=C2)C=CC3CCC(F)(F)CC3)OCO4,219F5918EDABE972_6F65D2167F6A374D_7019_UN,8.954602,00000000000000000000000000001000000000000010000000001000010000100100000010010000100100010000011010010100010101001100001011111100110000100100001011011110110011111111110,IZQMLYHDEBYJIM-UHFFFAOYSA-N
CN(C)[C@@H]1CCC[C@@H]1COCCCN2CCOCCC2,41DAD6B15FD6D992_3D6A8395FC72BE37_6039_UN,6.979655,00000000000000000001000000000000000000000000000000000000010000000000000000110000000001100000010111001000000011010000101011100010110011000110001000011110010111111100110,FGHYETFWUAXOOT-HZPDHXFCSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC[C@@]34[C@@H](C3)CCC4,42EA3BDB61C8EEAC_DE644FB3E9177630_6041_UN,7.3867006,00000000000000000000001000000000000000100010000000000000000000000110000000000100001000010011000010101100010110001000001001000100110001110100001011010111010110101111010,LCJZZRGVKHCQQO-ACJLOTCBSA-N
CN4CCC1=C(C3=C(N1CC2CNCCC2C)C=CC(=C3)Cl)C4,2F13CFC37B705B11_896015B1E1885E2E_6034_UN,7.7910304,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101110011010010101101110100010001101011100100110000100110001011011111010110101111010,IHHOZHTXZQSRKF-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)NCC4NC3COCC3C4,F2E2D2BFE344686E_A59F3064016BD57A_7022_DP,7.6348453,00000000000000000000001000000000000000000110000000000010010000100010000000000001001100110011000111001100110101011000000011000000110101110110001010010011010111100111110,LQTICQXNBHZKCS-UHFFFAOYSA-N
FC1(F)CC15CCC(C=CC2=C[N](N=C2C3=CC=C(C)C=C3)C4=CC=C(C=C4)F)CC5,968E6CD4A05FD7B4_EB2959E3ECB76FA0_7019_UN,8.189929,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000001010010000010100001000001011101100110001110100001011011010000010101111010,KEMDZDOTXIQUHI-UHFFFAOYSA-N
CC3=NC1=C(C=CC2=C1CCCN2)N3C[C@]45[C@](C)(C4)CNC5,EFB0C1BD5331C3E5_B8E3C7C0D40BC81C_6034_UN,6.9859643,00000000000000000000001000000000000000100000000000000000000000000110000000010101101101100011000010101100110010011001101011100100110100010110001011011111010110101111010,AALBEHIRTJSPBO-MSOLQXFVSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC4=CC=C(C3CCCN3)C=C4,2113943AD6F79A68_5E2DE37B7116274D_6035_DP,8.364486,00000000000000000000001000000000000000000010000000000000000000100010000000000000001110010011000011001000100101011100001001000111010100100110001101010011110111100111110,VPSPYZXNMDSEJK-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCCC3CCCC3(C)C,012695CA364ACE65_2333CBAFC41F15F4_6041_UN,7.9023867,00000000000000000000000000000000000000100010000000000000000000000110000000100100001000010001000010101100110110011001101001000100110001110100011011010111010110101111010,SZNVLZUDFHJNKI-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC3CCCC(C)CC3,AF8F40A5F8B09D62_ABE706C35AC6E2A8_6041_UN,8.094379,00000000000000000001000000000000000000000010000000000000000000000100000000000000101000010011000000101100010110000001101001000100110001110100001011010111010110101111010,HZOBHRDEBULLON-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC(C)CC3CCOCC3,63FDE38F104D58EC_4C50325C0A7814B4_6041_UN,8.144211,00000000000000000000000000000000000000000010000000001000010000000100000000010000100100110001011010100100110111010001001011101100110011110110001001011101010111101111110,SBXOPSGFVLTVKW-UHFFFAOYSA-N
ClC1=CC3=C(C=C1)C(=O)C2=C(CCCC2)N3CC4CNCCO4,285B564C5CEB0DC9_1D0A28C97DEF364B_6034_UN,9.043625,00000000000000000000000000000000000000000000000000000000010000000100000000010000101001110011000101101101110101010100001011100101110010100110001111011001111111110111110,ADQATDPPGXQUFX-UHFFFAOYSA-N
N(CC1CN2CCC1CC2)C(=O)C3(CC3)C4=CC(=C(C=C4)Br)Cl,6A554A0ECEB1A158_D0E8E0D46F5FC371_6038_UN,7.1375375,00000000000000000000001000000000000000000000001000000000000000100010000000000000101001110011100000101001010100111000011001100000110000100110001011011011011110100111110,ISVKPUXZZCUTDX-UHFFFAOYSA-N
N(CC1CN2CCC1CC2)C(=O)C3(CC3)C4=CC(=C(C=C4)F)Cl,F40A1BA752624EDF_54DF14E350B4DE92_6038_UN,7.137534,00000000000000000000001000000000000000000010000000000000000000100010000000000000101001110011100000101001010100111000011001100000110000100110001011011011011110100111110,WGLJQPYXCRUNES-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=C1)NCC2CCNC3(C2)CCC3,C9DEFC8551A0782C_DB481199CC012DD2_6041_DP,7.3276343,00000000000100000000100000000010000000000000000000000000000000000010000000100000001000100011010000101000110000011000001001000000110101010110011011011111010110101111010,ZVBJVAKJGQCSQJ-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NCC3CCCN(C)C3C4=CC=CS4,65452C25DB8AC6A3_2E0082C61B8A0D37_6041_UN,8.129998,00000000000000000000000000000000000010100010000000001000000000100100000000010101111101111011011010101000000110010001101011101100110001110110001011011111010110101111010,PGODVWBWINQDGJ-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NCCC3COC(C)(C3)C,09028494DC788B04_6793E06D63890BC9_7022_UN,7.1702995,00000000000000000000001000000000000000000010000000000000010000100010000000100000001100010001000010001000100111011001101000000000010011110110000010010111110111101111110,HLNGICVVMXMAHV-UHFFFAOYSA-N
CC2=C1CCCC1=CC(=C2)NC3=CC=C(CO[Si](C)(C)C)C=C3,6C7F2CF49FC6795F_C0AFF98574EA6654_6041_UN,7.6379366,00000000000000000000100000000010000000000000000000000000000000000000000000100000000000100001010010000110010011001000101000001110010001010000010011011101010111101111110,IMDFKTPLKFCRSG-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NCCC3COC(C)(C3)C,ECED589B4251F4E7_935312602BCAAA76_7022_UN,7.1702747,00000000000000000000001000000000000000000000000000000000010000100010000000100000001100010001000010001001100111011001101000000000010011110110000010010111110111101111110,KOXMUQRSRNPKFJ-UHFFFAOYSA-N
ClC1=CC2=C(N=C1)N(C(=O)C=C2)CC3(N)CC4=C(C3)C=CC=C4,04A5B983554DA27A_B1ACCDA9FC880B0B_6034_UN,8.341705,00000000000000000000000000000000000000100000000000000000000000000110000000010101000011010000100011101101110100111100010011100101010001100100001111001011011110100111110,RHVBWLCQLMGDIP-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CN(C2=C1C=CC=C2)CC4CC3(CCN3)C4,6A0D6EF64F904400_552B7CC2997648F4_6034_UN,7.683693,00000000100100000100100000000010000000000000000000000000000000000110000000110000001101100011010010001100110000011000001011100100110000000110011000011101010110101111010,VYWWPCZYDVBQMH-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC(CC)C2COCCO2)F)CC3,7CCC88607A199B3F_8654BF2EE90DE64B_6041_UN,7.2010174,00000000000000000001000000000000000000000010000000000000010000000000000010010001100001110011010101101000100111010011101011100000110011110110001011011111110111111111110,GWVDWJFHZQBTRM-UHFFFAOYSA-N
NOCC1=C(C=C(C=C1)F)NCC3CC[N]2C=CN=C2C3,3F1F3594A9A0330A_DC232406A221023C_6041_UN,7.659387,00000000000000000000000010000000000000100010000000000000000000000100010100000101001111010011001011101110110101010000001011101110110101110110001011011011010111100111110,NOMUYNVPMAQSFA-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=N3)NCC45CC(CNC4)(F)C5,5BC0455344639322_90C45513811DB4CA_6041_DP,7.68719,00000000000100000001000001000000000000000010000000000100000000000110000000000100101101110011010010101000111100011000101011100000110101110110001001011001010110101111010,GSVDXXXOVJTCQX-LQBVPKAGSA-N
O[C@@H](CCl)C1=CC=C(C=C1)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,3F77275305BBBDF2_1065B517B9B318F6_6041_DP,8.7912,00000000000000000000000000000000000000000000000000000100000000100100000000010101101101100011010010001001100010000000000011100100110111110111001010001011110111101111110,QESRPZPZAMJGAQ-LXZKKBNFSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2(C)CCCCCC2)F)CC3,878A2DD622692FC6_2BE9F669D90119AA_6041_UN,7.48598,00000000000000000001000000000000000000000010000000000000000000000010000000010001101001110011010000001000000110011001101011100000110001110110001010011111010110101111010,WRLXEPFKHHXJHF-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2CC2)NCC4=C(CN(C)C3CCCCC3)C=CC=C4,8A51917C00791091_7A23576AFD219508_6041_UN,8.311108,00000000000000000000001000000000000000000010000000000000000000100000000000000000001001110001010000001000000110010001101000100100110001110010001011011011010110101111010,VJDWTEROPIKEBN-UHFFFAOYSA-N
FC2=C1CCCC1=C(C=C2)NC(C3=NC=C[N]3CC)C4CCOCC4,F07A7028050A5465_BD60737B9D00D32D_6041_UN,7.4881425,00000000000000000000000000000000000000100010000000000000010000000100000000010101000101110011000010101100010101000010001011100100110011110110001011011011010111101111110,RBRVUCWIJMAQLN-UHFFFAOYSA-N
CCCCC4(OCC3CC1(CC2(C1)OCCO2)CO3)CC4,81CCB5F831F35B97_DBA577AC011A3663_6039_UN,7.1686296,00000000000100000000001000000000000000000000000000000000010000000010000010000000000100000000000010000000010001001011101010010011110010000110100100110000110101011000110,YDBMPZNESMTBEP-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2CCCC3CCCN23)F)CC4,F7262077769BF033_A1475A48C1308F28_6041_UN,7.5257974,00000000000000000001000000000000000000000010000000000000000000000000000000010001101101110011010010101100010110010001101011100000110001110110001011011011010110101111010,FPFXNOGOZYMQBG-UHFFFAOYSA-N
N(CCN1CC2CCC(C1)O2)C([C@@H]3C[C@]3(C)C4=C(C=CC=C4)F)=O,630F4C0477FE9E92_93E9C6A746F8E7F1_6038_UN,7.809671,00000000000000000001001000000000000000000010000000000000010000100010000000010001001101110011100110101000110100111001111011100000110010100110001011011011111111111111110,UPSRVDMNEHNEIY-XPYAJCMZSA-N
CC1=C(C2=C([NH]1)C=CC=C2NC(CC)C3CCCOC3)C,02F70CD0AF7820A3_AADAFE4D95E36B86_6041_UN,7.8902974,00000000000000000000000000000000000000000000000000000100010000000100000000000000100100100011000011100100110011010010001011000100110111010110011011010111010111101111110,DNLYQSHUFWBOHD-UHFFFAOYSA-N
CC4(C)CN(CCC2CCC3=C(C)C1=C(C(=CC=C1)F)N=C23)CCS4,248F53C624C1D643_C6F7752CD31EBED0_2201_UN,8.168786,00000000000000000000000000000000000010000010000000000000000000000110000000110000010001111000000010101100010110011001101011100100110000100110011011011100010110101111010,UWQCYDRZQXJGJV-UHFFFAOYSA-N
C(C1=NOC2=C1COCC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,C59D4942E2C1CEF7_0F04EC506F4CFAA3_7019_UN,7.9619126,00000000000000000000000000000000000000000010000000000000010000000100000100000000000101110100011011110110010111010000101011101100110011110110001011011010110011111111110,DWZZGYXLYIYBDX-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C3CCC2O3)NCC4=N[N](C(=C4)C)C,567C69CC3FC62B20_5457C87F2F0DA7BE_6041_UN,7.2239356,00000000000000000000000000000000000000000000000000001000010000000100000000010001101100000000011010001100010010010000001011101100000011010100001011011111110111101111110,UKABKOYMNCKBKF-UHFFFAOYSA-N
C[N]1C=NC2=C1C=C(C=C2)NCC3(CCNCC3)C4=C(C=NC=C4)F,6499B3B5CAE0B4E5_07A070EB04944563_6041_DP,7.6629534,00000000000000000000000000000000000000000010000000000000000000100110000000010101101101110011010010101100110100011000001011100100110101110110001011011011010110101111010,MFIMOHNCXOTZJS-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CC=C1)NCC3=C2CCCCC2=CC=N3,0021052881F84F78_6C7F0C69B91C2F03_6041_UN,7.888553,00000000000000000100100000000010000000000000000000000000000000000100000000100001001000100001010000101100010000011000001001000100110001010100011011011101010110101111010,AVXKORDBHFZCLH-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCCOC3CCSCC3,53C37A37846F1E4D_A8386BD26B74F077_6041_UN,7.8037877,00000000000000000000000000000000000010100000000000000000000000000100000000000100001000101000000100101100110011010000001011000111110011010110011111010111110111101111110,JPJRZKFKXQFIGI-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CCCC3=C(C=CC=C3F)F,7C20D7CACEBA6A99_003FDC49522A9EA8_6038_UN,7.639134,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100010001000110100110000011000000000110010100000000011010011011110100111110,RIHQPMYDMMULJT-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NCC3CCSC(C)C3)C,4BF63032B20CE0B8_8FAC104FDD9D6C88_6041_UN,7.80367,00000000000000000000000000000000000010000010000000000000000000000100000000000000111000011011000000101100010110000001101011000100110001110110011011010111010110101111010,FWLGXHQOFPEUJA-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CC(=N2)NCC3CCCCN(C)C3,436A660586A9ACC6_2BEBEC6B423D3ACE_6041_UN,7.989069,00000000000000000001000000000000000000100010000000000000000000000100000000010100101001110011010000101100010110010001101011100100110001110110001001011001010110101111010,SQYUJMJMHRRFIG-UHFFFAOYSA-N
N4CC5(C=CC1=C[N](N=C1C2=CC=CC(=C2)C)C3=CC=C(C=C3)F)CC4C5,7504B5086E7D20F6_F8C6E847E74F014A_7019_DP,7.8052583,00000000000100000000000000000000000000000010000000001000000000100110000000010000101100010011001010011000110100011000000011101100110001110100001011001011010010101111010,ATFDOZBXUOGAFY-UHFFFAOYSA-N
CN(C)C3CCN(CC1=CC=C(C=C1)NCC2(CCOCC2)F)C3,59887E1446495FCB_2AA0BFB49162718F_6041_UN,7.7676945,00000000000000000000000000000000000000000010000000000000010000000010000000110001101101110011010010101000000111011000101011100000110011110110001001011101010111101111110,IYPULXQVYGRZGW-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=CN=C3)NCC5=NC4=C(C=CC(=C4)F)O5,DC373D2293E0122E_00596478B76E651B_6041_DP,8.209928,00000000000000000001000000000000000000100010000000000000010000000100000000000101101101010011110110101100110100110000111011100100110111110100001001011001110110101111110,KMUBKHBXEIOYTI-QDMKHBRRSA-N
FC2=C(C=C1C(=CN(C1=C2)C[C@@H]3C[C@H]3C#N)C4=CCNCC4)F,9B069B0E18E9722A_5B28312BF94DB6BF_6034_UN,7.870535,00000000000000000000001000000000000000000110000000100000000000100100000000011000001101110001000010111100110100010000001011100100110000100110001011011011010110100111010,JRPXFBMEWORXNV-STQMWFEESA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC[C@H]4[C@@H](OCC4)C5=CC=C(C=C5)F,7B90DFDDE59D13D1_A2FF81F370FBB844_6041_DP,7.818272,00000000000000000001000001000000000000100010000000000000010000100100000000000100101101010011010011101000111101010000101011100100110111110110001001011011110111101111110,YDUVUDSYHOQAOG-UWQHEJLZSA-N
C1(=CSC(=C1)C2OCCO2)NCC(N3CCN(C)CC3)C4=CC=C(C=C4)F,E3C3F336F8D9F00B_57200398E314444B_6041_UN,7.4672537,00000000000000000000000000000000000010000010000000000000010000100000000010010001011101111001010010101000000101010001101011110100110011110110001001011001010111111111110,KYRUVHITXIWIFQ-UHFFFAOYSA-N
N(CC1C2CCC(C1)C2)C(=O)CSC3=CC=C(C=C3)F,5C7CB8FBBDAA9E3D_DB43BFD206143013_6038_UN,7.850966,00000000000000000000000000000000000000000010000000000000000100001000000000000000011000011011100010001000110100110000011000000000110010100010000001010001011110100111110,FWTHDAIOXSTUOG-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2OCCO2)NCC4=CC3=C(CN(C)C3)C=C4,1FE2BF42755FBBB2_BD1866A0865C0CF9_6041_UN,7.423684,00000000000000000000000000000000000000000010000000000000010000100000000010010000001101110000010010001100010101000001001011110100110011110110001011011011010111111111110,BSUNJIXUARMMAI-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=C[NH]2)NCC3CCCCN3C4CC4,976969B39CFB7C08_2DE78B837FB4A953_6041_UN,7.8170156,00000000000000000000001000000000000000000000000000000010000000100100000000010001001101000011000010101100010010010000001011100100110101010110001011011011010110101111010,CKLSVHHFZUWCRE-UHFFFAOYSA-N
O([C@H]1C[C@H](NCC1)C2=CC=CC=C2)C3=CC(=C(C=C3Cl)C#N)C,75695450F29023B0_9A9A5A169AF168E8_6035_UN,7.697482,00000000000000000000000000000000000000000100000000000000000000100000000000000000001000010001000001101001100100010100001001000111110010100100001111010011110011101111110,CNGPQEVBRSLWQO-AEFFLSMTSA-N
CC5(C)CCC1=C(C4=C([N]1CC2(CC23CCNCC3)C#N)C=CC(=C4)Br)C5,C26CC10EA844D74E_EA9318C5DB146415_6034_DP,7.9406033,00000000000000000000001000000000000000000100001000000000000000000110000000110000101101110001000010101100110100011001101011100100110000100110001011011101010110101111010,ROVFVDHOACCHOU-UHFFFAOYSA-N
C2(=C1C=CC=CC1=NC=C2C#N)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F,A64B653797A33A03_7C95C202A2E42279_6041_DP,7.0378594,00000000000000000000000000000000000000000110000000000010000000100100000000000001101000110011000000101100110100010000001011000100110101110110001011010011010010100111010,FPPSXAIFWVROLN-FOIQADDNSA-N
CC1=CN(C2=C1C=CC(=C2)F)CC3CCCN3CC4CCCN4,0BD3401D3646AED5_53C8C326E411D01A_6034_UN,8.107276,00000000000000000000000000000000000000000010000000000000000000000100000000010001001101110011000010001100110110010000001011100100110000100110001000011011010110101111010,DJCZDEZLGBXOAZ-UHFFFAOYSA-N
CC1=CN(C2=C1C=CC(=C2)Cl)CC3CCCN3CC4CCCN4,0C03978B1012BD5A_DF8A9C9CA1775B49_6034_UN,8.107266,00000000000000000000000000000000000000000000000000000000000000000100000000010001001101110011000010001101110110010000001011100100110000100110001000011011010110101111010,XOMBZTWXOQCIRK-UHFFFAOYSA-N
C1(=C(C2=C(C=C1)C=CC=C2)F)NCC3CCCN(C)C3C4=CC=CS4,7A86247B16770F00_9293A9F056F36E28_7022_UN,8.339811,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101100010110010001101011100100110001110110001011011011010110101111010,ILTRJQWNIPDLQB-UHFFFAOYSA-N
C1CC(CNC1)C2=CN(C=N2)CC(C)(N)C3=CC(=CC=C3)Br,C5FD874D6EB2D9BF_5883C67B049CFFCD_6034_UN,7.927438,00000000000000000000000000000000000000000000001000000000000000100110000000010101101111110011000010101000100100011001001011100100110100100110001001011001010110101111010,BUKNUCJCYVVHIF-UHFFFAOYSA-N
CC1=C(C=CC=C1Br)NCC2CCCN2CC3CCCCC3,139FF1C2A4BB8ACE_5E1652A1E43D23EA_7022_UN,7.805541,00000000000000000000000000000000000000000000001000000000000000000000000000010001001101110011000010001000000110010000001001100000110001110110001011011011010110101111010,UQHJOQCEEXZLDX-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NCC2(CCOCC2)C3=CC=C(C=C3)F)F)C4,EAC236B1EC1E7C06_AD5E262017ACB387_6041_UN,7.271615,00000000000000000000000000000000000000000010000000000000010000100010000000010000001001110011000000101100010111011010101011100100110011110110001011011001010111101111110,AKLWOAMIRMPKRP-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2CC2)NC[C@@]34CCCN[C@H]3CCCC4,2F1F83E1A46C887C_092A9123D4628133_6041_DP,7.41823,00000000000000000000001000000000000000000010000000000100000000100010000000000000101000010011000000101100110100011000001001000000110101110110001011010011010110100111010,QXZYVRBWJCRBIZ-RBUKOAKNSA-N
CC(C)(C#N)C1=C(C(=CC=C1)NCC3CC2(CCN2)C3)F,C050F1D7AC1656F4_9DE5C4A8AD24FFEE_6041_DP,7.5847707,00000000100100000000000000000000000000000110000000000000000000000010000000100000001000010011000000001000110100011000001001000000110101110110001010010111010110101111010,IQHFJNSROBZFNM-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC2CCCN2CC3CCCCC3,F58351AB3E473C44_821500BD4D73B7D8_7022_UN,7.8055086,00000000000000000000000000000000000000000000000000000000000000000000000000010001001101110011000010001001000110010000001001100000110001110110001011011011010110101111010,KDXULWUHPLLBEF-UHFFFAOYSA-N
CC1=C(C(C4=C(N1CC2(CC23CCNCC3)C#N)C=CC(=C4)Br)=O)C,79FDA98B442CF6DA_F803FBA81869AF92_6034_DP,8.6083145,00000000000000000000001000000000000000000100001000000000000000000110000000010000101001110001000001101100110110011100101011100101110000100110001111011111111110101111110,KQRONLUOAXINGW-UHFFFAOYSA-N
C1(=C[N](N=C1)CC2CCC2)N[C@@H](CC)C3=CC(=C(C=C3)C)F,BB7DE6586182254F_9775397B5459DCA2_6041_UN,8.199301,00000000000100000000000000000000000000000010000000001000000000000100000000010001100100010001001010001000100100010010001011101100110001110100001010011111010110101111010,BVHUKULKRRMHBX-SFHVURJKSA-N
CC1=C(C=CC=C1F)NCC2CCCN2CC3CCCCC3,EA24D5701195EF28_53BE0B165BAF49FA_6041_UN,7.8054976,00000000000000000000000000000000000000000010000000000000000000000000000000010001001101110011000010001000000110010000001001100000110001110110001011011011010110101111010,HGHOBPLOAWOYPY-UHFFFAOYSA-N
C[N]1N=C(N=C1NC2CC3=C(OC2)C=CC(=C3)F)C4CCOCC4,B92C8552175D274C_DEAD1180A2ED8B74_6041_UN,8.216919,00000000000000000000000001000000000000100010000000001000010000100100000000010101100100110000011110100100111101010100001011101100110011110110001011011011110011111111110,UVZMQVIMIJTKCV-UHFFFAOYSA-N
N([C@@H]1CCO[C@H]1C2=CC(=C(C=C2)Cl)F)C(C3C(C)C4CCC3C4)=O,0DD5D65FE7BDD33C_79A14C54C7ABA020_6038_UN,7.833377,00000000000000000000000000000000000000000010000000000000010000100000000000000000000100010011100111000001110111110000111000000000010011100100000011010011111011111111110,KSEDKJHVULLZFH-KGQLMFAASA-N
N([C@@H]1CCO[C@H]1C2=CC(=C(C=C2)F)F)C(C3C(C)C4CCC3C4)=O,8946730CC3644CDF_4E2C3EE3D4F83B1D_6038_UN,7.833374,00000000000000000000000000000000000000000010000000000000010000100000000000000000000100010011100111000000110111110000111000000000010011100100000011010011111011111111110,OWFMMLCZWDIXPE-KGQLMFAASA-N
C1(=C(C=CC=C1)C=C)N[C@@]34[C@@H]2OC(C)(O[C@@H]2[C@@H](CC3)C4)C,A3EF5B4EB47F77E7_98A6497CD8B5050F_6041_UN,7.7035103,00000000000000000000000000000000001000000000000000000000010000000010000010100000000100000011000111010100110000011000001010010000010001010100000011010111100011111111110,GOIJLDLBDLUGDW-ZDRJDWQYSA-N
CN(CC1=NN=C(C=C1)N[C@H]2[C@@H](C2)C3=C(C=C(C=C3)F)F)[C@H]4C[C@@H]5CC[C@H](C4)N5,339834E08B6DB38A_3AD6C7624CFAC7B4_6041_DP,7.539986,00000000000000000001001000000000000000100010000000001000000000100100000000000101100101110011011010101000110100010001101011101100110101110100001011011011010110101111010,ODSMVJNABKUFPP-XSLRHLANSA-N
FC1=C(C=CC=C1)C2=CN(C(=N2)C3CCCN3)CC5[C@@H]4C[C@@H](C4(C)C)CC5,8326E3F5059594DF_4E87A2075C213308_6034_UN,8.047992,00000000000100000000000000000000000000100010000000000000000000100110000000110101001101010011000010001000110110011000101011100100110000100110001011011111010110101111010,XUIROPOFUZCJBW-OUBFZGACSA-N
N(C1=CC2=C(C=C1)COCC2)[S](C4=CC3=C(SC=C3C)C=C4)(=O)=O,F36F54583898EA4F_FC69306131E530B5_6029_UN,8.210894,00000000000000000000000000000000110010000000000000010001011111001001010001000000010100101001001010100110011001001000011010001100111011011110000011111001010011111111110,LAWAKFNCMOVJFB-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC(C3CCC3)C4CCC4,CA6AE2951E9804BA_08EE7AFDCD33C982_6041_UN,8.299545,00000000000100000000000000000000000000000010000000000000000000000100000000000000101000010001000000101100010100000000001001000100110001110100001011010011010110101111010,MEPKAVZQRIEDHY-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC3CCOC(C2=CN=C[N]2C)C3)C=C,30120C9BEC16412E_79D032FEFC691049_6041_UN,7.468154,00000000000000000000000000000000001000000010000000000000010000100100000000010101000101010010010111110000100111010000001011100100110011110100001011011011110011101111110,XHJBPWAIFNHVCF-UHFFFAOYSA-N
C(C1CCCC=CCC1)=CC4=CC2=C([N](N=C2C)C3=CC=CC=C3)N=C4Cl,F65131BB54C4A122_D6E2BF9E270A0266_7019_UN,7.9221935,00000000000000000000000000000000000000100000000000001000000000100100000000010101100100010000001010110101010100000000001011101100110001110100001011011010000010101111010,LBUFWLKVMZASQW-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1C[C@@H]2CNC[C@H]2C)C=CC(=C3)C)C4,2F3CC332CC3FA386_19798AE225353922_6034_UN,8.176957,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101100011000010001100010010010011101011100100110000000110011011011111010110101111010,UOZXOBCDWFJFLO-SKQWJGTPSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC=C(N=C3)NCC4CCC5=C4C(=CC(=C5)F)F,406FAC71E5B8E74E_6ACE9BE7E7ABB121_6041_DP,7.8808722,00000000000000000000001000000000000000100010000000000000000000000100000000000101101101110011010010101100010110000000001011100100110101110110001011011001010110101111010,FVZHAKMRPQWYAK-URRZBSOSSA-N
C1(=CC=C(C=C1)C2OCCCO2)NC4=CC(=C(N(C)C3CCCCC3)C=C4)F,96F95448C7ED66F6_0C9F00A1DA934760_6041_UN,8.057135,00000000000000000000000000000000000000000010000000000000010000100000000000000000000001010100010000100000000111010000101010110100110011110110001011011011010011111111110,WLYQFIRGEPZJQA-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NCC4CC3(CCNCC3)C4,3C746C344C2EA3FA_625B3DAF82920748_6041_DP,7.1759806,00000000000100000000000000000000000000100000000000001000000000100110000000010101101101100011011010101000110010011000001011101100110101010110001011011111010110101111010,OTBLABABLTUBHJ-UHFFFAOYSA-N
CN(C1CCCCC1)C2=NC(=CC=N2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,74F94663A553EC8E_2FEF509307DBCE5B_6041_UN,7.893111,00000000000000000000001001000000000000100010000000000000000000100100000000000100101001010011010000101000001110010000101011100100110001110100001011011011010110101111010,DNTFNTDQMQNEND-GOEBONIOSA-N
CC5(C)CCC1=C(C4=C(N1C[C@H]2[C@@H](CN2)C3=CC=CC=C3)C(=CC(=C4)F)F)C5,6B69811C4DDC1C91_7BF6E25C5D78A19D_6034_UN,7.9081907,00000000100100000000000000000000000000000010000000000000000000100110000000110001001101010011000010001100110100011001101011100100110000100110001011011111010110101111010,BFQLREZOXJGVTG-FPOVZHCZSA-N
CC2=C1C=C[NH]C1=NC=C2NCC3CCCN(C)C3C4=CC=CS4,6BB41F10109B1203_E2C121793A36FEB4_6041_UN,8.363594,00000000000000000000000000000000000010100000000000000000000000100100000000010101111101101011010010101100010010010001101011100100110101010110001011011111010110101111010,DIJRBRIVSGFDJE-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC[C@H]3[C@H]2CCCCN2CCC3,B15AE1E478DED5EE_4D064672E96B889A_6041_UN,7.5978637,00000000000000000000100000000010000000000000000000000000000000000100000000100001101001100011010000101100010000011000001011100000110001010110011011011111010110101111010,CPPRUKKLLLWUKY-DOTOQJQBSA-N
C1(=CC(=C(C(=C1)F)F)F)NCC3=C(CN(C)C2CCCCC2)C=CC=C3,F64943595325B098_8FBE765F72D2B957_7022_UN,8.012577,00000000000000000000000000000000000000000010000000000000000000000000000000000000001001110001010000001000000110010001101000100100110001110010001011011011010110101111010,XADYNJDJVHBEGS-UHFFFAOYSA-N
CC1=NC(=NC(=C1)NC2(CCCCC2)CC3=C(C=C(C=C3)F)F)CC4CC4,9A00F0E1EF95C889_8C873492776E577F_6041_UN,8.240927,00000000000000000000001000000000000000100010000000000000000000000110000000000100100000010011000000100000100110011000001011000100110001110100001011010011000110101111010,OSCXALGWNXHSGD-UHFFFAOYSA-N
N1CCC3(CC1)OC4(COC2=CC=C(C=C2)I)CC3(N)C4,E1733A4103490654_F257C9A261D7EA2E_6035_DP,7.465907,00000000000100000000000000010000000000000000000000000000010000000010000010000000001110110011000111101000110101011100001011000011110111100110001101010001110111110111110,TXYBEICUEWLVSW-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2CC(C)N(CC2)C)F)CC3,324288B313892F5F_28D26B9B1438124E_6041_UN,7.4510508,00000000000000000001000000000000000000000010000000000000000000000000000000010001100001110010010000101000100110010001101011100000110001110110011011011111010110101111010,NLLUJEQUXRDVEM-UHFFFAOYSA-N
N1CCC3(CC1)OC4(COC2=CC=C(C=C2)Cl)CC3(N)C4,925707FB08595DF2_58D704021D00629C_6035_DP,7.465901,00000000000100000000000000000000000000000000000000000000010000000010000010000000001110110011000111101001110101011100001011000011110111100110001101010001110111110111110,MGQSHYQKLAYOLS-UHFFFAOYSA-N
N1CCC3(CC1)OC4(COC2=CC=C(C=C2)Br)CC3(N)C4,DC707C4EDD08A5C1_C38A136043C968B8_6035_DP,7.4658904,00000000000100000000000000000000000000000000001000000000010000000010000010000000001110110011000111101000110101011100001011000011110111100110001101010001110111110111110,ASGVEIIRQONNAS-UHFFFAOYSA-N
CC1=C(C=CC(=C1)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)C#N,35A4825F499231F9_DB0945A85045DEE2_6041_DP,7.8396726,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000001001000100110101110110001011010011010010101111010,SKVGALVTIOLORH-VQIMIIECSA-N
N1CCC3(CC1)OC4(COC2=CC=C(C=C2)F)CC3(N)C4,316BDDDB49C79B84_3493DDE4C13D9A99_6035_DP,7.465891,00000000000100000000000000000000000000000010000000000000010000000010000010000000001110110011000111101000110101011100001011000011110111100110001101010001110111110111110,XOWGWHIQQGWMOR-UHFFFAOYSA-N
CC[C@H](OCC1OCCC12CNC2)C3=CC(=C(C=C3)C)F,47219556C4018CD2_994F097161BBF049_6039_DP,8.4978695,00000000100100000000000000000000000000000010000000000000010000000010000010000000001100110011000011001000010111001010001011000010110010100110000010010111110101111111110,GVLBLMPINCLSQH-VYRBHSGPSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC(C)C3CCC3,2695AB2599CEB042_3B3AFC732E29F2C5_6041_UN,7.9395266,00000000000100000000000000000000000000100010000000000000000000000100000000000100001000010001000000101100010110000001101001000100110001110100011011010111010110101111010,INQLXZXVQROWRI-UHFFFAOYSA-N
CNC1CCCC2=C1N(C3=C2C=C(C=C3)C)C[C@H]4[C@@H](CCNC4)C5=CC=C(C=C5)F,7D893597E9FFE55D_AD71FCF09BE3341B_6034_UN,7.8191094,00000000000000000000000000000000000000000010000000000000000000100100000000010001101101110011010010101100110110010000101011100100110101100110001011011111010110101111010,JZBGIPRJWKGFEM-GGGSXUAESA-N
CCN4CCC1=C(C(=CC(=C1)NCC2(CCNCC2)C3=C(C=NC=C3)F)F)C4,CB22DCF816247007_CB6973ACC03E932D_6041_DP,8.103647,00000000000000000000000000000000000000000010000000000000000000100110000000010000001001110011000000101100110110011010101011100100110101110110001011011011010110101111010,OCNUVOIKYDQCLX-UHFFFAOYSA-N
C1(=CC2=C(C=C1)CC3CCC(C2)C3=O)NC4=CC(=CC(=C4)F)F,E1ACF364F447C7FA_D01CA31C672E6CA8_6041_UN,7.837987,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000010001000010000100010100000000001000000101110001110000000111010001101010100111110,IAKFDUSWIQRJTF-UHFFFAOYSA-N
N(CC3CN1CC2CC1(C2)CO3)C(=O)C4=C[NH]C5=C4C(=CC=C5)F,54109AB18F570B83_A0C005D8ACDA5A9C_6038_UN,7.8921614,00000000000100000000000000000000000000000010000000000100010000000110000000000000101101110011100111101100010101111000010011100100110110100110001001001001111111110111110,AMPNYZKRUKIUNV-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2C(CCC2)C3CC3)F)[N]4C=CC=C4,B191CFD5F90562D5_6EA3A9FF9B677BFB_6041_UN,7.80114,00000000000000000000001000000000000000000010000000000000000000100100000000010000001101010011000010001000000100000000001001100100110001110100001010011011010110101111010,YLSUHKZCEOITLP-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NCC4=C(C=C(C=C4)C5CC5)F,5C469B9DB93D6247_9BB6F142BEB39511_6041_DP,7.9097624,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110001010010101000010110000000000011100100110101110110001011011011010110101111010,MRPIMKPMBGDOBM-NYTJIUQPSA-N
FC1=C(C=CC=C1)C2=CN(C(=N2)C3CCCN3)C[C@@H]5[C@@H](C4=CN=C[N]4C)N(CCC5)C6CC6,67DFAF0682EC9FA0_EC28BAB186B601D9_6034_UN,8.625919,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101010011010010101000100100010000001011100100110001100110001011011011010110101111010,IWFORRRZCYVTOL-LJCPKLOSSA-N
CSCC2(C=CCC1(CCNCC1)C#N)CCOCC2,F5BE440D8D893294_36F37979D4D8FD28_7019_DP,8.310132,00000000000000000000000000000000000000000100000000000000010000000010000000000000001000101001010000111000100011011001001011000000110010000110001001010001010101101101110,LJAFCJUPBPLDOA-UHFFFAOYSA-N
CCN5CCC1=C(C(=CC(=C1)NC4(CN2CCN(CC2)C3=CC=C(C=C3)F)CC4)F)C5,1833767FD7A7B835_B427F9FAAF1EC16F_6041_UN,7.9821005,00000000000000000000001000000000000000000010000000000000000000100010000000010001000001110011000000101100110110011010101011100100110001110110001011011001010110101111010,MFJWGPLMYYBSLO-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NCC[C@@H]3CNC[C@H]3C,BB3D6F508DB7E971_C757C5521538F1FB_6041_DP,7.9846506,00000000000000000000000000000000000000100010000000000000000000000100000000000100001100110011000010101100110110010001101011000100110101110110011011010111010110101111010,HQJPYGQOMQETFU-ZIAGYGMSSA-N
FC1=CC2=C(C=C1)C=NC(=C2)NCC3CCCC(CC)CC3,0B171F395385446C_3DFE5637790CC1FE_6041_UN,8.261275,00000000000000000001000000000000000000100010000000000000000000000100000000000100001000010011000000101100010110000010101001000100110001110100001001010001010110101111010,ZOROUPKBFXQXAW-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC(CCC)C4=C(C=CC(=C4)F)F,8771D2E8F76A9AB3_A3EFABD3A52ACB8D_6041_DP,7.939458,00000000000000000000001000000000000000100010000000000000000000000100000000000101101101110011010010101000110110010011001011100100110101110110001011011111010110101111010,MKXKJBKSBLNOGJ-ZVXXOIICSA-N
O=[N](=O)C2=C1C=CN=CC1=C(C=C2)NC4=C3OCCCC3=CC(=C4)F,5A037DE674FDEEBB_A5DC8C34F4208346_6041_UN,8.293719,00000000000000000000000010000000000000000010000001000000110000010100001100000000100000010001001100100110010101000100001111101100101011110100001011111001110011110111110,NSXKGHWOJXFGEI-UHFFFAOYSA-N
CC1(C)C3CCC1(C=CCCC2=CN=CC(=C2)F)CC3,D760836924040A24_A392DD4538CB9ECD_7019_UN,8.227585,00000000000000000000000000000000000000000010000000000000000000000110000000100000000000010000000010110000010110001000101001000000110000100100000001010110000100001111010,CXATVUSFIBZEAE-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CCNC3CCC(CC)CC3)C4=CCNCC4,CA0C1785DAAC829E_8BC78D3372C02285_6034_UN,8.316194,00000000000000000000000000000000000000000010000000100000000000100100000000011001001101110011000010111100110110010010101011100100110101100110001001011001010110101111010,YMNMHLJLEVSAQN-UHFFFAOYSA-N
FC1=CC2=C(C(=C1)F)C(=C(C#N)C=N2)NCCC3CNCC(C)O3,A019E5445ACE3ED4_C88D837ECE89535D_6041_DP,8.341693,00000000000000000000000000000000000000000110000000000000010000000100000000000000101000110011000101101100110110010001001011000100110111110110001011010011110111101111110,CINJCSSQCACVKP-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]2CN(C)C[C@H]2C3=CC=CC=C3)Cl)C4CC4,7114EBD57BA53805_70A758C36D7BD17B_7022_UN,8.218571,00000000000000000000001000000000000000000000000000000000000000100000000000010000101101110011010010001001000110000001000001100100110001110110001011011111010110101111010,NWTXUFCLFRPUJW-QUCCMNQESA-N
FC2=C1CCCC1=C(C=C2)NC[C@H]4[C@H](C3=NC=C[N]3C)OCCC4,85F1C98A7EAC6AF3_F0E7A6F47298B7C0_6041_UN,7.1292787,00000000000000000000000000000000000000100010000000000000010000100100000000010101001101010011010111101100010101000000001011100100110011110110001011011011110111101111110,YCXOZYOSQYQZIW-SCLBCKFNSA-N
C[N]1N=NC2=C1C=CC(=C2)NC35CC(OC34CCNCC4)(C)C5,F5DC60374EBB4281_AD93D5DC238433C5_6041_DP,7.1223645,00000000000100000000000000000000000000000000000000001000010000000110001000010101101100100011011111101100110010011001001011101100111111010110001001011101110011101111110,AUUBCVRQFFMSIA-UHFFFAOYSA-N
FC2=C1N=C(N(C1=CC=C2)C[C@H]3[C@@H](CCNC3)C4=CC=C(C=C4)F)C5CCNCC5,27229394596E408B_C31EDF0425A4F0A0_6034_UN,9.002887,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101100110100010000001011100100110100100110001011011011010110100111010,ZLPFZOYDJSVDKC-ICSRJNTNSA-N
C1(=CN=C(C=C1)C2(CCOCC2)C#N)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,2AD2C21377F2C062_06CB7F99A68286B2_6041_UN,7.732484,00000000000000000000001000000000000000000110000000000000010000100110000000000001101000110011000000101000000101001000001011000100110011110110001011010011010111100111110,RUWSJJKNBSAGRH-GOEBONIOSA-N
CC1=CC(=C(C=C1)F)NC2=CC=C(C=C2)C35CC4CC(CC(C3)C4)C5,24BCBE7251B2C584_FE64AFE254D82959_6041_UN,8.1568575,00000000000000000000000000000000000000000010000000000000000000100010000000000000000000010000000000000100010100001000000000000100100001110000000011000011000010101111010,WKCSFXGBZMXJHU-UHFFFAOYSA-N
FC1=CC2=C(C(=C1)F)C(=C(C#N)C=N2)NCC3CNCC4(O3)CCC4,CC7F5B2D5EB7055A_72D59B47024594C0_6041_DP,7.9385753,00000000000100000000000000000000000000000110000000000100010000000110000000000000101000110011000100101100010100001000001011000100110111110110001011010011110111100111110,PPHJNCDIQHBLAC-UHFFFAOYSA-N
CC1=CC(=C(C=C1)C)[C@@H]2CCCC[C@H]2OCCC3OCCNC3,655582F43125D8F3_D18A3EACDAF1D064_6039_DP,8.649569,00000000000000000000000000000000000000000000000000000000010000100000000000000000001000100111000100101000100011010000001011000011110010000110000111010111110101111111110,NNEQINGJSXKHJO-AQCCAAQSSA-N
N(C1=CC(=CC(=C1)F)F)C(CC3CC2CCC(N2)C3)=O,35E29437A8666B0D_FBC28366838E8786_6038_DP,7.612869,00000000000000000001000000000000000000000010000000000000000000000000000000000000000100010011100010100000110100110000011001000000110111110100001001010001001110100111110,LXUNJOLBSNSGDK-UHFFFAOYSA-N
C2(=C1C=CC=CC1=C(C=C2)Cl)NCC3(C)CCC4(CC3)OCCO4,9C00755190BD2F64_39D369EED0D2EDFC_7022_UN,7.8953295,00000000000000000000000000000000000000000000000000000000010000000010000010000000001100010011000010001101010101001001101010010100110011110110000001010001110111111111110,FWDXQVBTPISEDG-UHFFFAOYSA-N
C(CC23CC1CC(CC(C1)C2)C3)=CC4=C([N](C)C5=C4C=CC=C5)Cl,7BC870EC37EC5622_05865C1A7F791F4D_7019_UN,8.060322,00000000000000000000000000000000000000000000000000000000000000000110000000010000000101010000010010010101010100001000000001100100100000100100000011001010000110101111010,DDFFTUZWPUEAFC-UHFFFAOYSA-N
O(C1CNC2(CC1)CC2)C3=CC5=C(C(=C3)C4=CC=C(C=C4)Br)OC(=O)S5,E00DFAA969A19ECE_D8F92A9A828C6F75_6035_UN,7.6445684,00000000000000000000001000000000000010000000001000000000010000100010000000000000011100011011000110101100111100011100001011010111110010100100000101110001111011110111110,AWXJKMOKXHIAIW-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2CCCC2CC=C)F)CC3,262E71F8E3F91508_A822FA8ECDB6A7E6_6041_UN,7.966428,00000000000000000001000000000000001000000010000000000000000000000000000000010001100001110011010010011000100110010001101011100000110001110110001010011011010110101111010,KVTAPEWQPIYLAG-UHFFFAOYSA-N
CC1=CC2=C(C=C1)N(C(=N2)C3CNCCC3)CC4(CN(C)C)CCCC4,F56F688E9AECF03B_029714D989E5B5BC_6034_UN,7.6453567,00000000000000000000000000000000000000100000000000000000000000100110000000110101101101100011010010101100110010011001001011100100110000000110011011011111010110101111010,QWNRQJFTWOCTIJ-UHFFFAOYSA-N
O(C2C1CC(C1)C3=C2C=CC=C3)CC4CCCC(F)(F)C(N4)=O,87D073DD3319E6DC_D6F2F2342D7A4041_6039_UN,7.6820984,00000000000100000001000000000000000000000010000000000000000000000000000000000000000000010011100100000100110101111000011001000011110000100100000111010011111111110111110,PCMJECAWWJNDCM-UHFFFAOYSA-N
O(C1CNC2(CC1)CC2)C3=CC5=C(C(=C3)C4=CC=C(C=C4)F)OC(=O)S5,DD4873B4C14ADA06_3B3DE2B4761CEECF_6035_UN,7.6445723,00000000000000000000001000000000000010000010000000000000010000100010000000000000011100011011000110101100111100011100001011010111110010100100000101110001111011110111110,MTLOQDBQRJMADO-UHFFFAOYSA-N
NCC14CC(C1)(COC2=C(C=CC(=C2)C3CNCCC3)F)CO4,D53A84044E704F2B_AC107A5E56C593E6_6035_UN,7.9758415,00000000000100000000000000000000000000000010000000000000010000100010000000000000001110110111000110101000110101011100001011000011110110100110001111010011110101110111110,JFQISPZQOCSQRR-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC3CC2CCCCN2C3,599FB8A95ECC16FE_64AA0EBA9662EBB8_6041_UN,8.092104,00000000000000000000100000000010000000000000000000000000000000000100000000100001100101100001010010101100110000011000001011100000110001010110011011011111010010101111010,LVBGCJGMAQUPII-UHFFFAOYSA-N
O=C1C=CN=C(N1C[C@H]2[C@@H](CNC2)C3=CC(=CC=C3)F)C4CCOCC4,C69C1A7CC42E46CA_A7C5300919AA5932_6034_UN,7.931575,00000000000000000000000000000000000000100010000000000000010000100100000000010100101101110011100011101000000101100100011011100101110010100110001111011011011111110111110,UXQLHWOKESUKEE-WMZOPIPTSA-N
C2(=C1C(=CSC1=NC(=N2)C3CC3)C4=CC=CC=C4)N[C@@H]5CCN(C)[C@H]5C6=CC(=C(C=C6)F)F,5F0B0DB203976B52_77A831C59554B22F_6041_UN,8.569417,00000000000000000000001000000000000010100010000100000000000000100100000000010101110101111011010010101100110110010001101011100100000001110100001011011011010010101111010,RCWDRHDQYHONPX-GGAORHGYSA-N
CN5CCC1=C(C4=C(N1CC3(CC2=CC=C(C=C2)F)CCNC3)C=CC(=C4)Cl)C5,FCE675A6636997AC_4FC0F3A802BB6E3A_6034_UN,7.780059,00000000000000000000000000000000000000000010000000000000000000000110000000010000101101110011010010101101110100011001101011100100110000100110001011011001010110101111010,DOQMSYSRDVYMJR-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@]23CCC[C@]2(CNC3)F)F)CC4,01403AED60C939D7_E34A2AFD563AD317_6041_DP,7.3180084,00000000000000000001000000000000000000000010000000000110000000000010000000010001101101110011010010001100110110011001101011100000110101110110001010011011010110101111010,ALMKFBLOOLUSRD-UXHICEINSA-N
FC1=CC2=C(C=C1)[NH]C=C2NC4=C(CN(C)C3CCCCC3)C=CC=C4,86A48A61B3E34106_88860A715191073F_6041_UN,8.028912,00000000000000000000000000000000000000000010000000000110000000000100000000000001100101110010010010001100010110010001101001100100110101110100001011011011010110101111010,ODDQTACAZVYRJM-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NC(CC)CC3=C[N](C)C4=C3C=CC=C4,0531A6A0AA179A0E_0AF394375BE27268_6041_UN,7.850436,00000000000000000000000000000000000000000010000000000000000000000100000000010000000101010011010010000100110110010010101001100100010001110100001011011101000110101111010,MJNIWESDYZNPMX-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4=C(C=CC5=C4OCO5)F,D7622230593064A2_6A49ECE440368673_6041_DP,8.380766,00000000000000000001000001001000000000100010000000000000010000000100000010000100100101010011010111100100111101010100101011110100110101110100001011011011110011111111110,BXBFEOSEQZCBHZ-CLLJXQQHSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC3=CC(=CC=C3)CC4CCNCC4,B0831333BAC31EDC_7089C869DCA2C1B5_6035_UN,8.173943,00000000000000000000001000000000000000000010000000000000000000100010000000000000001010110011000001101000100101011100001001000111110100100110001101010011110101100111110,MVDGNWXDEIEDHP-UHFFFAOYSA-N
N(CC12CCC(CC1)O2)C(=O)C3(CCCC3)C4=CC(=CC(=C4)F)F,FDC791BA2DF7677B_9D07C23B6E102B0F_6038_UN,7.5068827,00000000000000000000000000000000000000000010000000000000010000100010000000000000001100010011100110001000010100101000011000000000110010100100000001010001111111110111110,IWWYTAIENFHDIT-UHFFFAOYSA-N
FC1=CC(=C(C(=C1)F)NCC2CCNC(C2)(C)C)C#N,72B40F2772806908_E9522E4D770A02CF_6041_DP,8.09184,00000000000000000000000000000000000000000110000000000000000000000010000000100000101000010011000000101000100110011001101001000000110101110110001011010111010110101111010,RWBAGOYNHRHEET-UHFFFAOYSA-N
CCC1=CC(=C(C=C1)CC)NC3C2C4CC5C2CC6C3C4C56,022AD294FAD962A5_D2CA9DD563E595F7_6041_UN,8.55196,00000000000100000001000000000000000000000000000000000000000000000000000000000000000000000011000010000100010000000010000000000000110001010000000011000111000110101111010,NQOIOEUFIXVJQM-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3(CC)CCCN3C)Cl,F31FACAAB217F08F_B5075340726A0D5A_6034_UN,8.142534,00000000000000000000000000000000000010000000000100000000000000000110000000010111010101111011010010001001001110011011101111100100110001110110011010011111010110101111010,UDTWJTRYEBLRLE-UHFFFAOYSA-N
CC4(C)CCC1=C(C3=C(N1CC2=CCSC2(C)C)C=CC(=C3)Br)C4,DC910079ADBEB75B_6B868D1F549F3CBA_6034_UN,8.196477,00000000000000000000000000000000000010000000001000100000000000000110000000111000010101011000000010011100010110011001101011100100110000100110010011011110010110101111010,LLQQAPLXCLHQNU-UHFFFAOYSA-N
ClC1=CC(=CC=C1)NCC2=NC=C[N]2C[C@@H]3CNCC(O3)(C)C,B2A464C5960476D9_5EEDC4A30B85D440_6034_DP,8.197181,00000000000000000000000000000000000000100000000000000000010000000110000000110101101101110011000110101001000110011001000011100100110111110110001011001111110111101111110,SHYBTKVRGOWILE-HNNXBMFYSA-N
FC1=CC(=CC=C1)NCC2=NC=C[N]2C[C@@H]3CNCC(O3)(C)C,E1F2B9446BB00795_03327350AB927641_6034_DP,8.19717,00000000000000000000000000000000000000100010000000000000010000000110000000110101101101110011000110101000000110011001000011100100110111110110001011001111110111101111110,NVSMEYUZIWILTR-HNNXBMFYSA-N
NCCC(OC1=CC=C(C=C1)CC2CCCNC2)C3=CC(=C(C=C3)Cl)Cl,D4076F98B3E29301_4287FEDF738EC828_6035_UN,8.149106,00000000000000000000000000000000000000000000000000000000000000000000000000000000001010110011000001101001100100010100001001000111110110100110001111010011110101100111110,HRPMADTVNAKKAZ-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C3=C(N=CC(=C3)C)F)=O,5099D78433C72FCD_E1EB4551DF4E82A1_6038_UN,7.7133265,00000000000000000000000000000000000000000010000000000000010000000100000000000000101100010001100011101000110100110000011011000000110010100100001011010011111111111111110,RTWWOGNIBLXWIO-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCCC3=CSC(=N3)C(C)(C)C)F,4E149E071EEA49ED_076161F236C1D6D7_6041_DP,7.5354486,00000000000000000000000000000000000010000010000100000000000000000110000000100000111100011011000010101100110100011000001011000100100101110110011011010111010110101111010,UIJYPXBWRSITAI-UHFFFAOYSA-N
C2(=C1[NH]C=CC1=CC=C2)NC4=CC3=C(CCN3CC)C=C4,5BE4B653D812970E_0222442D7EEA95E8_6041_UN,8.153296,00000000000000000000000000000000000000000000000000000010000000000100000000010001100101100000000010001100010010010010101011100100110101010110001011011001010110101111010,VGTIDVGNLNNWSH-UHFFFAOYSA-N
CC2=C(C(=C1C=C(C=CC1=N2)F)NCC3(CC3)CC4CC4)C,D673E27B06AC3510_9ECD4B25171730F9_6041_UN,7.813125,00000000000000000000001000000000000000000010000000000000000000000110000000000000101000010011000000101100010110001000001001000100110001110100001011010111010110101111010,ANZSPLYXQGBGDQ-UHFFFAOYSA-N
N(C2=C1OCCC1=CC=C2)C(C3=CC=CC(=C3)CSC)=O,73A6F35B4FFA8A98_BE75BF25CF86E38B_6038_UN,8.205982,00000000000000000000000000000000000000000000000000000000010000000000000000000000000100101001110110000100010001100101011000000100000011010110000011010001111111111111110,AUZDXWUBPUPJKS-UHFFFAOYSA-N
C[N]1N=CC2=C1N=CC=C2NCC3(CCOCC3)C4=CC=C(C=C4)F,9A1FA091E24957E1_536656C964F6AEF8_6041_UN,7.2845054,00000000000000000000000000000000000000100010000000001000010000100110000000010101101100110011011010101100010101001000001011101100110011110110001001011001010111101111110,CGRRYHCSSHHVIK-UHFFFAOYSA-N
FC2=C1C=CC=CC1=CC=C2NC3CCN(C)C4CCCC34,1BEE15526A6F89BA_739FEBDF91768946_6041_UN,8.35788,00000000000000000000000000000000000000000010000000000000000000000000000000010000100001110011010010101100110110010001101001100100110001110100001011011011010010101111010,PSPBVPFAZLRUSO-UHFFFAOYSA-N
O(C2(CC1CO1)CCOCC2)CCCN3CCN(C)CC3,0B1A400FF3043345_34D617C70CA3DE65_6039_UN,7.471285,00000000000000001000001000000000000000000000000000000000010000000010000000010001000001100100010001101000000001011001101011100011110010000110001101111000110101111101110,YMDWLFVSWZXRCS-UHFFFAOYSA-N
O(C1CCC2=C1N=CC=C2)CC3=CC4=C(C=C3)NC(=O)O4,E3B631C797737F67_AF6A7F1F19B297DB_6039_UN,9.171193,00000000000000000000000100000000000000000000000000000000010000000100000000000000000100000000000110100100011001100100011011010111110010000100001111110001111111010111110,PQJXOGLPRPVPSM-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)N[C@H]3[C@H](C2=C(C)[N](N=C2)C)OCC3)F)CC4,24FC061D87C8C27B_33D0AA52FA9AA328_6041_UN,8.145517,00000000000000000001000000000000000000000010000000001000010000100100000000010001100101110011011111001000100111010001101011101100110011110110011010011111110111101111110,TURMDENGRMLJHG-YADHBBJMSA-N
CC1=C(C(C4=C(N1CC2CSCC(N2)C3=CC=CC=C3)C(=CC=C4F)F)=O)C,347F2BCBFFC40BC1_6D655FF995ABB936_6034_UN,8.6089115,00000000000000000000000000000000000010000010000000000000000000100100000000010001000001111001000001101100110110010100100011100101100000100110001111001111111110101111110,BTBPMMDMRHXQQA-UHFFFAOYSA-N
CN5CCC1=C(C4=C(N1CC2=C(OC=N2)C3CNC3)C=CC(=C4)Cl)C5,309F4FCDDD0AA9E0_C21275D9778CEE75_6034_UN,7.787585,00000000100100000000000000000000000000000000000000000000010000100100000000010001101101110010010111101101010100110001111011100100110000100110001011011011110110101111110,TUBYIJRVWYUCEB-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)NCC3CN(C)C4=C(C3)C=CC=C4,4FE66A69FE2DD9EE_44167FD9EA423594_6041_UN,8.1786995,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001110011010010101100010110000001001001100100110001110110001011011001010110101111010,VSXBFPVQWMHKKB-UHFFFAOYSA-N
CC2=C(C=C1C=CC=C(C1=N2)F)NC[C@@H]3CCO[C@H]3C=C,69B121A8E4AA6B18_C1FD429A621F43F4_6041_UN,8.419258,00000000000000000000000000000000001000000010000000000000010000000100000000000001001100010011000011111100010111000000001011000100110011110110001011010011110111101111110,CBRKZWAEIPVGCA-BBRMVZONSA-N
ClC1=CC2=C(C=C1)N(C(=O)C3=CN=C[N]23)CC4OCCC5=C4C=CC=C5,92402780069BC449_B3802F80247B3DB1_6034_UN,9.155645,00000000000000000000000000000000000000000000000000000000010000000100000000010101100101010000100111101101010101100100011011100101110010100110001111011010111111110111110,DRROHFRKLVXIFF-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)F)NCC2(COCCNC2)F)C#N,58695858FE428FDF_7041208D3018E118_6041_DP,7.967885,00000000000000000001000000000000000000000110000000000100010000000010000000000000101000110011000101001000100101011000001011000000110111110110001010010011010111101111110,IRGXQSYDBXVLAL-UHFFFAOYSA-N
N4CCC1=C(C=C(C(N1CC3(CC2=CC=C(C=C2)F)CCNC3)=O)C#N)C4,A88F0020745FC48D_CA3512DD921FF84B_6034_DP,8.160786,00000000000000000000000000000000000000000110000000000000000000000110000000010000101101110011100011101100110100111100011011100101110100100110001111011011011110100111110,ZHUNWCAWTLKPBN-UHFFFAOYSA-N
F[C]5(F)C[C]4(C[CH](C=CC3=C(OC2C1(CCC(C1(C)C)C2)C)C=CC=C3)C4)C5,8030A5BFEAA4B54A_066AD961565504B5_7019_UN,7.2540536,00000000000100000000000000000000000000000010000000000000000000000010000000100000000000010000000010010000010110001101101000000011110010100000010111010110100001001011110,OWAZJVHGEAXFTB-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC3=NC=C2CCCCCC2=C3)F,7D33CFB07F499700_95354DB809B65F7E_7022_UN,7.4616814,00000000000000000001000000000000000000100010000000000000000000000100000000100100000001110001010000101100010100000001001001100100110001110100001011011111010110101111010,QAJOPIZSWIOKBW-UHFFFAOYSA-N
C1(=C(C=CC(=C1F)F)Cl)NC[C@@H]2CCCN(C)[C@H]2C3=C[N](N=C3)C,9D717D43F2675905_8881659D54DCBC4E_7022_UN,8.493269,00000000000000000000000000000000000000000010000000001000000000100100000000010000101101110011011010101001000110010001101011101100110001110110001011011111010110101111010,NKGWFXJQMCXCBO-APPDUMDISA-N
BrC1=CC2=C(C=C1)N(C3=C2CCCCCC3)CC4(C)CCCN4,2FFBA7028CE8116C_6A55C229BD48C0ED_6034_UN,7.7249703,00000000000000000000000000000000000000000000001000000000000000000110000000010001001101010011000010001100110110011001101011100100110000100110001010011001010110101111010,IGPPZPPECVQDOD-UHFFFAOYSA-N
C(C1CCC2(CC1)OCCO2)=CC4=C(N3CCN(C)CC3)C=CC=C4Cl,DF24A8AC2D7365DE_B19FEA06CFC431FE_7019_UN,6.913002,00000000000000000000000000000000000000000000000000000000010000100000000010010001000101110000010010111001010101011001101011110000110011110110001011011010110011111111110,KQEHEYCCXXBACI-UHFFFAOYSA-N
CC[C@H](NC(=O)CCC1CC2CCC1C2)C3=CC=C(C=C3)F,98F3B1BACA26D617_FB1CA351BB207A5F_6038_UN,7.79513,00000000000000000000000000000000000000000010000000000000000000000000000000000000000000010010100010000000110100110010011000000000110010100000000001010001001110101111110,YEOKGBMIDGRJPE-GYISRMCQSA-N
N4CCC1(CCCC1C=CC2=C[N](C)N=C2C3=CC=C(C=C3)F)CC4,04C9BDD02C61BFE3_682062B108747CCF_7019_DP,7.860795,00000000000000000000000000000000000000000010000000001000000000100110000000010000101100110001011010111000110100011000001011101100110000100110001011011011010010101111010,ULMUXCLLGAIRLJ-UHFFFAOYSA-N
C(CN1C2CCC(C1)C2)=CC3=C[N](C)N=C3C4=C(C=CC=C4)Cl,AE8BC187E8264AED_A9DC92260CC1D8AF_7019_UN,7.8101254,00000000000000000000000000000000000000000000000000001000000000100100000000010000100101110000011010111001010100010000001011101100110000100110001011011010010110101111010,ZGFQZMFRIZGBGV-UHFFFAOYSA-N
N3=C([C@]12CCCN[C@@H]1CCCC2)[N](C4=C3C=C(C=C4)Cl)CC5=CC=CC=C5,CD3370A3936DDF91_5C4A4DD0C26BC73E_7013_DP,8.0944195,00000000000000000000000000000000000000100000000000000000000000100110000000010101101101010011000010101101110100011000001011100100110000100110001011011011010110100111010,OBGBFKNKVRRKPD-FYYLOGMGSA-N
N(CCC1CC2CCC1C2)C(=O)CC3=C[NH]C4=C3C=C(C=C4)F,9722436101BBE36D_060D6307251B1EAB_6038_UN,7.9109197,00000000000000000000000000000000000000000010000000000000000000000100000000000000001100010011100010001100110100110000011001000100110110100100001001010001011110100111110,KWLRTPFCBFLZJJ-UHFFFAOYSA-N
C1CC(=CCN1)C2=CN(C3=C2C=CC=N3)CC4(CC)CC4,C14F1DC66B7E6557_089024BD2E9F20CE_6034_UN,7.928329,00000000000000000000001000000000000000100000000000100000000000100110000000011100001101100001000010111100110000011010101011100100110000000110001001011001010110101111010,ZVJIAVDLESTJMX-UHFFFAOYSA-N
FC1=CC=C(C=C1)CC2=NN=C(S2)NCC34COC(C)(C3)CCC4,CBAAF7262A57A97B_D75FDBCD094D323E_6041_UN,7.561791,00000000000000000001000000000000000010000010000100001000010000000110000000000101111100011011001011001000011111011001101011001100110011110110001001010001110111101111110,VAGRGKAGCSDBEN-UHFFFAOYSA-N
FC1=CC=C(C=C1)[N]4N=C(C=C[C@@H]2CCCO[C@H]2C3=CC=N[N]3C)C5=C4CCC5,80F8DA5326C24A5D_31DDE5BB24E551AF_7019_UN,7.8077664,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010000011111110100010101010000001011101100111011110100001011011010110011101111110,NQFMXMQZEMXMMH-QMHKHESXSA-N
CC1=C(C=C(C(=C1)NCC3CC2(CCNCC2)C3)Cl)C4CC4,A1D6CBBB17DEEDC4_E4B15A1F6DC1FFF7_7022_DP,7.8076873,00000000000100000000001000000000000000000000000000000000000000100010000000000000001000110011000000101001110110011000001001000000110101110110001011010011010110101111010,DXNRCAYBYHDBOU-UHFFFAOYSA-N
C[N]1C5=C(N=C1CNC(C24CC(OC23CNC3)(C)C4)=O)C=C(C=C5)F,94D829921E09CEB1_43FBE7F5C23473BB_6038_DP,8.077837,00000000100100000000000000000000000000100010000000000000010000000110000000010101001101110111110111001100010110111001110011100100110110100110001010001111111111111111110,GDMNCRPFXFDGSD-UHFFFAOYSA-N
N2CCC(COC1=C(C=C(C=C1Br)Br)C#N)(CC2)C3=CC=CC=C3,6BF7E7FA17FC1B61_42706235398B2260_6035_DP,7.788863,00000000000000000000000000000000000000000100001000000000000000100010000000000000001000110001000001101000100101011100001001000111110000100110001111010011110101100111110,UKLWMOOOHJQCRY-UHFFFAOYSA-N
C(C[C@@H]1C[C@H]1C2CC2)=CC3=C[N](N=C3C4=CC=C(C)C=C4)C5=C(C=CC=C5)Cl,DAEDCDFE0344603B_35B290C9DBDDBEB7_7019_UN,8.579072,00000000000000000000001000000000000000000000000000001000000000100100000000010000100100010000001010010001000100000000000011101100110001110100001011011010000110101111010,BVEBAINENDASJZ-IRLDBZIGSA-N
N2CCC(COC1=C(C=C(C=C1Cl)F)C#N)(CC2)C3=CC=CC=C3,19FF61C0CBDF4965_CFE89B1B3AC2F39C_6035_DP,7.7888594,00000000000000000000000000000000000000000110000000000000000000100010000000000000001000110001000001101001100101011100001001000111110000100110001111010011110101100111110,LZXMJSBNYFMZBS-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)Cl)NC3=CC=C(C=C3)N4CC5CCC(C4)O5,DC752042A4744531_4923C75D70C1D0F1_7022_UN,7.6932836,00000000000000000001001000000000000000000000000000000000010000100000000000010000000101110000000110101001010100000000001011100100110011110110001011011011110011100111110,DEYBOBFUTHPFGT-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2CC2)F)NC3=CC=C(C=C3)N4CC5CCC(C4)O5,9CA791ED8DCBCD8F_BDE335503882714E_7022_UN,7.6932874,00000000000000000001001000000000000000000010000000000000010000100000000000010000000101110000000110101000010100000000001011100100110011110110001011011011110011100111110,BKNJYRVGGMOTAM-UHFFFAOYSA-N
CN1CCC2=C1C=CC(=C2)NC4=NC=C(CC3COCCO3)S4,DCE63F4E2D9B67F0_94E97BE3EA9EB62D_7022_UN,7.250065,00000000000000000000000000000000000010000000000100000000010000000100000010010100010101101001010010101100011011010001101011100100110011010110001011011001110111111111110,FHCOVAZGFWMJKI-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC[C@@H]3[C@@H](C2=CC=N[N]2C)N(CCC3)C4CC4)F)[N]5C=CC=C5,6405EEF090D4288E_337C9451CFD8C075_6041_UN,7.7951207,00000000000000000000001000000000000000000010000000001000000000100100000000010001101101010011011010101000000100010000001011101100110001110110001011011111010110101111010,VKXSLOSMBRXAPV-KOSHJBKYSA-N
C1(=C(C2=C(C=C1)OCO2)F)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,48EE4341BABBCF3C_82434F2357CC94DB_7022_UN,8.300113,00000000000000000000000000001000000000000010000000001000010000100100000010010000101101110001011111101100010111010101101011111100110011110110001011111111110111111111110,GJLLTWNYHFKJDP-HOCLYGCPSA-N
C1(=CC=C(C=C1)C2OCCCO2)NCC(N3CCN(C)CC3)C4=CC=C(C=C4)F,B4B87EF9E3FCF811_F0ABB5DF6B7A43AB_6041_UN,7.4265327,00000000000000000000000000000000000000000010000000000000010000100000000000010001001001110101010000101000000101010001101011110100110011110110001001011001010111111111110,FVCDMJJNKSOOKE-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)C3(CC3)C4=CC(=C(C=C4)F)Cl,9A9D07AFAFA62C9A_DD5ED39D144660A5_6038_UN,7.56326,00000000000000000000001000000000000000000010000000000000000000100010000000010000101001110011110000101001010110111001111001100000110000100110001011011011011110101111110,LSSKIPISGDKCKN-UHFFFAOYSA-N
CN1C2CCC(C1)CC2CNC(=O)C3(CC3)C4=CC(=C(C=C4)Br)Cl,7CCE928F638C8A31_596927AA2BAD7D46_6038_UN,7.5632577,00000000000000000000001000000000000000000000001000000000000000100010000000010000101001110011110000101001010110111001111001100000110000100110001011011011011110101111110,JXZXITIJSFOLNG-UHFFFAOYSA-N
CCCC1=C(C=CC=C1)NC(C(F)(F)F)C24CC3CC(CC(C2)C3)C4,A0BF9EFB1C01ACAE_3A8D7D268A7F7BC2_7022_UN,7.945105,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000000011000000000100011100001011001000000000100001110000000011010011000110101111010,ADPPBXMRCSLRPD-UHFFFAOYSA-N
CN(C)CC1=CN(C2=C1C=CC(=C2)F)C[C@]34[C@](C)(C3)CNC4,B6EEDFAB69113684_A0EBC2539E8AE70C_6034_UN,7.6534834,00000000000000000000001000000000000000000010000000000000000000000110000000110000101101110011010010101100010110001001100011100100110000100110011001001111010110101111010,KHCLYXQTDAOSDM-MSOLQXFVSA-N
FC2=C1[NH]C=CC1=CC(=C2)NCCC3CCN(C)CC3,37ABD4BC88244B91_169D781A673430A8_6041_UN,8.280228,00000000000000000000000000000000000000000010000000000000000000000100000000010000001101110001010010101100110100010001101011100100110101110110001001011001010110101111010,ZPRFCOJRIVERJT-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC(C)CC3CCOCC3,9BC798C72CC5AA38_88D6AD537593EB37_6041_UN,7.7049317,00000000000000000000000000000000000000100000000000000000010000000100000000000100000000100001000000100100110011010001001011000100110011010110011011010111010111101111110,QVRQDGWKLOLFAV-UHFFFAOYSA-N
O(C2=C1OCCCOC1=CC=C2)C(C4=CC3=C(C=C[N]3C)[NH]4)=O,983C8AA427B9F7EF_68F400EAD6213394_6038_UN,8.475603,00000000000000000001000000000000000000000000000000000000010000000100000010010001100101000100010110000100010001000100001011110111000010000110101110111001111011111111110,BWJQGDNKQYQFGD-UHFFFAOYSA-N
CC2=CC1=C(C(=CC(=C1)Cl)Cl)N2CC(CC)C3=CC4=C(C=C3)CCCC4,54860B32B413E15C_9421A54BBBEB9AE2_6034_UN,8.075546,00000000000000000000000000000000000000000000000000000000000000000100000000010000000101010000000010001101010100000010101001100100110000100100000011011110010110101111010,IJLOCBPZFMFPRC-UHFFFAOYSA-N
C[N]1C(=NC2=C1C=C(C=C2)F)NC[C]4(C[C]3(C[CH2]C3)C4)C5=NC=CC=C5,D0F19A155F9E45AE_62F189A5EBA4EE25_6041_UN,8.063645,00000000000100000000000001000000000000000010000000000000000000100110000000010101101101010010010010101100011110001000001011100100110001110100001011011011010110101111010,IENGBAIWTCIFJT-UHFFFAOYSA-N
CN(CC1=NC=C(N=C1)N[C@H]2[C@H](CC2)C3=C(C=C(C=C3)F)F)[C@H]4C[C@@H]5CC[C@H](C4)N5,F6DDADD5EBEE4BCA_DD56CCC88503E4D1_6041_DP,7.4050646,00000000000100000001000000000000000000100010000000000000000000100100000000000101100101110011010010101000110100010001101011100100110101110100001011011011010110101111010,DQWWLFBCSATACL-ISAFILGBSA-N
N(C1C2CCC(CC1)C2)C(=O)CCC3=C(C=CC=C3F)F,20D64EE7774D2907_FD84A51C511A07CE_6038_UN,7.292279,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000010011100010000000110100110000011000000000110011100000000011010011001110100111110,SRYNLVUXIKXAGC-UHFFFAOYSA-N
C2(=C1OC=CC1=CC(=C2)F)NCCC3CC(C)CC(C3)(C)C,A6D4FD24912D6BD1_2CB4E7E1A88E43C2_7022_UN,7.5018644,00000000000000000000000000000000000000000010000000000000010000000010000000100000001100010001000110001100110110011001001000000100110001110100010001010101110110101111110,LWPDIPIDVOUZGP-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2=CN(C(=N2)C3CCCN3)C[C@H]5N[C@H]4CCCC[C@H]4C5,98F9731B16D082C4_904FBEED98B81B14_6034_UN,8.341719,00000000000000000000000000000000000000100010000000000000000000100100000000010101001101010011000010001100110100010000001011100100110100100110001011011011010110100111010,HTCYRDBFGNEZHO-SWYNNERLSA-N
CCC5CCC1=C(C4=C(N1CC[N]2C=CC3=C2C=CC(=C3)Cl)C=CC(=C4)C)C5,D85BE5306E613213_E459C3CAB37124AD_6034_UN,8.235352,00000000000000000000000000000000000000000000000000000000000000000100000000010001000101010000000010001101010110010010101011100100110000100110001011011100010110101111010,FRDRLLMFJLURBB-UHFFFAOYSA-N
C2(=C1COCC1=NC=N2)N[C@@H]3CCN(C)[C@H]3C4=CC=C(C=C4)F,CD3C5CADF4D24F52_8EF1E715FE2D697C_6041_UN,7.9333463,00000000000000000000000000000000000000100010000000000000010000100100000000010101100101110011010111101100110111010001101011100100010001110110001011011011010011101111110,OLYCZIOZAADCMR-ZBFHGGJFSA-N
FC1=CC(=C[N]2C1=NC(=C2)C3CCOCC3)NC5=CC(=C(N(C)C4CCCCC4)C=C5)F,907F86225AB13712_26B2DF3A55435A07_6041_UN,7.740169,00000000000000000000000000000000000000100010000000000000010000100100000000000101000101110000010010100100010111010000101011100100110011110110001011011011010011101111110,GFABWBDJNCFCFP-UHFFFAOYSA-N
CCN4CCC1=C(C(=CC(=C1)NC[C@@H]2O[C@H](CC2)C3=CC=CC=C3)F)C4,74734CD5C62A19E7_0D2AFA8ECCAAC605_6041_UN,7.488595,00000000000000000000000000000000000000000010000000000000010000100000000000010000001101110011000110101100010110010010101011100100110011110110001011011001110111101111110,LRNNBRAIWSPNGH-DENIHFKCSA-N
CC1=C(C(=CC=C1)CC2=CN(C(=N)S2)CC34C(C3)CNC4)Cl,D5FC1025E2A85382_A87B7847330E51BC_6034_UN,7.4860587,00000000000000000000001000000000000010000000000100000000000000000110000000010110111101111011000010101001011110001000000111100100110101110110001011001011010110101111010,NTYXRQIFLXJETI-UHFFFAOYSA-N
O=[N](=O)C1=CC2=C(C=C1)N(C=C2)CC3=NC4=C(C=C3)OCCN4,3AC5FC8D06A1AEB7_1BEC738C3DC94B8E_6034_UN,8.859736,00000000000000000000000010000000000000100000000001000000110000010100001100010101001101000001001110101110110001010100001111101100001011010110001011111001110111110111110,VNUCFULUVYHSPW-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1CC3CN(CC2=CC=CC=C2)CCO3)C(=CC(=C4)F)F)C5,634896C5F1B60A17_007DC9CC78BB39FB_6034_UN,8.109466,00000000000000000000000000000000000000000010000000000000010000000110000000110000100101110000000110101100010101011001101011100100110010100110001011011100110111101111110,HSHODBDGPOQPPC-UHFFFAOYSA-N
C1(=C(C=CC=N1)CN2CCCC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,20ED041E7A4D4D9E_59441B43B5C21F83_6041_UN,8.66467,00000000000000000000000000000000000000100010000000000000000000100100000000010101100101110011010010101000100110010001101011100100110001110110001011011011010110101111010,XOQTYLZLEXQERV-UXHICEINSA-N
N1[C@@H]([C@H]2CC[C@@H]1C2)C3=NC=C(C=N3)N[C@H]4[C@H](CCNC4)C5=CC=C(C=C5)F,24DF9CAE0CBD2543_DA900E5DE99BC6D4_6041_DP,7.00089,00000000000000000000000000000000000000100010000000000010000000100100000000000101101100110011000010101000110100010000001011000100110101110110001001010011010010100111010,AYKVUXPCVMOTLX-CGKHISLQSA-N
C[Si](C)(C)C1=CC=C(C=C1)C=CC3=CC2=C(CCNC2)S3,97D94A05E9E03279_DE6142306BF55A9E_7019_DP,7.968482,00000000000000000000100000000010000010000000000000000000000000000000000000100000011100101001010010111100110000011000001011000100110000000110010011011101010000101111010,UUFAHPQJILYXST-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NCC2CCCN2CC3CCCCC3,F06D15A47BA7AF76_26A1EAE5E7FB6AB3_6041_UN,7.3671303,00000000000000000000100000000010000000000000000000000000000000000100000000110001001101100011010010101000000000011000001011100000110001010110011011011111010110101111010,SWKBSJKKDMXCHE-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CCC3NCCNC3)C4=CCNCC4,4BB84757E2542EE8_ED817942FA008A2F_6034_UN,8.094549,00000000000000000000000000000000000000000000000000100010000000100100000000011001101101100011000010111100110000010000001011100100110100000110001001011001010110101111010,WWIUNBBSJNMPLF-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC5CCCN(C4=C(C)C=C(C=C4)F)C5,C9C9C786AF721A43_FE24166489F30DA6_6041_DP,8.216759,00000000000000000000001000000000000000100010000000000000000000100100000000010101101101110011010010101000110110010000001011100100110101110110001011011111010010101111010,BUGCFEFQRLCXDW-CXOKAFIMSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC4(CC3=C(C=CC=C3)F)CCCCC4,D7DC9A5D277AE572_07CC771004342102_6041_UN,7.89867,00000000000000000000000000000000000000100010000000000000000000100110000000010100100101110011010010101000100110011001101011100100110001110100001011011011010110101111010,GNJNMFBYWHXDPA-NRFANRHFSA-N
CCN1CCN(CC1)C2=CC(=CN=C2)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F,36AD98A88F4EFF65_421389CA95E50D86_6041_DP,7.7999816,00000000000000000000000000000000000000000010000000000100000000100100000000010001101001110011000000101000100110010010101011100100110101110110001001011011010110101111010,DYHGZNSEYVKJQL-WMZHIEFXSA-N
O(C(CC1COCCN1)C2=CC=CS2)C4=NC3=C(C(=N[N]3C)C)C(=C4)Cl,AECC36C31134B0FE_E8C0A013B568168C_6035_UN,8.438498,00000000000000000000000000000000000010100000000000001000010000000100000000010101111100111001111111101101110101110100011011101111110010100110001101011101110111111111110,HWRJYYOSCGYVAD-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CC2CCCNC2)C=CC(=C3)C)C4,230A3CD2F2C280AE_2A4A7AD400A71D1E_6034_UN,8.533019,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101100011000010101100110010010010101011100100110000000110001011011101010110101111010,KINVCEVMYSSQQZ-UHFFFAOYSA-N
CCC4CCC1=C(C3=C([N]1CC2CCCNC2)C=CC(=C3)C)C4,230A3CD2F2C280AE_F96D4788ABA24E28_6034_DP,8.533006,00000000000000000000000000000000000000000000000000000000000000000100000000010000101101100011000010101100110010010010101011100100110000000110001011011101010110101111010,KINVCEVMYSSQQZ-UHFFFAOYSA-N
CC1=C(N=C(N=C1)NCC2(CNC2)COCC[Si](C)(C)C)C3=C(C=CC=C3)F,78B319990ADCA75A_B8E61255C06CE327_6041_DP,8.048832,00000000100100000000100001000010000000000010000000000100000000100110000000100100101000110010010001101000001101001001101011000110110111110110011011011111010111101111110,YNCNFULPJLYLDI-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NCC2N(C)CC3(CC2)CCC3,7A4807B81B779304_452BA6B698623369_6041_UN,8.052782,00000000000100000100100000000010000000000000000000000000000000000110000000110001001001100011010000101000010010011001101011100000110001010110011001011111010110101111010,AEFZQUXMGFKRAJ-UHFFFAOYSA-N
N(C1C2CCN(C1)C2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)F,21CA8CA593DE81AA_5870F1A1B24916C5_6038_UN,7.2883496,00000000000100000000000000000000000000000010000000000000000000100010000000000001100101110011100010101001110100111000011001100000110001100110001011011011011010100111110,XOYSDDLQWROFLW-UHFFFAOYSA-N
N(C1C2CCN(C1)C2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)Cl,A8CDAD23B424F71A_9795ABA9697F6FE3_6038_UN,7.2883363,00000000000100000000000000000000000000000000000000000000000000100010000000000001100101110011100010101001110100111000011001100000110001100110001011011011011010100111110,JSRUGWSZZMTGDY-UHFFFAOYSA-N
N(CC1C2CC(C1)C3CC23)C(C4=C(CCC)[N](N=C4)C5=CC(=CC=C5)F)=O,A7E0B4EA71C1FD6E_B728F13584CA9C49_6038_UN,8.435605,00000000000000000001001000000000000000000010000000001000000000100100000000010000101100010011101011001000010100110011011011101100110001110100001011011011011110101111110,GNFCQMWPBNCPOP-UHFFFAOYSA-N
CN1CCC[C@H]1C2=CN=C(C=C2)NC3(CCC3)C4=C(C=CC=N4)F,48D42537EF52E51A_DC440FDE11E9C8D7_6041_UN,7.7759585,00000000000100000000000000000000000000100010000000000000000000100110000000010101100101110011010010101000100110011001101011100100010001110100001011011011010010101111010,VTKKEGQPNULWKS-INIZCTEOSA-N
CCC2=C1[NH]C=CC1=CC(=C2)NCC(N3CC(C)OC(C3)C)C4=C(C=CC=C4F)F,F08AC0CF8E84D24A_8FDAE768C0C328F6_6041_UN,8.358711,00000000000000000000000000000000000000000010000000000000010000000100000000010001001101110011000110101100010110010011000011100100110111110110011011001111110111101111110,DKZQTLRKUHFOEW-UHFFFAOYSA-N
FC1=CC=C(C=C1)CC2=NC5=C(C(=N2)NCC3N(C)CC4(CC3)CCC4)C(=CS5)C6=CC=C(C=C6)F,4C5E046BE3200E3E_79A6FF9B13B0F113_6041_UN,8.214616,00000000000100000000000000000000000010100010000100000000000000100110000000010101111101111011010010101100010110011001101011100100110001110110001001011011010110101111010,KHXYSIFPUVVHRO-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)C[C@@H]3C[C@H](C(C)(C)C)CNC3)Cl,B812482F9350E0B2_0417C3A6C33DA9B1_6034_UN,8.7427,00000000000000000000000000000000000010000000000100000000000000000110000000110110111101111011000010101001001100001000100111100100100101110110011011001111010110101111010,FHNOZLYRCGJWCK-SJORKVTESA-N
CSCC1=C(C=CC=C1)NCC2(CCN(C)CC2)N3CCOCC3,718F68CE1C963C32_88311ED110548389_6041_UN,7.708312,00000000000000000000000000000000000000000000000000000000010000100010000000010001101001101011010100101000000001011001101011100000110011010110001011011111010111101111110,PTQCPSRDGQENPL-UHFFFAOYSA-N
CC(C)C2=C1N=C(C=C(C1=CC=C2)C)NCC3(CNC3)C4=NC=C(C=C4)F,72941BB86491719B_AEBE6A48A322AC54_6041_DP,8.238098,00000000100100000000000000000000000000100010000000000100000000100110000000100100101000110010000000101100010100001000000011000100100101110110011001000101010110101111010,CAMIWOARAVZWNW-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(C)COCCN3CC4=CC=CC=C4)C5=CCNCC5,BA7C1BC257B6C487_AB8700015B6CDE0B_6034_UN,8.261681,00000000000000000000000000000000000000000010000000100000010000100110000000011001001101110001000111111100110111011001101011100100110010100110001001011011010111101111110,YVAYOINRNQTUNJ-UHFFFAOYSA-N
FC2=C(C=C1C=NC=CC1=C2)NC3=CC=CC(=C3)CC4CCCN(C)C4,CFFDB578768EAD8C_DE21D8548DACEC07_6041_UN,7.979062,00000000000000000000000000000000000000000010000000000000000000000100000000010000000001110001010000101100010110010001101011100100110001110110001011011011010110101111010,DRPUAJOBZGMAPF-UHFFFAOYSA-N
C(CC1CC2CCC1C2)=CC3=C[N](C)N=C3C4=CC(=CC=C4)F,CAA58701A626DBA7_4C0DBC6CF880E8F9_7019_UN,7.536588,00000000000000000000000000000000000000000010000000001000000000100100000000010000100100010000011010010000010100000000001011101100110000100100001011011010000110101111010,SGLDJSULUCPQHZ-UHFFFAOYSA-N
CN5CC(C1=NN=C(C)N1CC3C[C@@H]2CCCC[C@H]2O3)C4(CNC4)C5,A11DFA358A87F466_810A5C23D40F884B_6034_UN,7.213878,00000000100100000000000000000000000000100000000000001000010000100110000000010101101101100011011110001100010010001001101011101000110010000110001010011111110111101111110,VDBQYXBGYSMQQT-ZGRYLRDCSA-N
N3CCCC1=C(C=C(S1)NCC2=CC=CC(=C2)CN(C)C)C3,0E6D23BA30320A9E_10A9BF9D62E0930B_6041_DP,6.794098,00000000000000000001000000000000000010000000000100000000000000000000000000100000011101101011010010001100110000010001001011100100110101010110001010011101010110101111010,NNRQLZSQLBTOAQ-UHFFFAOYSA-N
CN1CCNCC1C2=NC=CN2CC4(CC3CO3)CCOCC4,8E34F4CD481D1AF5_461A6942F8732962_6034_UN,7.552043,00000000000000001000001000000000000000100000000000000000010000100110000000010101101101100001010010101000100001011001101011100000110010000110001011011011110111111111110,FJRCTBBHGWSUSW-UHFFFAOYSA-N
CN3CC[C@@]2(COCC(F)C1CCOCC1)CNC[C@@H]2C3,8C4D820AC7433D70_4BF70F76CD490DD9_6039_DP,7.4599233,00000000000000000000000000000000000000000010000000000000010000000010000000010000101101100011010011101100010111011001101011100010110010100110001001011001010101111101110,NUJATEYCLBVILD-TUOGLVOQSA-N
CC1=C(C=CC(=C1)N[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)CC#N,19324DD783AEDD51_90DE46A2016323B1_6041_DP,7.436494,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000101001000100110101110110001011010011010110101111010,PTYLQQBCSYGKJM-WOJBJXKFSA-N
N(C1=CC2=C(C=C1)CCC2)C(C4=CC3=C(OCCN3C)C=C4)=O,1E5A7F0F2969EC3E_2BBFB8E34E62FA0D_6038_UN,8.690052,00000000000000000000000000000000000000000000000000000000010000000000000000010000000001100001110110101100010001110101111011100100010011010110001011011001111011111111110,NBXHRMHFKXBKLQ-UHFFFAOYSA-N
ClC1=CC=C(C=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]5[C@H]4CNC[C@H]4OC5,88D45AA019057F2E_16B24E256E18EB86_6034_UN,8.657944,00000000000000000000000000000000000000100000000000000000010000100100000000010101001101110011000111001101110101010000001011100100110110100110001010011011110111100111110,SPDDIWRAPYORAR-HTGGYDROSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2CC(CC)N3CCNCC3,021F6615C51A4C3E_B47B82EA9FC04178_6034_UN,8.1381,00000000000000000000000000000000000000000000001000000000000000000100000000010001001101110001000010101100110110010010101011100100110000100110011011011111010110101111010,CMKJTSHPPJSCCI-UHFFFAOYSA-N
COC1=C(C=CC(=C1)C(F)(F)F)NC2C3CC4CC2CC(C3)(F)C4,7A4B702EFCD0627F_0289225476978D48_7022_UN,8.23194,00000000000000000000000000000000000000000010000000000000000000000010000000000000000000010010010100000100011100001100000000000011100001110000000111000011100011101111110,ARVIIWWMXAIMDL-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=C[N]2CCC3CNC(C3)(C)C)C4CCNCC4,0E90817E54130EAC_E3611BAC708E579C_6034_DP,8.217813,00000000000000000000000000000000000000000010000000000000000000100110000000110000001101110011000010101100110110011001101011100100110100100110001001011101010110101111010,GZKCCXBVCUNWCO-UHFFFAOYSA-N
C[N]1N=C(C=C1NC2C(C)CC3=C2C=C(C=C3)F)C4CCCC4,37DF4DC247262547_66A98509AFB36600_6041_UN,7.898847,00000000000000000000000000000000000000100010000000001000000000100100000000010101100100010011011010000100010100000001001011101100010001110100001010011111000010101111010,LBSUGMFPLSSRQG-UHFFFAOYSA-N
FC2=C(C=C1C(=CN(C1=C2)CCNC(CC)C3=CC=CC=C3)C4=CCNCC4)F,E1759E8565BA4F8D_284743D95C021179_6034_UN,8.265526,00000000000000000000000000000000000000000010000000100000000000100100000000011001001101110001000010111100110110010010001011100100110100100110001011011011010110101111010,IZEVRWKHEVVLHL-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC3CCNC34CCCC4,4527468B9E85BEF2_8F7502BF27F405DE_6041_DP,7.6648827,00000000000000000000000000000000000000100000000000001110000000100110000000010101101101000011011010001000110000011000001011101100110101010100001010011111010010101111010,PTIPTRZIJLXSBP-UHFFFAOYSA-N
CC(C)C1=C(C2=C(N=C1C)C(=CC=C2)F)NCC3C5(C34CC4)CC5,87D1301777C35EFD_21BA8F7BE0121178_6041_UN,7.6848464,00000000000000000000001000000000000000000010000000000000000000000110000000100000101000010001000000101100010100001000001001000100110001110100011011010111010110101111010,NOHMSNWJMIBIII-UHFFFAOYSA-N
CC1=NC2=C(C(=C1)C)C3=C(S2)C(=O)N(C=N3)CC(N4CCNCC4)C5=CC(=CC=C5)Cl,EF4AE442736F71B1_DE1210B13C7A3835_6034_UN,8.447725,00000000000000000000000000000000000010000000000100000000000000000100000000010101111101111001100011101101110100110100011011100101110000100110001111011111011110101111110,FKEHFSHXRFDTCT-UHFFFAOYSA-N
CC1=C(C=C(C=C1)C2=NN=C[N]2C)NC3CC4(CC3)CCOCC4,D3F2DC2796DB668B_26F8CC36D235B3BF_6041_UN,7.125873,00000000000000000000000000000000000000100000000000001000010000100110000000010101100101100011011010100000110001011000001011101100110011010110001011011111010011101111110,MNCRSODBAIUXFT-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3CCN(C(CC)C)C3,F90A19C9373A12F4_8D1CC5794D106F3A_6041_UN,8.329542,00000000000000000000000000000000000000000010000000001000000000000100000000010000101101110011011010001100010110010011101011101100110001110110011000011101010110101111010,MXHUYABXIFGIMR-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C=CN=C2C#N)NC3CNCC3(C)C,E05F318E2DB4BD11_68B07C185E23688F_6041_DP,7.818904,00000000000000000000000000000000000000000100000000000110000000000110000000100001101100100011000010101100110010011001100011000100010101010110001001000111010010101111010,HCEBQVQLUQSWQA-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)C3=C(C4=C(C=C3)OCO4)F,3C70C7EC0D371B70_7F2A79A3B2AE321D_6005_DP,8.190269,00000000000000000000000000001000000000100010000000000000010000100100000010010101001101010011010010101100110111010100001011110100110000100110001011011011110011111111110,RAQRZEACMINDKA-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)NCC2(COCCNC2)F)F)C#N,5D38F935C30318FD_3417DAAD1EA8962D_6041_DP,8.065951,00000000000000000001000000000000000000000110000000000100010000000010000000000000101000110011000101001000100101011000001011000000110111110110001010010011010111101111110,SZEOSDHOOHKHOA-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)F)NC[C@H]2[C@H](CCCC2)N3CCOCC3)F,D9678207451781FE_3A1F023D0E43A461_7022_UN,8.227573,00000000000000000000000000000000000000000010000000000000010000100000000000010000101001110011000100101000000101010000001011100000110011110110001011011011010111101111110,JDNJHYBGRLUYKI-HOCLYGCPSA-N
FC1=CC2=C(C=C1)[NH]C(=C2)NCC4CC3(CCN3C)C4,A2FAD1179E763D0A_6903062961D1015D_6041_UN,8.220899,00000000100100000000000000000000000000100011000000000000000000000110000000010100001101110010010010001100010100011001101011100100110101110110001000011001010110101111010,LSXCCQYLGBZZAD-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)COC2)[S](C4=C3C=C[NH]C3=CC=C4)(=O)=O,B3928BCC5BA89A05_2EB8907FADED9431_6029_UN,8.684092,00000000000000000000000000000000110000000000000000010001011111001101010001000000010100101001001010000110011001001000010011001100011101011110001011101001010011110111110,WSISYWDINOOWDK-UHFFFAOYSA-N
C[N]1N=C(C=C1C2=NC=C(C=C2)F)NC(C)C34CC(C3)CO4,1B2DA6EDF2420ED9_247C7FBD362ADC71_6041_UN,8.069988,00000000000100000000000000000000000000100010000000001000010000100110000000010101100100010011011110100000010111001000100011101100110011110100001010001111110011101111110,XTGJAYHMJCXWIG-UHFFFAOYSA-N
C(C1(CC1)C2CCCO2)=CC3=C[N](N=C3C)C4=C(C=CC=C4)F,89577D479C38242F_F338E29DB2EC47AA_7019_UN,8.167907,00000000000000000000001000000000000000000010000000001000010000100110000000010000100100010000001010010000000101001000001011101100110011110100001010011010110011101111110,WGDPTWBVPUSHOY-UHFFFAOYSA-N
C1(=CC(=CC=C1)C2(CC2)C#N)N[C@H]3[C@H](CCNC3)C4=CC(=C(C=C4)F)F,14321E2859BE54E2_0F38BB0FF7705243_6041_DP,7.584832,00000000000000000000001000000000000000000110000000000010000000100010000000000001001000110011000000101000100100011000001001000100110101110110001011010011010010100111010,XSONBESRYOWSOT-YLJYHZDGSA-N
C(C1(CC1)C2CCCO2)=CC3=C[N](N=C3C)C4=C(C=CC=C4)Cl,5FDE35BBE753EAB2_BE8E3845B0301693_7019_UN,8.167918,00000000000000000000001000000000000000000000000000001000010000100110000000010000100100010000001010010001000101001000001011101100110011110100001010011010110011101111110,DPUUSQIHBSKNTO-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CC2(C)CC=CC2)C=CC(=C3)Cl)C4,CBA7D727796ECF22_11BA1A89112CE449_6034_UN,7.4669523,00000000000000000000000000000000000000000000000000000000000000000110000000010000001101010010000010011101110110011011001001100100110001100110001011011101010110101111010,GSQRWFDGPHAIFN-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1C)Br)N2CC3(CNCC3)C4CCOCC4,186683520ADB947B_FF16BFA49BF7B907_6034_UN,8.090228,00000000000000000000000000000000000000000000001000000000010000100110000000010000101101110011000010101100110101011000101011100100110010100110001011011111010111101111110,WSQDTBPYMZJMMG-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NCC2(CCCC2)C3=CC=NC=C3)F)CC4,F310B5B6E1754A17_DCBACDE15FF0485C_6041_UN,8.349629,00000000000000000001000000000000000000000010000000000000000000100110000000010001101001110011010010101000000110011001101011100100110001110110001011011011010110101111010,RPTSHGCAGNPVFR-UHFFFAOYSA-N
CN(CC1CNC1)C2=NC(=NC=C2)N[C@H]3C5=C(OC4(C3)CCCC4)C=CC(=C5)F,22FE205B2EDF13DC_BA927AE67569834C_6041_DP,8.0755625,00000000100100000000000001000000000000100010000000000000010000000110000000000100101001110011010011101100111110011101001011100100110111110110001011011001110111101111110,BRXHQLOTBQTEIK-GOSISDBHSA-N
CC(C)(C)C1=CN=C(O1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F,1EA755AC2E9FE1BC_6CBA69E31ABED0E9_6041_DP,8.0743885,00000000000000000000000000000000000001000010000000000100010000100110000000100100101100110011000110101000101100111000011011000100110101110110011001010111110110101111110,ZHBSTUVUYWJYBG-GOEBONIOSA-N
C1(=C(C=NC=C1)C2CC2)NC3=CC(=CC(=C3)F)N4C[C@H](C)O[C@@H](C4)C,B8BD420BA77FC256_A3D9C647159406C0_6041_UN,8.414286,00000000000000000000001000000000000000000010000000000000010000100100000000010000100001110001000100101000000110000001000011100100100011110110001011011111110011101111110,HHLHXDIPBVAGIU-OKILXGFUSA-N
C(C2CCC1(CC1)CC2)=CC3=C([N](N=C3C)CC4=C(C=CC=C4Cl)Cl)C,5C23FE985C520301_CB06DF27A0D72E41_7019_UN,8.352764,00000000000000000000001000000000000000000000000000001000000000000110000000010000100100010000001010011001010110011000101011101100110000100100001011011110010110101111010,VGZJSUXQFAMXEZ-UHFFFAOYSA-N
CC2=NC1=C(C=CC(=N1)Cl)N2CC4[C@@H]3C[C@@H](C3(C)C)CC4,A51E6D18D4D77AE1_93A7972ED516ADC8_6034_UN,8.362118,00000000000100000000000000000000000000100000000000000000000000000110000000110101100101010000000010101101010110001000101011100100110000100100011011011110010110101111010,XHIIFSZJOYUGMM-SPOOISQMSA-N
CC1=C(C=CC(=C1)NCC2C(CCC2)(F)F)OC3CCOC3,9BB066DA75803B43_2D190391F545629D_7022_UN,8.029258,00000000000000000000000000000000000000000010000000000000010000000000000010000000001100110111000010001000000101001100001000000011110011110110000110010011110111111111110,PUPCXDWQSAXCJL-UHFFFAOYSA-N
CCNC4CCC1=C(C3=C(N1CC2(C)CSC2)C=CC(=C3)Cl)C4,73C12A68C7CB6EB1_83214BE214A61B50_6034_UN,8.190682,00000000100100000000000000000000000010000000000000000000000000000110000000010000001101111010000010001101110110011011001011100100110001100110001011011101010110101111010,OXYOZTKZIUPTJK-UHFFFAOYSA-N
C1CC(=CCN1)C2=CN(C3=C2C=CC=N3)CC4(CN(C)C)CCCC4,0A4011E88B121298_A1EB3ED8B596CB06_6034_UN,7.334765,00000000000000000000000000000000000000100000000000100000000000100110000000111100101101100001010010111100110010011001001011100100110000000110001001011101010110101111010,FPWWJEGOXLBPQU-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2CC2)N[C@H]4[C@H](C3=C(C)[N](N=C3)C)OCC4,7BD5B75CD539E5E6_CCD0B99F460E781E_6041_UN,8.655767,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010011011111000000100101010000001011101100000011110100001010011111110011101111110,JQYFQEUEMPRQHT-MSOLQXFVSA-N
CC1=C(C=CC=C1F)NC3CCN(CC2CCCO2)CC3,FD124CCCBACBFE19_445623A9B380B6FD_6041_UN,8.075069,00000000000000000000000000000000000000000010000000000000010000000000000000010000100101110010000110101000100101010000001011100000110011110110001011011011110111101111110,WGOUJWOKBKJLIM-UHFFFAOYSA-N
C2(=C1C=CC=CC1=CC=C2Cl)NC3=CC=C(C=C3)N4CC5CCC(C4)O5,401D728DA56D6009_ED5B4E71741143D9_7022_UN,8.046413,00000000000000000001000000000000000000000000000000000000010000100000000000010000000101110000000110101101010100000000001011100100110011110110001011011011110011100111110,UMIYACCPMHQJMC-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NC3CCN(CC2CCCO2)CC3,9E4DC1A988D2B9DD_AA77F49BEF51D2E5_7022_UN,8.075046,00000000000000000000000000000000000000000000000000000000010000000000000000010000100101110010000110101001100101010000001011100000110011110110001011011011110111101111110,HBLAYLIVCUFRBE-UHFFFAOYSA-N
CC1=C(C=CC=C1Br)NC3CCN(CC2CCCO2)CC3,B30FA1BE1749E216_7674A687461F46D7_7022_UN,8.075044,00000000000000000000000000000000000000000000001000000000010000000000000000010000100101110010000110101000100101010000001011100000110011110110001011011011110111101111110,OOWRITQVAVGOOC-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)NC(CC)C3CCCCO3,ED327C4C99330A13_2D040CD6940A5D39_6041_UN,7.383876,00000000000000000000001000000000000000000010000000000000010000100000000000000000000000010011000100100000100111010010001000000000110011110100000011010011110111101111110,BMHJCVYRQHRRCL-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NCC34CC3(C)C4,262DC0A1F3B24BF8_EB4DC32863D7CBBA_7022_UN,8.422892,00000000000100000000001000000000000000000010000000001000000000000110000000010000101100010011001010001000010110011001100011101100110001110110001010001011010110101111010,VXWNUUDTLHYBCA-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NC3CC2(CCN(C)CC2)OC4=C3C=CC=C4)C5CC5,5399FCE00B2147DF_9AF29B291B62D8DB_6041_UN,7.614807,00000000000000000000001000000000000000000010000000000000010000100010000000010000000001110001010001101100110100011101101011100100110011110110001011011011110011101111110,AKCNSCPFPKYQMB-UHFFFAOYSA-N
C1(=CC2=C(C=C1)CC3CCC(C2)C3=O)NC(CF)C4=CC=C(C=C4)C#N,4943A098D1D8C3A8_7CD45908EDE79C17_6041_UN,8.215094,00000000000000000001000000000000000000000110000000000000000000000000000000000000000000000001000010000100110000010000001000000101110001110000001111010001111110100111110,OTSZAANKGOKCNT-UHFFFAOYSA-N
FC1=CC(=C(C(=C1)F)NC[C@@H]2OCCN(CC)[C@H]2C3=C[N](N=C3)C)F,CBAD6AC78C737DC7_524B68E1D81DC3CC_6041_UN,8.83164,00000000000000000000000000000000000000000010000000001000010000100100000000010000101101110001011110101000000111010010101011101100110011110110001011011111110111101111110,VZINHXHMETZLDJ-RDJZCZTQSA-N
FC1=CC4=C(C(=C1)NC2CCN(C)C3(C2)CC3)N=CC=C4,7C5601DCDCEBD77D_AFF894AB2AAC15C3_6041_UN,8.168378,00000000000000000000001000000000000000000010000000000000000000000110000000010001100001110011010000101100110100011001101011100100110001110100001001011001010010101111010,VNHOTNSWQJAEHZ-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C(=O)CC2)NC3=C(CSC)C=CC=C3,BDD435FDD0CFC14A_C57EFCC75B7FBCFC_6041_UN,8.480559,00000000000000000000000000000000000000000000000000000000000000000000000000000000000000101011010010000100010000000001001000000101000011010000000111010011111110101111110,BYOMQWRJXRPZMO-UHFFFAOYSA-N
C(C#CC1=C(C(=CC=C1)Cl)Cl)=CCC2(C)CCOCC2,9EB99909AFA0E265_B09CB8AABA5C6D6A_7019_UN,7.9267015,00000000000000000100000000000000000000000000000000000000010000000010000000000000000000110000000000110001000101001001101000000000110010100110000011010010010101001011110,PRQHHAUMVQSJLT-UHFFFAOYSA-N
CC1=C(C4=C(N1C[C@H]2[C@@H]3CC[C@H](C2)N3)C=CC=C4)C5=CCNCC5,D36886A63B1D1427_CEC10679750CC31B_6034_UN,8.316169,00000000000000000000000000000000000000000000000000100000000000100100000000011000101101100011000010111100110010010000101011100100110100000110001011011011010110101111010,VJKUQKHTNQITGW-SCTDSRPQSA-N
CN5CC(C1=NN=C(C)N1CCC2CCCCC23OCCO3)C4(CNC4)C5,03649B65FDA5620B_35030BFFC2338474_6034_UN,6.877061,00000000100100000000000000000000000000100000000000001000010000100110000010010101101101100011011010001000010011011001101011111000110010000110001010011111110111111111110,HKPOALJANRWUDY-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NC3C[C@H]2CCC[C@H](N2C)C3)C=CO4,B7632971F51FF641_4FACAC80E41AB27A_6041_UN,7.565982,00000000000000000000000000000000000000000010000000000000010000000000000000010000100101010001010011100100110110010000101011100100110001110100001001011001100010101111110,JALOROPSLAYIKF-AGUYFDCRSA-N
FC1=CC2=C(C=C1)SC=C2NCC3CCCN(C)C3C4=CC=CS4,1F1876515CE8CC0A_5BB70C502151704C_6041_UN,8.362196,00000000000000000000000000000000000010000010000000000000000000100000000000010000111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,NCUBDDFVFZELRI-UHFFFAOYSA-N
N(C1C4C2CC5C3CC(C1C23)C45)C(CN6C7=C(N(C)CC6)C=C(C=C7)F)=O,F251978704767BB5_2EE10FFDDEBE146C_6038_UN,8.036651,00000000000000000001000000000000000000000010000000000000000000000000000000010001000001110001110110101100110100110001111011100000110011110110001011011001011110101111110,VTCHGMVJIMEDIH-UHFFFAOYSA-N
N(CCC1CC2CCC1O2)C(C3=C(SC(=N3)C)C4=CC=C(C=C4)F)=O,1A08506D28706E9A_A5DC1E69ABFF1D6E_6038_UN,8.147676,00000000000000000000000000000000000010000010000100000000010000100100000000000001011100011001100110001000110100110000011011000100110010100100001011010011111111111111110,LPAHDZNDTUKQJU-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C#N)NCC3(C2CCNCC2)CCOCC3,F7FFE5EEBC874EE5_05736ECCA0A52A2C_6041_DP,8.047223,00000000000000000000000000000000000000000110000000000000010000100010000000000000001000110011000000101000100101011000001011000000110111110110001011010011010111100111110,BBTSOLOZCBKIHT-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2=C(C=CC=C2)F)NC[C@@H]3CCCN(C)[C@H]3C4=C[N](N=C4)C,ACFB67977E07DA91_E30CAEE054D71D2F_7022_UN,7.6955175,00000000000000000000000000000000000000000010000000001000000000100100000000010000101101110011011010101000000110010001101011101100110001110110001011011111010110101111010,MRSHUOZXHPWADQ-FDDCHVKYSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC3=CC4=C(C=C3)OCCNC4,9ACF53F48FAAF87B_15A2E02D8CEBED14_6035_UN,8.079776,00000000000000000001001000000000000000000010000000000000010000100010000000000000001010110011000101001100110101011100001011000111110110100110001111010011110101110111110,OEPRXJUDTPRGTB-UHFFFAOYSA-N
C[N]1C=CN=C1C(NC(=O)CC3C2CC4CC(C2)CC3C4)C5=CC(=C(C=C5)F)F,CEFCE2FF01BA3315_03FC551FCBC54FB2_6038_UN,8.082015,00000000000000000000000000000000000000100010000000000000000000000100000000010101000101010000110010000100110100110000010011100100110010100100001011001011001110101111110,PVGRGIDAWVRYJY-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C2CC2)N[C@@H]4C[C@@H](C3=C(C)C=CC=C3)C4,EDEFE22142AB5F1C_9CA25CD68BD9E748_6041_UN,7.8484116,00000000000100000000001000000000000000000010000000000000000000100000000000000000000000010001000000000000100110010000000000000100000001110000000011010011000010101111010,QROWEOPZYXJOIY-WKILWMFISA-N
FC1=C(C=C(C=C1)C2=CN=C(N2CC(CC)NC3=CC=CC=C3)C4CCNCC4)F,DCC66948912927F8_7DF1568E3558A08F_6034_UN,8.039522,00000000000000000000000000000000000000100010000000000000000000100100000000010101001101110001000010101000100100010010101011100100110101110110001011011011010110101111010,ZAGOMVMKGFIKGR-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC2C3=C(CCNC2)C=CC=C3,0527C387BC4EBE4E_E49B16FB325ABCC4_6041_DP,7.454773,00000000000000000001100000000010000000000000000000000010000000000000000000100001001000100001010000001100110000011000001001000100110101010110011011011101010010101111010,GWBHKXBJNKEIRP-UHFFFAOYSA-N
CN3CCN(CC1=C(C=CC=C1)NCC2C(CCCCC2)(F)F)CC3,6A62C2C82DAF8AB1_79BE7769F98A176E_7022_UN,7.6544504,00000000000000000001000000000000000000000010000000000000000000000000000000010001101001110011010000101000000100011001101011100000110001110110001011011011010110101111010,RXQDWHLBVQVZSD-UHFFFAOYSA-N
FC2=C1[NH]C=CC1=CC=C2NCC3C(N(C)CC3)C4=CC=CC=C4,5E5BF41BA662B755_FB294680C9040C8A_6041_UN,8.337655,00000000000000000000000000000000000000000010000000000100000000100100000000010000101101110011010010001100010110010001101011100100110101110110001011011011010110101111010,YUSRPVDSMZPYHE-UHFFFAOYSA-N
CCOC(OCC)C2=NC1=C(N=CC(=C1)Br)N2CC4(CC)CCN(CC3=CC=CC=C3)CC4,05CC21F75906DB4E_84B4055257B66BF5_6034_UN,8.602207,00000000000000000000000000000000000000100000001000000000000000000110000000010101100101110000000110101100010111011010101011110110110000100110011011011110010111111111110,WIORAPVEGDYIIN-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NCC3=C(C=N[N]3C)C4CCC4)F,693CCFC05C257E76_84D989167F00CF53_6041_DP,7.696138,00000000000100000000000000000000000000000010000000001000000000100100000000010001101100010011011010101100110100010000101011101100100101110110001011011011010110101111010,NNWBQHKUXSRMHM-UHFFFAOYSA-N
CC1=C(C2=C([NH]1)C=C(C=C2)NCC3CCCC(O3)C4CC4)C,745958813B5FB4AD_2D087B83BAAD9D92_6041_UN,7.8788366,00000000000000000000001000000000000000000000000000000100010000100100000000000000101100000011000110101100010000000000001011000100110111010100001011010111110111101111110,MJCONGZGPFQMHX-UHFFFAOYSA-N
N(CC1=CC=C(C=C1)F)C(C34CC(C2CNC2)(C3)C4)=O,DB29AE209416907D_97137919FBC1AC84_6038_DP,7.901898,00000000100100000000000000000000000000000010000000000000000000100010000000000000001000110011100000001000010100101000010001000000110100100110001000000001011110100111110,JPWYDVPVSKETJO-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)NC(C)CC2CCNCC2)F)C#N,9A30638FCED7AAD1_251B17A9B41A8A3C_6041_DP,8.463533,00000000000000000000000000000000000000000110000000000000000000000000000000000000001000110001000000101000100110010001001001000000110101110110001011010111010110101111010,CEXJPBNOARIDRP-UHFFFAOYSA-N
C2(=C1C=C[NH]C1=CC(=C2)C#N)NC3=CC4=C(C=C3)[S](CC4)(=O)=O,D34E9E8CC17CAD72_D5C6941649EFF380_6041_UN,8.240768,00000000000000000000000000000000000010000100000000010101001111000101000001000000110100001001000010000110010000001000001011001101001111011100001111011001010010110111110,GBGHIPOAFNYVSU-UHFFFAOYSA-N
CN(C1CCNCC1)C2=NC=C(N=C2)N[C@H]3[C@@H](C3)C4=CC(=C(C=C4)F)F,AC79F64DC237D2D0_060F949BB5683B75_6041_DP,8.490604,00000000000000000000001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010000101011100100110101110110001011011011010010101111010,INUFYTCSHWVZLU-WMLDXEAASA-N
CC1=C(C(=CC(=C1)Br)C)NCC2=NC=CN2CC3CNCCC34CN(C)C4,12A05D9316A26EAE_5ECAF7B866255449_6034_UN,8.04767,00000000100100000000000000000000000000100000001000000000000000000110000000010101101101110011010010101000110110011001001011100100110101110110011011011111010110101111010,BDDIHWYLBBCPLO-UHFFFAOYSA-N
C(C12N(CCC1)CCCC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,B50C69FC294DD75F_2731D0E34A054C44_7019_UN,8.072703,00000000000000000000000000000000000000000010000000000000000000000010000000000000000101110000010010111100010110011000101001100000110001110110001011011010010010101111010,KGUJQPSZUQAUHM-UHFFFAOYSA-N
CC(C)N1CCC(CC1)C=CC2=C[N](C)C3=C2C=C(C=C3)F,5F20E546FC955F00_151CADF8B974217C_7019_UN,8.713237,00000000000000000000000000000000000000000010000000000000000000000100000000110000000101110000010010111100010110010000101011100100110000100110011001011100010010101111010,DUTDDHCNQPMDMO-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3(CN(C)C)CCCC3)C4CCNCC4,C38E4A203063E9BC_ADDE2A8351D1F812_6034_UN,7.7451096,00000000000000000000000000000000000000000010000000000000000000100110000000110000101101110001010010101100110110011001001011100100110000100110001001011101010110101111010,VTGMAUOFOXYAGR-UHFFFAOYSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(=O)C4CC(F)(C4)C5=CC(=CC=C5)F,788253E16CEACF67_83E721207CEEF8A5_6038_UN,7.45072,00000000000100000000000000000000000000000010000000000000000000100010000000000000001000010010100010001000010100101000011000000000110000100000000001010001011110100111110,UOKCGHRYNRMXQA-UHFFFAOYSA-N
CCC4=CC1=C(C=CN(C1=O)CC2C3CCC(N2)C3)O4,8582AC54E08FBA62_C04C446254DD7231_6034_UN,8.499886,00000000000000000000000000000000000000000000000000000000010000000100000000010001000101000111100011101100110000110110011011100101110010000100001111011011111110111111110,IQDCBFUEOPYVMI-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)C=CC(=N2)NC4=C3OCCC3=CC=C4)[N](=O)=O,918F1984D5E7966B_B0FC3E99AD3854DE_6041_UN,8.388244,00000000000000000000000010000000000000100000000001000000110000010100001100000101000100000001001111100110010001000100001111101100001011010100001011111011110011111111110,BMQNYLARMUSJGN-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NCC(CN3CCCC3)C4CC4,8AE7B966C65C85E7_C5736D42E08D222C_6041_UN,8.4629755,00000000000000000000001000000000000000000010000000000000000000000100000000010000101101110011000010101100010100010000001011100100110001110110001011011011010110101111010,AKWJXXBNEPSNBR-UHFFFAOYSA-N
CC2=C1N(C=CC(C1=CC(=C2)Br)=O)CC3C4CCC#CCCC34,0C26770205F9B77F_694B4FC6AE8096A6_6034_UN,8.8757105,00000000000000000100001000000000000000000000001000000000000000000100000000010000000001010000000001101100010110000100001001100101110000100100000101011000111110101111110,JDIBURRDITVRNM-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3CC4(NCC3)CC4)Cl,537F816B52B972F3_E0C72AC621ACBBF0_6034_UN,7.096689,00000000000000000000001000000000000010000000000100000000000000000110000000010110011101011011000010101001111100011000001111100100110101110110001011011011010110101111010,WFZMWOJFWRGUCY-UHFFFAOYSA-N
C[N]1C(=CN=C1C2CCCCN2)NC3=CC=CC(=C3C)C4=NN=C5CCCCC[N]45,26778C6EEC7C1DE6_73777A6AB1FD0235_6041_DP,8.298549,00000000000000000001000000000000000000100000000000001000000000100100000000010101101101000011011010101100110010010000001011101100110101010110001011011111010010101111010,JJTGPWVCNKHAGA-UHFFFAOYSA-N
CC3=C2N=C1CCCCC1=C(C2=CC=C3)NC[C@H]4[C@H](CCNC4)C5=CC=C(C=C5)F,A766F0A5DC6A840D_A74860B47FEB1C11_6041_DP,6.9319344,00000000000000000000000000000000000000000010000000000100000000100100000000000000101000110011000000101100110100010000001011000100110101110110001011010011010110101111010,MNPGJGYIIVPMOZ-PZJWPPBQSA-N
COC1=CC2=C(C=C1)N=CC(=C2C4=C3CCCCC3=CC=C4)[N](=O)=O,E12B6FA875B7F312_D3C80627E4A4B0D0_6006_UN,7.877484,00000000000000000000000010000000000000000000000001000000100000110100001100000001000000000000011001100110010000000100001101101111111001010100001111111010100011111111110,DTCJQHIMHVTLNT-UHFFFAOYSA-N
FC1=C(C(=C(C(=C1F)F)NCC(OC)C2CCCOC2)F)F,3805136C6550463F_D411BB154C4FA586_6041_UN,8.327999,00000000000000000000000000000000000000000010000000000000010000000000000000000000001000110101010100101000000111000000101000000010110011110110000011010011110111111111110,XOEKYYDBYDEWNN-UHFFFAOYSA-N
CC(C)C1=CC(=CC=C1)NC2C3CC4CC2CC(C3)(F)C4,99F5CCE256524621_DBC51994AF48E662_7022_UN,7.380429,00000000000000000000000000000000000000000010000000000000000000000010000000100000000000010010000000000100010100001000000000000000100001110000000001000101000010101111010,JNUPIBBGBUUOMQ-UHFFFAOYSA-N
CC1=CC(=CC(=C1)F)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,852135C5B4C4BDD0_BB7CF46EFBBBA1B8_6041_DP,8.009781,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001111010110101111010,COGQZFRLSLEHID-SWLSCSKDSA-N
O(C1CCCC2=C1C=C[NH]2)CC3=CC4=C(C=C3)NC(=O)O4,72C3543CA94ACC72_A8951D74425BBD47_6039_UN,9.339088,00000000000000000000000100000000000000000000000000000000010000000100000000000000000100000011000111000100111001110100011011010111110110000100001111110001111111010111110,KUOHBLQPLDZHAY-UHFFFAOYSA-N
C[N]1N=C(N=C1N[C@H]2[C@@H](C2)C3=CC(=CC=C3)F)C4CCOCC4,7849374295D6441B_2B8812981AA0AD12_6041_UN,7.74846,00000000000000000000001001000000000000100010000000001000010000100100000000010101100100110010011010100000101101010000001011101100110011110110001011011011010011101111110,PIXCITUQEDWNFU-LSDHHAIUSA-N
C1(=NC2=C(C=C1)C=CC3=C2N=CC=C3)NC5CCC(C4=NC(=NO4)CC)C5,6E9B51D4A7948CD9_54EE657FA8092D29_6041_UN,8.476918,00000000000000000000000000000000000000100000000000000000010000100100000100000101000100000011101111100110110000110010011011001100010001010100001001010001000110101111110,HWLHKFJTAQCTLG-UHFFFAOYSA-N
C[Si](C)(C)C1=C(C=CC=N1)NC3CCC2(CCCN2)C3,D0E915E4457BF988_6492E63F0A205BC7_6041_DP,7.8482194,00000000000000000000100000000010000000000000000000000100000000000110000000100001101100100011010010101000110000011000001011000000110101010100011010011111010010101111010,DFWLJOTWKKJFSW-UHFFFAOYSA-N
C1(=CC=C(O1)C2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)F)F,EC26DDD53548D81B_06D56047A5EF2DCB_7022_UN,8.791986,00000000000000000000001000000000000000000010000000000000010000100000000000010001100101110011110010001000100110110001111011100100000001110100001010011011110010101111110,VCKDYFRDGDQQLO-QAPCUYQASA-N
FC1=C(C2=C(C=C1)SC=C2)NCC4OC3(CCC(C)(CC3)C)CC4,8E4827E6006A3D5E_A2512BB5AC8F284D_6041_UN,7.7452455,00000000000000000000000000000000000010000010000000000000010000000010000000100000011100011011000110001100010100001001101010000100110011110100000011010111110111101111110,BKHLTYJKIALDMQ-UHFFFAOYSA-N
C1(=CC=C(O1)C2CC2)N[C@@H]3CCN(C)[C@H]3C4=CC(=C(C=C4)Cl)F,850B602E5E7E5F8D_45B9523907CC11E6_7022_UN,8.791984,00000000000000000000001000000000000000000010000000000000010000100000000000010001100101110011110010001001100110110001111011100100000001110100001010011011110010101111110,RJGWUMFZIVFRPK-QAPCUYQASA-N
CN(C1CCNCC1)C2=NC(=CN=C2)N[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,929D8690E5A9588E_50F0B55696D2D794_6041_DP,8.445787,00000000000000000000001000000000000000100010000000000000000000100100000000000101101001110011010000101000100110010000101011100100110101110110001011011011010010101111010,GAMSAPCCXIMGKQ-CZUORRHYSA-N
FC1=CC(=CC(=C1)F)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C,E211FE38B9F50A64_972C894FA9EA30CE_6041_UN,8.31479,00000000000000000000000000000000000000000010000000000000000000100100000000010101101101110011010010101000000110010001101011100100110001110110001011011111010110101111010,CRVWMIOPISOBCA-YVEFUNNKSA-N
CN(C)CC1=C(C=CC(=C1)NCC2(COCCNC2)F)F,2E4964CC5AEE5AF3_1DBDA9A10E7935CD_7022_DP,7.0926895,00000000000000000001000000000000000000000010000000000100010000000010000000100000101001110011010101001000100101011001001011100000110111110110001010011111010111101111110,UMRGVJGCQSJNDZ-UHFFFAOYSA-N
CC5(C)CCC1=C(C4=C(N1C[C@@H]3C[C@H](NCC2=CC=CS2)C=C3)C(=CC(=C4)F)F)C5,995376A7A4BF8BF9_63ECED7A9FDB6E1B_6034_UN,7.9182224,00000000000000000000000000000000000010000010000000000000000000000110000000110000011101011001000010011100110100011001101011100100110001100110001011011101010110101111010,LNJJYCRTWYBDKK-FUHWJXTLSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4(CCCC4)C5=C(C(=CC=C5)F)F,9D03D0D1D0AD56EA_94C26E564A79F066_6041_DP,7.9816504,00000000000000000001000001000000000000100010000000000000000000100110000000000100100101010011010010100000111100011000101011100100110101110100001011011011000010101111010,RCXDIJYXXAPQNM-BJWYYQGGSA-N
FC1=C(C(=CC=C1)C2CC2)NC(CC)C3COCCO3,52F4AC7A46850F96_1CC3988B1CD433B0_6041_UN,7.4876804,00000000000000000000001000000000000000000010000000000000010000100000000010000000000000110011000101100000100111010010001010000000110011110110000011010011110111111111110,KHIYMLNBQWWVKI-UHFFFAOYSA-N
O[C@H](CCl)C1=CC=C(C=C1)NC24CC(OC23CCNCC3)(C)C4,8CB3992AE7FE9729_88682B55CE0F821F_6041_DP,8.662545,00000000000100000000000000000000000000000000000000000000010000000010000000000000001100100011000111101001110010011001001011000000110111110111001001010001110111111111110,YUNPRRIUJGTWAN-KLAILNCOSA-N
N(CCN1CC2C(C1)C3CCC2C=C3)C(C4=C(C)C5=C([NH]4)C=CC(=C5)F)=O,6B00748BB62303F2_730143DC4A2C2BFA_6038_UN,8.101534,00000000000000000000000000000000000000000010000000000010000000000100000000010001001101110001100110011100110100110000011011100100110100100110001011011011011110101111110,BUVZXKZDAGCBFD-UHFFFAOYSA-N
C1(=CC2=C(C=C1)[NH]C3=C2CCCCCC3)NC4=CC(=C(CN(C)C)C=C4)F,447229F09951DC11_47A81F3BB533DAB1_6041_UN,7.597989,00000000000000000000000000000000000000000010000000000000000000000100000000100000000101110011010010001100110100010001001001100100110101110100001011011111010110101111010,XLUCMYGHANXQEJ-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C=CN(C2=O)CC45OC3(CNC3)C(C4)(N)C5,1106CDC172B7F1F6_E955B227C4D09DCF_6034_DP,8.204473,00000000100100000000000000000000000000000010000000000100010000000110000000010000101111110011100111101100110100111100010011100101110111100110001111001011111111110111110,GVVDJJJRJSFABQ-UHFFFAOYSA-N
O(C(=O)C1=C[NH]C2=C1C=C(C(=C2)Br)Br)CC3CC4CCC3CC4,A1578224F666E01D_C5C43916F23A74AD_6031_UN,7.9724236,00000000000000000000000000000000000000000000001000000000000000000100000000000000000100010000000011000100010101000000001001010110110000100100000011010011011111010111110,IVIGDZMIMUJKNG-UHFFFAOYSA-N
N1CC2CCCC1C2C=CC3=C(C)[N](C(=C3)C)C4=CC=C(C=C4)F,8E3DDA0F4F40D1F9_F3206705E7A3E403_7019_DP,7.8763742,00000000000000000001000000000000000000000010000000000000000000100100000000010000001101010011000010011000110100010000001011100100110001110100001011011111010010101111010,UPERKXMLOLRTTR-UHFFFAOYSA-N
N1CC2CCCC1C2C=CC3=C(C)[N](C(=C3)C)C4=CC=C(C=C4)Cl,A42E66B59F13DC87_C9091080239CFA60_7019_DP,7.876369,00000000000000000001000000000000000000000000000000000000000000100100000000010000001101010011000010011001110100010000001011100100110001110100001011011111010010101111010,QASWZTMCXDLKID-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=C3)NC4(CCCC4)CC5=C(C=C(C=C5)F)F,1D98A8933212B261_18C5EE5ABE659305_6041_DP,7.9409876,00000000000000000001000001000000000000100010000000000000000000000110000000000100100101010011010010100000111100011000101011100100110101110100001011011011000110101111010,YZJMWCBPYQNSNH-ACDBMABISA-N
C(C1=NC=C(O1)C2CCOCC2)=CC4=C(N(C)C3CCCC3)C=CC(=C4)F,E153284D7C1726EA_1D498EB1CE26FB55_7019_UN,8.031975,00000000000000000000000000000000000000000010000000000000010000100100000000000000000101110000110110110000000111110000111011100100110011110110001011011010110011111111110,DYNMZEVHZHYYOS-UHFFFAOYSA-N
FC1=CC4=C(C(=C1)NC[C@@H]2CCCN(C)[C@H]2C3=C[N](N=C3)C)C=NC=C4,37E5F9401447881C_99CB458AE6FBEA30_6041_UN,8.450228,00000000000000000000000000000000000000000010000000001000000000100100000000010000101101110011011010101100010110010001101011101100110001110110001001011111010110101111010,GVFKFHMFOCAMHU-MGPUTAFESA-N
CC1(C)O[C@@H]2CC[C@H]1C[C@H]2OC3=C(C(=CC=C3)C4=CN=CC=C4)F,9B42EACB11B88D59_845EB47A8A66ABCF_6035_UN,7.8879232,00000000000000000000000000000000000000000010000000000000010000100110000010100000000000010000000000100000010110001100101011000111110010100100000111010110100001011111110,XWCORQQJTFRNFE-YXJHDRRASA-N
CC1=C(C(=CC(=C1)F)NC[C@H]2CNCC(O2)(C)C)C#N,AAA60FDB6F817AAE_5CD517CA67E94A83_6041_DP,7.632997,00000000000000000000000000000000000000000110000000000100010000000010000000100000101000110010000100101000000110001001000011000000100111110110011011000111110111101111110,ZSRQFVKHXMFBDG-GFCCVEGCSA-N
CC2=C1N=CC(=C(C1=CC(=C2)F)NC[C@H]3[C@H](CCNC3)C4=CC=C(C=C4)F)C#N,E7711F897FFDAD77_0AC541E52CA434C9_6041_DP,6.943622,00000000000000000000000000000000000000000110000000000100000000100100000000000000101000110011000000101100110100010000001011000100110101110110001011010011010110101111010,RCTYZLSNWPOPMQ-FXAWDEMLSA-N
N(CC1=COC(=N1)C2=CC=CS2)C(C45CC3(CC(CC(C)(C3)C4)C5)F)=O,25D6E9936D8AB802_3830ECC5E61F06FD_6038_UN,7.9400687,00000000000000000000000000000000000010000010000000000000010000100110000000000001011100011010100111001100010110111001010011000100100000100100001001000001011110111111110,ONTCLHFPPBOVCD-UHFFFAOYSA-N
FC2=C1CCCC1=CC(=C2)NC(CC)CC3=C[N](C)C4=C3C=CC=C4,D7152E97D7C110F1_47C92B4316232707_6041_UN,7.6885176,00000000000000000000000000000000000000000010000000000000000000000100000000010000000101010001010010000100110110010010101001100100010001110100001011011101000110101111010,RXDTXFTURLFOBJ-UHFFFAOYSA-N
C2(=C1CCCCC1=CN=C2)NC3=CC=CC(=C3)CN(C)C,3F932537F2161840_7F67271CD19B543B_6041_UN,7.443692,00000000000000000000000000000000000000000000000000000000000000000100000000100001000001100011010000101100010000000001001001100100110001010100001011011101010110101111010,DYQMMDJLUDOVRK-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC(C)CC3CCCCN3C)F,165E7B04A52610B3_491175CF578B39D9_6041_DP,7.2029333,00000000000000000000000000000000000000000010000000000000000000000000000000010000101001110011010000101100110110010001101011100000110101110110001011011111010110101111010,KJFXZVNTLVLOEC-UHFFFAOYSA-N
C1CNC(C1)C2=CC=CN2CC(CN)CC3=C(C=CC=C3F)Cl,D075FCA653D01039_2C208BD03CCEB23D_6034_UN,8.44264,00000000000000000000000000000000000000000010000000000000000000100100000000010001101111010011000010001001100100010000001011100100110100100110001010011011010110100111010,HDSNBDMEIKCYSX-UHFFFAOYSA-N
CC1=NC2=C(C=C1)C=CC(=C2F)NC3C4CC(C3)C(C4)F,2CE9F2812FAB5C2E_AA785773479EC6BA_6041_UN,9.259392,00000000000000000000000000000000000000000010000000000000000000000100000000000000100000010011000010100100110100010000000001000100110001110100001011000011000010101111010,WVNIVHWIORGQQN-UHFFFAOYSA-N
NCCCC(OC1=CC(=CC=C1)CNC2CC2)C3=CC=C(C=C3)F,C4ECD2B311A7A0B4_889B9ED421563C58_6035_UN,8.281818,00000000000000000000001000000000000000000010000000000000000000000000000000000000001010010010000000001000100100010100001000000111110111100010001101010001110111100111110,MSGVFYVGTYDEBV-UHFFFAOYSA-N
CC2=CC1=C(C=C(C=C1C)Br)[N]2CCC3CNC(C3)(C)C,83AC35B3539258FB_A05953F62CB45421_6034_DP,8.28664,00000000000000000000000000000000000000000000001000000000000000000110000000110000001101010011000010001100110110011001101011100100010000100110011010011111010110101111010,JCTYQWLTVHPEIK-UHFFFAOYSA-N
C1(=C(C=CC=C1Cl)Cl)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C,CCBAF7CC004596A2_49B800E73314C6EF_7022_UN,8.188972,00000000000000000000000000000000000000000000000000000000000000100100000000010101101101110011010010101001000110010001101011100100110001110110001011011111010110101111010,RPIXWVWBXZIYNA-YVEFUNNKSA-N
C1(=C(C=CC=C1F)F)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C,C1C965D0DD22DBE5_A2EED2F7D1BB4414_7022_UN,8.188947,00000000000000000000000000000000000000000010000000000000000000100100000000010101101101110011010010101000000110010001101011100100110001110110001011011111010110101111010,QSPIEBAIMBADNQ-YVEFUNNKSA-N
CC1=C(C=C(C=C1)C2=N[N](C=N2)C)NC3CNCC4(C3)CC4,23B02207AAA9B54C_26D838B4F7809B1F_6041_DP,8.1117115,00000000000000000000001000000000000000100000000000001010000000100110000000010101101100100011011010101000110000011000000011101100110101010110001011011111010010101111010,SYRFBAIPSXEYFM-UHFFFAOYSA-N
C1(=C(C=CC=C1F)Br)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C,D36749F571632667_6AEBC6976A01C991_7022_UN,8.188962,00000000000000000000000000000000000000000010001000000000000000100100000000010101101101110011010010101000000110010001101011100100110001110110001011011111010110101111010,ZLIHDALXRVCOSE-YVEFUNNKSA-N
C1(=C(C=CC=C1F)Cl)NC[C@@H]2CCCN(C)[C@H]2C3=CN=C[N]3C,556BAC2E9F97E4CD_FB9C7924183E8172_7022_UN,8.188959,00000000000000000000000000000000000000000010000000000000000000100100000000010101101101110011010010101001000110010001101011100100110001110110001011011111010110101111010,ZNZREKHNLLYLLZ-YVEFUNNKSA-N
CC1=C(C(=CC(=C1)F)F)NC[C@@H]2CNC[C@H]2C3=CN=C[N]3C,D3E669A9481B9A63_04554D223C5BFF8A_6041_DP,8.767068,00000000000000000000000000000000000000000010000000000100000000100100000000010101101101110011010010001000000110000000000011100100110101110110001010001111010110101111010,MJNGVUSMEBEGIK-WCQYABFASA-N
CC2=NC1=NC=CC(=C1C(=C2CCN3CCSC(C)(C)C3)C4=C(C=CC=C4)F)C,0FD2F7F884DBDA19_7EE4B0CF4F45EE19_2201_UN,8.713505,00000000000000000000000000000000000010100010000000000000000000100110000000110100010001111000000000101100010110011001101011100100110000100110011011011110010110101111010,NVUTWFXIWKDPLD-UHFFFAOYSA-N
C1(=CC(=C(C=C1)C[N]2C=CC=N2)F)NC4CC(C3=CC=N[N]3C)OCC4,94325E779488BBEB_080B653201DC5B8C_7022_UN,8.028553,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010010011111101000100111010000001011101100111011110110001011011011110111101111110,OVLBFWRKJCFQBV-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NC3CC(OCC3)C4=CC=CS4,9A7625479AD0021A_541A216D082C6E99_6041_UN,7.776181,00000000000000000000000000000000000010100000000000000000010000100100000000000100010100001010000011100100110001010000001011000100110011010100011011010111110011101111110,SHNVHJHFCKTXMI-UHFFFAOYSA-N
SC1=C(C=C(C=C1)C#N)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F,3A5EC155D23D781B_69E29C5C38F50F44_6041_DP,7.8514347,00000000000000000000000000000000000000000110000000000010000100101000000000000001011000111011000000101000100100010000001001000100110101110110001011010011010010100111010,QKBPGPNYVAREOG-CXAGYDPISA-N
N(CC1=C2C(=CC(=C1)F)COCO2)C(C3CC4CNC3C=C4)=O,26A868AABBD8875E_DE0AB0EDFF921FD3_6038_DP,7.385379,00000000000000000000000000001000000000000010000000000100010000000000000000000000101000110110100001111100010101100100010011010000100100100110001011100001111111110111110,CNANZFIRASNOIP-UHFFFAOYSA-N
CC3=C(C1=C(SC2=C1CCN(C)C2)N=C3[C@@H]4CCCN4)C5=CC=C(C=C5)C,FA4B563CA4254F51_68FA63DAD7CCCDD3_2201_DP,7.656491,00000000000000000000000000000000000010000000000100000000000000100100000000010001011101101011010010101100110010010001101011100100110000000110011011011111010010101111010,RUVUDRTVUMOVHJ-SFHVURJKSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)NC4(CC4CC)C5=CC(=CC=C5)C)F,41C5E282AA840F25_41CB575484870A91_6041_UN,7.4156394,00000000000000000000001000000000000000000010000000000000000000100110000000000000100000010011000000100100110100011010101001000100110001110100011011010111000110101111010,FNLWDRCXOIAKJW-UHFFFAOYSA-N
FC2=C1C(=C[NH]C1=CC=C2)NC4CC(C3=NC=C[N]3C)OCC4,953580325C49762A_F11018D051853341_6041_UN,7.8299303,00000000000000000000000000000000000000100010000000000110010000100100000000010101100101010010010111100100110111010000001011100100110111110100001011011011110011101111110,CARGYPQLKUSJAO-UHFFFAOYSA-N
NCC1(C(C1)C2=CC=C(C=C2)F)COC3=C(C=CC(=C3)C4CNCCC4)F,33910D767D900DB4_93E496FEB7C65499_6035_UN,8.085585,00000000000000000000001000000000000000000010000000000000000000100010000000000000001010110011000001101000100101011100001001000111110100100110001111010011110101100111110,QAPANCFPYAWEPD-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NCC2N(C)CC3(CC2)CCC3,F7080056B1E0ECF6_029890FCDFB11FB9_6041_UN,7.6430435,00000000000100000000100000000010000000000000000000000000000000000010000000110001001001100011010000101000010010011001101001100000110001010110011001011111010110101111010,VZUAKNMDOZEUMX-UHFFFAOYSA-N
CCC4CCC1=C(C3=C(N1CCN2CCC(C)CC2)C=CC(=C3)C)C4,5E3AF4DF164F3551_9BFC6E3113FEF1CD_6034_UN,8.151011,00000000000000000000000000000000000000000000000000000000000000000100000000010001000101100000000010101100010010010011101011100100110000000110011011011100010110101111010,KNZBOHGIROEJCG-UHFFFAOYSA-N
CN(C1CCCCC1)C2=NC(=NC=C2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,94BFAF8F8BADC453_EDD50E4C0BDADAF9_6041_UN,7.885185,00000000000000000000001001000000000000100010000000000000000000100100000000000100101001010011010000101000001110010000101011100100110001110100001011011011010110101111010,ZMQFWLBTPIOQMX-GOEBONIOSA-N
N1CC2COCC(C1)C2NC(=O)CC3=C[NH]C4=C3C=C(C=C4)F,9DF9179F7BDEF08F_3C440F84C3D10FFF_6038_DP,7.2924547,00000000000000000000000000000000000000000010000000000100010000000100000000000000101100110011100011101100110101110000010011000100100111100110001001000001011111110111110,WGWJISWSLCJNCS-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NC4=NC2=C(CC3(CC2)CCCCC3)S4,36509C2F69A85952_D34C5D706D847FBB_7022_UN,7.266078,00000000000000000000100000000010000010000000000100000000000000000110000000100100010100101001010010000100011000011000001011000100110001010100011011011101000010101111010,IHHTZGDGMJCTTN-UHFFFAOYSA-N
FC2=CC(=C1CCCC1=C2)N[C@H]4[C@H](C3=C(C)[N](N=C3)C)OCC4,3ED5C9C26F676A94_ECEDB90B48F0A4E9_6041_UN,7.865179,00000000000000000000000000000000000000000010000000001000010000100100000000010000100100010011011111000100110101010000001011101100010011110100001010011111110011101111110,XFVGNOABPSDNTD-AEFFLSMTSA-N
N(CCC1CC2CCC1O2)C(C3=CC=C(CSC)C=C3)=O,C0925EAEE07F85A1_BB43E47B139D7A1B_6038_UN,8.411549,00000000000000000000000000000000000000000000000000000000010000000000000000000000001100101001110010001000110000110001011000000000110010000110000001010001111111111111110,YSLWTGXVAFMIDJ-UHFFFAOYSA-N
O(C1CCCOC2=C1C=CC=C2F)C3=C(C4=C(C=C3)[NH]C=C4)[N](=O)=O,C039C9D0E768A706_A057992AE76BDB57_6035_UN,8.502083,00000000000000000001000010000000000000000010000001000000110000010100001100000000100100010100001110000110010101000100001111101111001011110100101111111011110011110111110,YTPNVXURINYCLU-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NC3C(CCC(C)C)CCC3,6FF4D993EF1B0E26_EBD3861F1590B671_6041_UN,8.44133,00000000000000000000000000000000000000000010000000001000000000000100000000110000100100010011011010000100110100010001101011101100110001110100011000011111000110101111010,HZEBYKPQSBULFS-UHFFFAOYSA-N
C[N]1N=CC=C1C2=C(C=C(C=C2)NC(=O)CC3CC4CC3C5CC45)F,E0B2D8DECE750981_DE565834F619C978_6038_UN,8.105929,00000000000000000001001000000000000000000010000000001000000000100100000000010000100100010001111010000000110100110000010011101100110011110100001011001011001110101111110,SUYCGHDMPGGAEV-UHFFFAOYSA-N
CN4CCC1=C(C3=C(N1CC2(C)CCCCC2)C=CC(=C3)Cl)C4,A9716DF636DF0725_2CDB76EC1CF28174_6034_UN,7.3496056,00000000000000000000000000000000000000000000000000000000000000000110000000010000100101110000010010101101010110011001101011100100110000100110001011011100010110101111010,LMIRXNJSDYIAEA-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC=C(N=C3)NC4(CCCCC4)CC5=C(C=C(C=C5)F)F,C167679DBB5ECB6A_EB3772E285111231_6041_DP,8.008333,00000000000000000001000000000000000000100010000000000000000000000110000000000101100101010011010010100000110100011000101011100100110101110100001011011011000110101111010,TYPYXFPHAOVDIN-WKCHPHFGSA-N
FC1=CC4=C(C(=C1)C=CC2=C(C)N=C(S2)N3CCCCC3)OCOC4,011387460DADEB6C_E5947BDC3727C6B2_7019_UN,7.9415884,00000000000000000000000000001000000010000010000100000000010000100100000000010100010101111100000010111100011101010100001011110100110001110110001011011010110011111111110,BWTWHHLXWSVSDY-UHFFFAOYSA-N
CCC5CCC1=C(C4=C(N1C[C@H]2[C@@H](CNC2)C3=CC=C(C=C3)Cl)C=CC(=C4)C)C5,1B260F875B501A3F_02272CEFD77259AF_6034_UN,8.186755,00000000000000000000000000000000000000000000000000000000000000100100000000010000101101110011000010001101010110010010101011100100110000100110001011011111010110101111010,XTNIUGFZCRIYDU-LNZZOJCLSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=CC(=CC(=C1)Br)Br)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,C1244E624439A169_EB08C14CA2BDCB12_6035_UN,8.90693,00000000000000000000000000100000000000000000001000100000000000100110000000001000000000010000000010110100010110001101101001000111110010100100000101010110100001001111110,FWERQEVYZVEAIR-SKNCEXACSA-N
CC1=C(C=C(C(=C1)NCC2OC(CC2)C3CC3)F)[N]4C=CC=C4,73CA1211F9B5CE7E_387238DB88AD25F6_6041_UN,7.9944963,00000000000000000000001000000000000000000010000000000000010000100100000000010000001101010011000110001000000100000000001011100100110011110100001010011011110111101111110,QZKSEZNMKISSAR-UHFFFAOYSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=CC(=CC(=C1)I)I)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,39B7E9D4B3860F62_4382CC2326D1BFE3_6035_UN,8.906927,00000000000000000000000000110000000000000000000000100000000000100110000000001000000000010000000010110100010110001101101001000111110010100100000101010110100001001111110,HGNIAYPISBDPMT-SKNCEXACSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=CC(=CC(=C1)Cl)Br)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,0ECD8614A8F82CBE_0FD23A3784D6C1BC_6035_UN,8.90692,00000000000000000000000000100000000000000000001000100000000000100110000000001000000000010000000010110101010110001101101001000111110010100100000101010110100001001111110,GASRTUAFZUUKAW-SKNCEXACSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=CC(=CC(=C1)F)Br)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,748E1ECA71B162BE_9D5B314B4C0978CD_6035_UN,8.90691,00000000000000000000000000100000000000000010001000100000000000100110000000001000000000010000000010110100010110001101101001000111110010100100000101010110100001001111110,YREBDHHKGBLMAC-SKNCEXACSA-N
FC1=CC(=C(C=C1)NCCN(C)CC2COCCC2)C3CC3,44D57364D12A8616_3CB0F0B9ACCA8BF6_6041_UN,7.5384493,00000000000000000000001000000000000000000010000000000000010000100000000000000001001001110001010001101000100111010001101000100000110011110110001011011011010111101111110,CLTPDBCWTXLRAM-UHFFFAOYSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=CC(=CC(=C1)F)I)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,F612974B67019DC4_2D5C9B6BADB9E65B_6035_UN,8.906908,00000000000000000000000000110000000000000010000000100000000000100110000000001000000000010000000010110100010110001101101001000111110010100100000101010110100001001111110,RUNOXHGLGNSZSY-SKNCEXACSA-N
FC2=C(C=C1C=COC1=C2)NCCC3CCCN(C)C3,E3DBC776133D0926_16DDA296B18ECDE7_6041_UN,7.8910995,00000000000000000000000000000000000000000010000000000000010000000000000000010000001101110001010010101100110110010001101011100100110001110110001011011011110110101111110,OIXGHZNURZVVAC-UHFFFAOYSA-N
CN(CC1CCNCC1)C2=NC(=NC=C2)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,0FBFDAE9F64935C8_817CDD6FBED04EE5_6041_DP,7.829604,00000000000000000000000001000000000000100010000000000000010000100100000000000100101101110011010011101000101111010001001011100100110111110110001001011011110111101111110,KZPDHGZOYKQYTA-RXVVDRJESA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC4=C(CN(C)C3CCCCC3)C=CC=C4,F991E3B029C196E0_F1E3BAECBC05EC59_6041_UN,7.7650356,00000000000000000000000000000000000000100010000000000000000000000100000000000100100001110010010000101100010110010001101001100100110001110100011011011111010110101111010,DJPPCAAWHXNFJX-UHFFFAOYSA-N
CC1(C)CCCCC1C=CC2=C[N](C)C3=C2C=C(C=C3)F,CB421444E30DB270_34723952AF0B57A4_7019_UN,7.701765,00000000000000000000000000000000000000000010000000000000000000000110000000110000000101010000010010010100010110001001101001100100110000100100010001011110000010101111010,JUSGXVPHYJTHBI-UHFFFAOYSA-N
CC4CC1=C(C(=CC(=C1)CC#N)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)O4,7E8717C82E6DF6A7_98B1ACCF5DCE541C_6041_DP,7.6006546,00000000000000000000000000000000000000000110000000000010010000100000000000000001001100110011000110101100110100010101001011000100110111110110001011010011110111101111110,VABOUCLWZDYIGV-XBDPRNKDSA-N
N(CC1CC2CCC(C1)S2)C(=O)C3=C[NH]C4=C3C=C(C=C4)F,6D36FC649042B6CF_B04DCE3103200FB2_6038_UN,7.48949,00000000000000000001000000000000000010000010000000000100000000000100000000000000111100011010100011101100010100100000011011000100110100100100001001010001011110100111110,FKOVECVIIMKQLY-UHFFFAOYSA-N
C(CCOC1CCCCO1)=CC(C)(C)N2CCOCC2,44D5D3FAD2CD7D0F_BB6C246A3E35D745_7019_UN,7.9950657,00000000000000000000000000000000000000000000000000000000010000000010000000110000000001100000000100111000000011011000101011110011110010000110000101111100010111111101110,BRMRCRSGBZMGNP-UHFFFAOYSA-N
C1(=C(C=C(C=C1)C2=CC=CC=C2)F)NC[C@@H]3CCCN(C)[C@H]3C4=CN=C[N]4C,3B170999A7394B3E_80AFF890068A581F_7022_UN,7.5365524,00000000000000000000000000000000000000000010000000000000000000100100000000010101101101110011010010101000000110010001101011100100110001110110001011011111010110101111010,ZODJIOMWURDZSK-WMZHIEFXSA-N
O(CC2CN(CC1=CC=CC=C1)CC23CCC3)CC4CNC(CO4)(C)C,88DBE60C83183C5C_F720006F7ADD0A9B_6039_DP,7.848932,00000000000100000000000000000000000000000000000000000000010000000010000010110000001101100011000111101000110001011001101011100010110010000110001001011101110111111111110,GGHDBRICEHTMMM-UHFFFAOYSA-N
CC(OCC2COC1(CCOCC1)O2)CC(C)CCC=C,A93AD98CCEC2BB46_0764AA576A3F608A_6039_UN,7.7524586,00000000000000000000000000000000001000000000000000000000010000000000000010000000000100100100000010110000010011001001101010010010110010000110100000110100110101011001110,DHOROPZEYGQETA-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2C[C@H]3[C@@H](CNC3)C4=CC=CC=C4)C5CCNCC5,3BDF5F54E9E79778_8EAD439C4B4A0D72_6034_UN,8.835337,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011000010101100110100010000001011100100110100100110001001011011010110100111010,LVXVLFQUWQJBLD-UGKGYDQZSA-N
N(CC1CC2CCC(C1)S2)C(=O)C3(CCCC3)C4=CC(=CC(=C4)F)F,416D26D83B0CB9DF_C246D000B2897DD5_6038_UN,7.233985,00000000000000000001000000000000000010000010000000000000000000100010000000000000011100011011100010101000010100101000011000000000110000100100000001010001011110100111110,CBBPHXBFLPBCFX-UHFFFAOYSA-N
FC1=C(C=C(C=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)CC#N,EB0BD1A42F1E2152_BDBA86524BFA173D_6041_DP,7.32371,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110100111010,DQYVSWDTMCOBPH-QFBILLFUSA-N
N(CC1CC2CCC(C1)O2)C(C3=C(C)C=C(N=C3)F)=O,CEE37156B93E481C_BFB163A7F3C3AB4F_6038_UN,8.002611,00000000000000000001000000000000000000000010000000000000010000000100000000000000101100010010100011101000010100100000011011000000110010100100001011010011111111111111110,DQGHDTGLYMZBJA-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCSC3=CC(=C(C=C3)F)F,70F642D15B5C196C_F6E0B1C38FA82BD4_6038_UN,7.8659945,00000000000000000000000000000000000000000010000000000000000100001000000000000000011000011011100000011000110100110000011000000000110010100010000011010011011110100111110,ILYGXMXZNQGCHA-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NC2C3(CCNC2)CCOCC3)F,2272D0929BB8E7CB_FACA24ABC62F9540_7022_DP,7.3005486,00000000000000000000000000000000000000000010000000000010010000000010000000100001001001110011010000101000110101011001001011100000110111110110001011011111010111101111110,DUKSUMNTMBRMHZ-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCCC3=C2N=C(C)S3)Cl)C4CC4,6687609725C094FB_815E8B88AE0465BA_7022_UN,7.5072174,00000000000000000000001000000000000010000000000100000000000000100100000000000000111100011011000010001101010110000000001011000100110001110100001011010111010110101111010,HLNQAORBXYWCPV-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=CC(=CN=C1)NCC2N(C)CC3(CC2)CC3,98DCC88CEBB0F6C1_E2E0CC40634D3A18_6041_UN,8.098943,00000000000000000100101000000010000000000000000000000000000000000110000000110001001001100011010000101000010010011001101011100000110001010110011001011111010110101111010,UNXBYAOLRWEADZ-UHFFFAOYSA-N
FC1=CC=C(C=C1)C2=CSC(=N2)NC[C@@H]3OCCN(C)[C@H]3C4=C[N](N=C4)C,E49853BBE71103C7_CCA4B2C66982932E_6041_UN,8.598488,00000000000000000000000000000000000010000010000100001000010000100100000000010100111101111001011110101000001111010001101011101100110011110110001001011111110111101111110,DGAVTCXFHKEBEU-ROUUACIJSA-N
FC1=CC(=CC=C1)CC2=CN(C=N2)CC4[C@@H]3C[C@@H](C3(C)C)CC4,C8F63412EEAF84E6_6B72837DB6F1EF35_6034_UN,8.226823,00000000000100000000000000000000000000000010000000000000000000000110000000110101000101010000000010001000010110011000101011100100110000100100001001011100010110101111010,UEURIVPEEYKGIJ-RRSHCKCTSA-N
CC2=C1C=C[NH]C1=C(C=C2)NCC(N3CCOCC3)C4=CC=C(C=C4)F,3236A6C419AAC483_D66A57785F553010_6041_UN,7.4206133,00000000000000000000000000000000000000000010000000000010010000000100000000010001001101110001000110101100010101010000001011100100110111110110001001011001010111101111110,BSCXRKGURYWQQJ-UHFFFAOYSA-N
C1(=CC(=CC(=C1)F)COC2CCCCC2)NCC3=COC(=N3)CN(C)C,12AF9C26AD57324E_30525CD384F7A9DB_7022_UN,8.082126,00000000000000000000000000000000000000000010000000000000010000000100000000100001001101110001110111001000000101110001011011100111110011110110001101011101110111111111110,POVNXOLPIYLFLV-UHFFFAOYSA-N
CC1=CC(=C(C=C1)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C#N,2249FE8EE92C4AFB_277A1ED613979DF8_6041_DP,7.3864107,00000000000000000000000000000000000000000110000000000100000000100000000000000000101000110011000000101000100100010000001001000100110101110110001011010011010110101111010,GUILSNSUEZJUOH-PKOBYXMFSA-N
N4CCC1=C(C=C(C(N1CC(N2CCNCC2)C3=CC=C(C=C3)F)=O)C#N)C4,FBCB0B8F7B22ECA1_308A86AFC8C2C927_6034_DP,8.369116,00000000000000000000000000000000000000000110000000000000000000000100000000010001101001110001100001101100110100110100011011100101110100100110001111011011011110100111110,ZONAAZHZPIEJFC-UHFFFAOYSA-N
CC1=C(C2=C(C=C1)N=CC=C2)NC4=C(C=C3OCCOC3=C4)[N](=O)=O,6F4F5C3021272A7F_D15D13E9E80AC638_7022_UN,7.9790707,00000000000000000000000010000000000000000000000001000000110000010100001110000001100000000000001001100110010001000100001111101100001011010110101011111011110011111111110,ZMBVOLLFRAVCAT-UHFFFAOYSA-N
FC1=CC(=CN=C1)C2=C4C(=CC(=C2)C=CC[C@@H]3COC(C)(C)O3)OCO4,9A28E5F1A0149608_CBF712C2319E8155_7019_UN,7.8786316,00000000000000000000000000001000000000000010000000000000010000100100000010100000000100010000000010110100010111001100100011010100000010100110100011100100110101011111110,BVVFBNJMRHKWKR-MRXNPFEDSA-N
N4CCC1=C(C=C(C(N1CC(N2CCNCC2)C3=CC=C(C=C3)Cl)=O)C#N)C4,E00AE3B5EB10909E_4116B8007904E915_6034_DP,8.369108,00000000000000000000000000000000000000000100000000000000000000000100000000010001101001110001100001101101110100110100011011100101110100100110001111011011011110100111110,BEQNAXFFAGUAMX-UHFFFAOYSA-N
FC1=C(C=CC(=C1)C2=NC=CO2)C=CC3=C(C=N[N]3C)C4CC4,8F4364EEACA83E60_CBE5812B86DB624C_7019_UN,8.493766,00000000000000000000001000000000000000000010000000001000010000100100000000010000100100010000111110010000000100100000010011101100000000100100001010011010000010101111110,XRMMVNIFCCVYCG-UHFFFAOYSA-N
CN4CCC1=C(C3=C([N]1CC2CNCC(C2)(C)C)C=CC(=C3)Cl)C4,BC57A40120ED3EEC_48C54473FCC6ECF7_6034_DP,7.657749,00000000000000000000000000000000000000000000000000000000000000000110000000110000101101110010010010101101010110011001101011100100110000100110011011011101010110101111010,LCRIRNGUNYUZJQ-UHFFFAOYSA-N
C1(=C(C=CC(=C1)C2(CC2)C#N)F)NC[C@H]4[C@H](C3=NC=C[N]3C)OCC4,44352EA0C6881AA4_2E97182E1519DB2E_7022_UN,7.284131,00000000000000000000001000000000000000100110000000000000010000100110000000010101001101010011010111001000000101001000001011100100110011110110001010011011110111101111110,DGLHDGZMLLJWEB-SUMWQHHRSA-N
CC1=C(N=C(N=C1)NCC2CNCC(O2)(C)C)C3=C(C=CC=C3)F,35EC8170DE0A0028_F568BB5F9D9B3B86_6041_DP,7.929733,00000000000000000000000001000000000000000010000000000100010000100110000000100100101000110010000100101000001110001001000011000100100111110110011011000111110111101111110,ISPYCVOQDMGTTB-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCCC2CCNC2)F)CC3,B6C322D41BCE83DD_58F05924AB241E37_6041_DP,7.605252,00000000000000000001000000000000000000000010000000000000000000000000000000010001101101110011010010001000100110010001101011100000110101110110001010011011010110101111010,AWHOSNOQDVQKIS-UHFFFAOYSA-N
CC1=C(C(=CC(=C1)Br)C)NCC2=NC=CN2C[C@H]3[C@@H](CCNC3)C4=CC=C(C=C4)F,201F68BD0927D44C_D162A896866AD70B_6034_UN,7.576048,00000000000000000000000000000000000000100010001000000000000000100100000000010101101101110011000010101000100110010000001011100100110101110110001011011111010110101111010,OSULWLFRHTZLGC-UGKGYDQZSA-N
FC2=C(C=C1C=COC1=C2)NC4CC3(CCN(C)CC3)OC5=C4C=CC=C5,A6568258CBE14735_2D8DAD2DE69E0EF4_6041_UN,7.983774,00000000000000000000000000000000000000000010000000000000010000000010000000010000000101110001010011101100110100011101101011100100110011110110001011011011110011111111110,CKRDEKMKDFBCCJ-UHFFFAOYSA-N
C1CC(CNC1)C2=CN(C=N2)C[C@H]3[C@@H](CNC3)C4=CC(=CC=C4)F,822539422C5597DA_D56D8FB90FA7A4C7_6034_UN,7.848189,00000000000000000000000000000000000000000010000000000000000000100100000000010101101101110011000010101000100100010000001011100100110100100110001001011011010110100111010,FPTQNYOVUVIXHF-YLGOGADGSA-N
CC1=CC=C(C=C1)C2=CN(C(=N2)C3NCCCC3)CC4CC4=CC5=C(C=CC=C5)Cl,76CA26D53A26222F_3C8ADF5B30882C5C_6034_UN,7.9171767,00000000000000000000001000000000000000100000000000100000000000100100000000011101001101010011000010111001100100010000001011100100110000100110001011011011010110101111010,OVMMNHKBJKFIIK-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2(CCCCC2)N3CCCCC3)F)[N]4C=CC=C4,9BFC44D9976E21FD_87B97D7A7BB05B2A_6041_UN,7.6714916,00000000000000000000000000000000000000000010000000000000000000100110000000010001001101110011000010101000000100011000001011100100110001110110001011011011010110101111010,ZDFYIIPGVXASNO-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(CC3=C(C)[NH]C4=C3C=C(C=C4)F)=O,63E9EC6B26E73741_F126877E4F778D90_6038_UN,8.108765,00000000000000000000000000000000000000000010000000000000000000000100000000000000001100010011100010011100110100110000111001000100110110100100001011010011011110101111110,DBPFXKMRSZCYEE-UHFFFAOYSA-N
CN(CC1=NN=C(C=C1)NC2C3=C(OC(C)(C2)C)C=CC(=C3)F)C4[C@@H]5CNC[C@H]45,EDB86B46D5A21321_CCEEAEED3FAE9AB2_6041_DP,8.251083,00000000000000000000001000000000000000100010000000001000010000000110000000100101101101110001011011101100110110011101000011101100110111110110011011001101110111101111110,DLBDRXPLOOQCFR-JOIKAWEESA-N
C1(=CC=C(C=C1)CN2CCN(CC2)C3CC3)NCCC4CCCN(C)C4,8A6FF9837BEDB4A2_C268084892133EF0_7022_UN,7.9419785,00000000000000000000001000000000000000000000000000000000000000100000000000010001001001100001010000101000100010010001101011100000110001010110001001011001010110101111010,ZHUOMZNKMPAAQR-UHFFFAOYSA-N
O(C1=C(C2=C(C=C1)[NH]C=C2)[N](=O)=O)CC3=CC4=C(C=C3)OCC4,CDC15BEBC4879116_DA4C276ED8C317B3_6039_UN,8.1570635,00000000000000000000000010000000000000000000000001000000110000010100001100000000100100000100001110000110010001000100001111101111101011010110101111111011110111110111110,CSHFIFPFSOSOJM-UHFFFAOYSA-N
C(C2CCC1(CC1)C2)=CC3=C[N](C)N=C3C4=CC(=CC=C4)F,225C9582BC7566E2_615EF7CD4756FA67_7019_UN,7.4362626,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000011010010000010100001000001011101100110000100100001010011010000010101111010,VQEDFORNDCEBMY-UHFFFAOYSA-N
FC2=C(C=C1C=CN=CC1=C2)NC4CC(C3=NC=C[N]3C)OCC4,34C6586B80B842A8_B819328C34C4C9D5_6041_UN,8.128253,00000000000000000000000000000000000000100010000000000000010000100100000000010101000101010010010111100100110111010000001011100100110011110100001011011011110011101111110,WEEIGDDUWKVCRB-UHFFFAOYSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=C(C=C(C=N1)F)I)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,D04896C8688571E5_75F0A18561A1BC16_6035_UN,8.975913,00000000000000000000000000110000000000000010000000100000000000100110000000001000000000010000100010110100010110101101111011000111110010100100001111010110100011001111110,RTJWPRSAVZAZNC-SAPQRMKNSA-N
CC4(C)CCC1=C(C3=C(N1CC2CCCS2)C=CC(=C3)Br)C4,F6A2112FDF6DD4C7_776027D55F0F4D54_6034_UN,7.87947,00000000000000000000000000000000000010000000001000000000000000000110000000110000010101011000000010001100010100011001101011100100110000100110000011011100010110101111010,QPPHGVQDYDADLK-UHFFFAOYSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=C(C=C(C=N1)Cl)Br)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,B0D5FE5005D03CE5_EDDE485BFD37FCF6_6035_UN,8.975893,00000000000000000000000000100000000000000000001000100000000000100110000000001000000000010000100010110101010110101101111011000111110010100100001111010110100011001111110,XRQAFMPMMKYHDF-SAPQRMKNSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=C(C=C(C=N1)Br)Cl)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,187FFF75C7E42B49_87CEF814DB689BF7_6035_UN,8.975903,00000000000000000000000000100000000000000000001000100000000000100110000000001000000000010000100010110101010110101101111011000111110010100100001111010110100011001111110,GIAXCPKDIUDNOP-SAPQRMKNSA-N
C1(=C(C=C(C(=C1)F)C#N)F)NC2(CCNCC2)CC=C,FF8E354EF6086C3E_EE9647BB27257130_7022_DP,8.3693695,00000000000000000000000000000000001000000110000000000100000000000010000000000000101000110011000000111000100100011000001001000000110101110110001011010011010110100111010,IIPSTKBSMXHGDQ-UHFFFAOYSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=C(C=C(C=N1)Cl)I)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,DF01F5A655978B97_055E046D980364E9_6035_UN,8.975894,00000000000000000000000000110000000000000000000000100000000000100110000000001000000000010000100010110101010110101101111011000111110010100100001111010110100011001111110,OJIJTPOZRWMRBY-SAPQRMKNSA-N
C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=C(C=C(C=N1)Br)Br)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,DD815292D80AB78D_9C76E56E4398714E_6035_UN,8.975882,00000000000000000000000000100000000000000000001000100000000000100110000000001000000000010000100010110100010110101101111011000111110010100100001111010110100011001111110,LQNIMNDLGNFWRB-SAPQRMKNSA-N
CN1C4CCC1CC(NC(=O)[C@@H]2CCO[C@H]2C3=CC(=C(C=C3)F)F)C4,51363757CC945000_8403F1BA6983916E_6038_UN,7.7707844,00000000000000000001000000000000000000000010000000000000010000100000000000010000100101010111110011100000110111110000111011100000110011100100001011011011111011111111110,HOARTEZCGSUILX-LTNKILPXSA-N
CN1C4CCC1CC(NC(=O)[C@@H]2CCO[C@H]2C3=CC(=C(C=C3)Cl)F)C4,AFA6D2E6A3F8231A_E79610986C6668EB_6038_UN,7.770781,00000000000000000001000000000000000000000010000000000000010000100000000000010000100101010111110011100001110111110000111011100000110011100100001011011011111011111111110,ANCBYWRMECCCHK-LTNKILPXSA-N
N1CC(C1)(C#N)C2=NC=C(C=C2)NC[C@H]3[C@@H](C3)C4=C(C=CC=C4F)F,35567A9D3DEE9236_DF4A2E0D6024E170_6041_DP,7.7239327,00000000100100000000001000000000000000000110000000000000000000100110000000000001101000110011000000101000000100001000000011000100010101110110001011000011010110100111010,LWPQCBQKAPNCCF-GXTWGEPZSA-N
CN3CCCN(CC1=C(C=C(C=C1)NC2(CCOCC2)C=C)F)CC3,DFB1D06C24776F44_87F288763444F8BA_6041_UN,7.6391206,00000000000000000001000000000000001000000010000000000000010000000010000000010001100001110010010001111000100111011001101011100000110011110110001011011011010111101111110,JEPLTLZCGOYPHD-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)F)C=CC2(COC)CCCCO2)F,109B5651073E8F9E_8C836967447EC9A5_7019_UN,7.585817,00000000000000000000000000000000000000000010000000000000010000000010000010000000000000110000010000110000000111001001001000000010110010100110000011010110110101011011110,YMPQXPKOTNNKQO-UHFFFAOYSA-N
C(=CC1=CC(=CC(=C1)F)F)NCC2(C)CCCCCC2,83E71062A54E81BC_F85B5189CFD4E5B0_7022_UN,8.391193,00000000000000000001000000000000000000000010010000000000000000000010000000000000001000010011000000011000000110001001101000000000110000100000000000010001010100101111010,KGVUFPHYDGIQCT-UHFFFAOYSA-N
N1CC4(C1)OC5(COC2=C(C=C(C=C2)C3=CC=C(C=C3)F)F)CC4(N)C5,C515E962365A9B32_D129E937410EF489_6035_DP,8.24378,00000000100100000000000000000000000000000010000000000100010000100010000010000000101110110011000111001000110101011100000011000111110111100110001111000011110111110111110,VNASTZDFYSTRDA-UHFFFAOYSA-N
FC1=CC2=C(C=C1)C(=CN2CC3[C@@H]4COC[C@H]34)C5=CCNCC5,85DAFC11B0656A1C_354771E943976611_6034_UN,8.821673,00000000000000000000001000000000000000000010000000100000010000100100000000011000001101110001000010111100110101010000001011100100110000100110001001011001010111100111110,RIWUTOVYTKZSHA-AYHJJNSGSA-N
CCC(C)CC(C)COCC1OCCC12CCNCC2,D591F45EF59876D2_B497DAD6E45A845F_6039_DP,8.487851,00000000000000000000000000000000000000000000000000000000010000000010000010000000001100100001000010101000110011011011101011000010110010000110010000010101110101111101110,JMMWTVLRABRGHH-UHFFFAOYSA-N
FC1=CC(=C(C=C1)N[C@H]2CCCC[C@H]2C3=CC=N[N]3C)C4CC4,8AD1315CDD59512A_4D5B5E2FFC8AD68D_6041_UN,8.231365,00000000000000000000001000000000000000000010000000001000000000100100000000010000100100010011011010000000100110010000001011101100110001110100001011011011000010101111010,OKLKUVBTYRSJQL-WBVHZDCISA-N
FC2=C1C=NC=CC1=CC(=C2)NC[C@@H]3CCCN(C)[C@H]3C4=CC=CC=C4,871A8CD3974BF5AD_2E0D0AA33BEC2B47_6041_UN,8.43658,00000000000000000000000000000000000000000010000000000000000000100100000000010000101001110011010000101100010110010001101011100100110001110110001001011011010110101111010,LUOXNJZSODSAGX-AVRDEDQJSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCC3=C(C(=CC=C3)Br)F,6773827B06DA4378_9C3FA7F436A47219_6038_UN,7.4732895,00000000000000000000000000000000000000000010001000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,WGZCKFPPPGNLRW-UHFFFAOYSA-N
N3CCC(CC=CC1=C[N](C)C2=C1C=C(C=C2)F)(CC3)C#N,40B37D00FB752F12_C3BB0611F3559004_7019_DP,8.004093,00000000000000000000000000000000000000000110000000000000000000000110000000010000001101110001010010111100110100011000001011100100110000100110001001011001010110101111010,KHROZAKNYKRHLU-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCC3=C(C(=CC=C3)Br)Cl,A26DCE7EEBD4B05E_79C72E6F74E3484F_6038_UN,7.4732666,00000000000000000000000000000000000000000000001000000000000000000000000000000000001000010011100000011001110100110000011000000000110010100000000011010011011110100111110,KUYOQPYUCVMBAQ-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCC3=C(C(=CC=C3)F)Br,14784AA175413FFF_B441E464962C3362_6038_UN,7.4732647,00000000000000000000000000000000000000000010001000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,RWTWWAPUKSRGCP-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCC3=C(C(=CC=C3)Cl)Cl,99B17B8AD52E2CE6_3E24E54F3B53FF42_6038_UN,7.4732623,00000000000000000000000000000000000000000000000000000000000000000000000000000000001000010011100000011001110100110000011000000000110010100000000011010011011110100111110,ZXKFOQLSNWSOEP-UHFFFAOYSA-N
C(CCOC1CCOC1)=CC3=CC(=C(N2CCN(C)CC2)C=C3)F,923D16C47F7EA1A3_640E46B3F2CFB133_7019_UN,7.966255,00000000000000000000000000000000000000000010000000000000010000100000000010010001000101110100010010111000000101010001101011100011110011110110001111011010110111111111110,WAVBOIGEHRYBFV-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCC3=C(C(=CC=C3)F)F,38D7766A4CA4F99E_08B041B2DA99016E_6038_UN,7.4732566,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011000110100110000011000000000110010100000000011010011011110100111110,UIIGAADQGZGZLW-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)F)C)NC34C(OCC3)CCCCC4,FDBFFF251215C7CE_B7E2704D0C6B4A25_6041_UN,7.3046966,00000000000000000001000000000000000000100010000000000000010000000110000000000100000100010011000111100100110101011000001011000100110011110100001011010111110011101111110,WUPZQQVOKBVIMA-UHFFFAOYSA-N
CCC2OC1=C(C=C(C=C1C2=O)NCC34CC(CNC3)(F)C4)F,3F4D51968973602C_117FEBFE9CF58B79_6041_DP,8.124955,00000000000100000000000000000000000000000010000000000100010000000010000010000000101100110110000010101100010100001110000011000001100111110110001111000011111111111111110,FMVDWUPVOKMZLK-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2COCCN2C)Cl)C3CC3,0960FBE828080C5B_C38DFF725ED220DC_7022_UN,7.459723,00000000000000000000001000000000000000000000000000000000010000100000000000010001001001110011010101101001000111010001101011100000110011110110001011011111010111101111110,WQCPICKLXFUJMU-UHFFFAOYSA-N
FC1=NC2=C(C=C1)C=C(C=C2)NCC3CCCN(C)C3C4=CC=CS4,4A1F5B94ABEBAD37_D00132E6E0B9BD30_6041_UN,8.234487,00000000000000000000000000000000000010000010000000000000000000100100000000010000111101111011010010101100010110010001101011100100110001110110001001011011010110101111010,UPSPGFFTGJYLTD-UHFFFAOYSA-N
FC1(CCOCC1)C2=CC=C(C=C2)NC[C@@H]3CCCN(C)[C@H]3C4=C[N](N=C4)C,0355AC64A492A65A_D0D62C3B328F2685_6041_UN,7.6741962,00000000000000000000000000000000000000000010000000001000010000100110000000010000101101110011011010101000000111011001101011101100110011110110001001011111010111101111110,LMWXGCZGFFMSFP-LAUBAEHRSA-N
CC5(C)CN(CCC2CCC3=C(C1=C(C)C=CN=C1N=C23)C4=C(C=CC=C4)F)CCS5,EF5ECD4582B92DA4_E4556CC3B0B72D13_2201_UN,8.718076,00000000000000000000000000000000000010100010000000000000000000100110000000110100010001111000000010101100010110011001101011100100110000100110011011011110010110101111010,XFXYZWMRIFDRFI-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)NCC3(CC2(CNC2)C3)C4=CC=CC=C4)C#N)F,01BCFA508B5AB85E_0462BF45030EB272_6041_DP,7.5641117,00000000100100000000000000000000000000000110000000000000000000100010000000000000101000110010000000001000010100001000000001000100100101110110001011000011010110100111010,YBNNABHPIUQBKW-UHFFFAOYSA-N
FC2=C1OC=CC1=C(C=C2)N[CH]4C[C]3(C[C](C)(C3)C)C4,8589657A8B806561_B71F4F6982C87F85_6041_UN,8.158112,00000000000100000000000000000000000000000010000000000000010000000010000000100000000100010001000011000100110110011001000000000100100001110100000000000101100010101111110,PCZQMXWJBWTTBT-UHFFFAOYSA-N
C1C4=C(CN1[S](C3=CC2=C([NH]C=C2)C=C3)(=O)=O)C=CC=C4,3CDDDAC8C69E410F_DE133CF6C0FEF20B_6029_DP,9.403493,00000000000000000000000000000000110000000000000000010001001111001101000001010000010100101000001010001110011000001000010011101100011000001110001011001001010010110111110,LNHZRDNKSBQCCC-UHFFFAOYSA-N
CN1C2CCC(C1)CC2NC(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)F,802D0C097B7FCBA2_0737B7E307478FC1_6038_UN,7.641374,00000000000100000000000000000000000000000010000000000000000000100010000000010001000001110011110000101001110110111001111001100000110001100100001011011011011010101111110,WHDQSKXPTGSXQL-UHFFFAOYSA-N
CN1C2CCC(C1)CC2NC(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)Cl,B74D857E1D16CB53_C8D2EDEBDC71F6E7_6038_UN,7.6413717,00000000000100000000000000000000000000000000000000000000000000100010000000010001000001110011110000101001110110111001111001100000110001100100001011011011011010101111110,MRFPMQQSVPCEMN-UHFFFAOYSA-N
N(CCC1CC2CCC1C2)C(C4=C(C)N=C3C=C(C=CC3=C4)F)=O,08C60A699C838D6A_06EC4291D04E8326_6038_UN,7.929682,00000000000000000000000000000000000000000010000000000000000000000100000000000000101000010001100011101100110100110000011001000100110000100100001011010011011110101111110,NZCXGEJICQWZAZ-UHFFFAOYSA-N
FC1=C(C=CC=C1)C2=NN=C3C=CC(=N[N]23)NCC45OC(C)(C)C(C4)C5,52D266D44DFEE1EE_5B1843845EEFED40_6041_UN,8.114278,00000000000100000000000000000000000000100010000000001000010000100110000000100101101100010010001110101100010110001000100011101100101011110100001011001111110111101111110,SMYXQPQTIMJKPW-UHFFFAOYSA-N
FC1=C(C(=CC=C1)NC2CCCC3=C2C=C([N]3CC)C)C4CC4,29E0AD4D23D19883_D1031B8820FC09E5_6041_UN,8.132973,00000000000000000000001000000000000000000010000000000000000000100100000000010000100101010011000010001100110110010010101001100100110001110100001011011111010110101111010,BOMOUUPQFLUFSS-UHFFFAOYSA-N
CC1=C(N=C(N1CC2COCCN2C)C3CCCN3)C4=CC=CC=C4,AAA865EDEDFC6CA9_510A71FEBF43F402_6034_UN,7.916274,00000000000000000000000000000000000000100000000000000000010000100100000000010101001101100011010111101000100001010001101011100100110010000110001011011111010111101111110,HUZKYFQLHOMMGM-UHFFFAOYSA-N
NC(COC2=CC1=C(CCN(C)C1)C=C2F)CC3CCOC3,C5C2E6C364F1CC19_B5CFE4E8D4E09F0F_6035_UN,7.52656,00000000000000000000000000000000000000000010000000000000010000000000000000010000000111110001010110101100110101010101101011100011110010100110001111011011110111111111110,WZLDAFWSCCOUHB-UHFFFAOYSA-N
C[N]1C=CC2=C1C(=NC=C2)NCC(N3CCOCC3)C4=C(C=CC=C4)F,4B436DA5F8FA4C03_ED94BE61D441966B_6041_UN,7.43789,00000000000000000000000000000000000000100010000000000000010000000100000000010101001101110001010110101100010101010000001011100100110011110110001011011011010111101111110,QXFBGPITICWINU-UHFFFAOYSA-N
N(C1=CC2=C(C=C1)CCOC2)[S](C4=CC3=C(C=C[N]3CC)C=C4)(=O)=O,971D7C040C19F6FB_1E218858987D5667_6029_UN,8.442063,00000000000000000000000000000000110000000000000000010001011111001101010001010000010101101001001010101110011001001010011011101100111011011110001011111001010111111111110,AHPFXRGQXLDSAJ-UHFFFAOYSA-N
C1(=CC=C(C=C1)C2CCOCC2)NC3=CC(=C(C=C3)N4CCCCC4)F,E95261FC7951B3B3_6CC1023B9532E43E_6041_UN,8.111256,00000000000000000000000000000000000000000010000000000000010000100000000000010000000001110000000000101000000101010000001011100100110011110110001011011011010011100111110,MTAHKQUFTJSHTA-UHFFFAOYSA-N
C1CC(CCN1)C3=CC2=C(C=CC=C2)N3CC4(C)CC4F,D7C8CED4A8CBA59A_6E1F4E4DD8175BC0_6034_UN,7.8196654,00000000000000000000001000000000000000000010000000000000000000100110000000010000001101110001000010101100110100011001101011100100110000100110001011011011010110101111010,XIMFLFFIQKJBBK-UHFFFAOYSA-N
C1CC(CCN1)C3=CC2=C(C=CC=C2)N3CC4(C)CC4Br,30B9E5857DBF0D97_E16D1935DC3CEAB4_6034_UN,7.819666,00000000000000000000001000000000000000000000001000000000000000100110000000010000001101110001000010101100110100011001101011100100110000100110001011011011010110101111010,HHAXCUCUGCSXLL-UHFFFAOYSA-N
CC1(C)[C@H]4CC[C@]1(C)[C@H](OCC3CCC2(CCNCC2)O3)C4,E6ECA721BD86F43E_3F48F29B0459C613_6039_DP,7.29912,00000000000000000000000000000000000000000000000000000000010000000010000010100000001100100001000011101000110011011001101011000011110010000110010101010111110101111101110,QIJWGTLCLQNUQG-MBSQVXIWSA-N
CC1=C(C=CC=C1)C(NC(=O)CC2CC3CC2C4CC34)CF,83802DF2720BE964_C4445A6FD9B6C22D_6038_UN,7.964202,00000000000000000001001000000000000000000010000000000000000000000000000000000000000000000001100010000000110010110000010000000000110010100000000011000011011110101111110,KNYMFRRFUQPJKP-UHFFFAOYSA-N
CC1=C(C=C(C=C1)F)NCC2(CCCOC2)N3CCOCC3,45FE48B88EE4027F_8BA6BACD064E8752_7022_UN,7.540228,00000000000000000000000000000000000000000010000000000000010000100010000000010001001001110011000101101000000111011000001011100000110011110110001011011011010111111111110,FMSJOJAQYPWLNZ-UHFFFAOYSA-N
CC1=C(C=C(C=C1)Cl)NCC2(CCCOC2)N3CCOCC3,C18FF4CBCCCC03D5_67A5572704FCB860_7022_UN,7.5402255,00000000000000000000000000000000000000000000000000000000010000100010000000010001001001110011000101101001000111011000001011100000110011110110001011011011010111111111110,WQTBPAIFNYCCAH-UHFFFAOYSA-N
C2(=C1[NH]C3=C(C1=CC=C2)CCC3)NCC4=CC=C([Si](C)(C)C)C=C4,145B542561EC22FE_0302E112A74E7346_6041_UN,7.2242584,00000000000000000000100000000010000000000000000000000010000000000100000000100001001100100011010010001100110000011000001001000100010101010100011011011101010110101111010,CBPXKQUVJAOEEH-UHFFFAOYSA-N
FC1=CC(=CC=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]5C[C@@H]4NC[C@@H]4C5,CD12A633B1088731_1AEEE523F1B94DB7_6034_UN,8.841234,00000000100100000001000000000000000000100010000000000000000000100100000000010101001101010011000010001000110100010000001011100100110100100110001010011011010110100111010,OSGVIMNMCPARTB-QFDAWVLOSA-N
N(CC1CC2(C1)C3CCC(C2)C3)C(C4=C(CC)[N](N=C4)C5=CC=C(C=C5)F)=O,6190881958681622_F6048DD1209B479D_6038_UN,7.78927,00000000000100000000000000000000000000000010000000001000000000100110000000010000101100010011101011001000010100111010011011101100110001110100001011011011011110101111110,OWKRVNJRMCUGEZ-UHFFFAOYSA-N
CN(CC1CCNC1)C2=NC(=CN=C2)NC[C@H]3[C@@H](OCC3)C4=CC=C(C=C4)F,C6052D619529E14E_16416B98231DE980_6041_DP,7.8422346,00000000000000000000000000000000000000100010000000000000010000100100000000000101101101110011010011101000100111010001001011100100110111110110001001011011110111101111110,GGSYBQQYDOSWTA-DJYSHGJYSA-N
CC1=C(C=C(C(=C1)N[C@@]23[C@@H](CCC2)OCC3)Cl)C4CC4,EF841A14E5C946DC_6E89258F95BB6BF4_7022_UN,8.249215,00000000000000000000001000000000000000000000000000000000010000100010000000000000000100010011000111000101110111011000001000000000110011110100000010010011110011101111110,PJJCQLCNBGCJSV-SJORKVTESA-N
FC1=C(C(=CC=C1)C[N]2C=C(C=N2)NCC3C(C)(SCC3)C)F,AAEC54F9E23EABE4_FC57BDD9A17E8A69_6041_UN,8.6245575,00000000000000000000000000000000000010000010000000001000000000000110000000110001111100011011001010001000000110011000101011101100110001110110001010011111010110101111010,DBEORLYTDKTUIP-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C[N]2C=C(C=N2)NCC(C3CCCN3)(C)C)F,2944A7A0826329C3_BFAE96F0CCAFA7CF_6041_DP,8.488627,00000000000000000000000000000000000000000010000000001100000000000110000000110001101100010011001010001000100110011001101011101100110101110110001010011111010110101111010,BINGXLIOQUCVLV-UHFFFAOYSA-N
C1(=CC2=C(C=C1)C3CCC2O3)NCC4CCCCN4C,B6A13C675DBA3449_3A82FA9F609E9F97_6041_UN,7.1139865,00000000000000000000000000000000000000000000000000000000010000000000000000010001001101100011010010101100010010010001101011100000110011010110001011011011110111101111110,REXFWDDVFQXSPU-UHFFFAOYSA-N
CN(C1[C@@H]2CNC[C@H]12)C3=NC(=CN=C3)NC4=CC(=CC=C4)C5=C(C=CC=C5F)F,A68F430013DA7608_9ED96F43430D7075_6041_DP,7.7016516,00000000000000000000001000000000000000100010000000000000000000100100000000000101101101110001010010101000010110000000000011100100110101110110001011001011010010101111010,QFQWYMCMMVBXHA-XVQYUUQNSA-N
CC1=C(C5=C(N1CC34CC2CC(CC(C2)O3)C4)C=CC=C5)C6CCNCC6,8A35588D2C9937E4_D32036F695F0CB99_6034_UN,7.952124,00000000000000000000000000000000000000000000000000000000010000100110000000010000001101100001000110101100110010011000101011100100110010000110001011011011110111101111110,DCTYYFNQTZDVMA-UHFFFAOYSA-N
CC5(C)CN(CCC1CCC2=C(C3=C(N=C12)C=CC=N3)C4=CC=C(C=C4)F)CCS5,79FADB8D63C7CCE3_4F826707CD7895BE_2201_UN,8.574898,00000000000000000000000000000000000010000010000000000000000000100110000000110001010001111000000010101100010110011001101011100100110000100110001011011100010110101111010,VYBOVBDKIPUAAF-UHFFFAOYSA-N
CCNCC1=CC2=C(C=C1)N(C=C2)CC(C)(N3CCNCC3)C4=CC=C(C=C4)Br,1A839C61CCBFF351_697DAB9519CDD0E7_6034_UN,7.8965054,00000000000000000000000000000000000000000000001000000000000000000110000000010001001101110001000010101100110110011011101011100100110100100110001001011101010110101111010,SBWTZAIPHIVVFI-UHFFFAOYSA-N
CN([C@H]1C[C@@H]2CC[C@H](C1)N2)C3=NC(=NC=N3)N[C@@H]4CCO[C@H]4C5=CC(=C(C=C5)F)F,0C4827646104F94F_9F4233B0A5E57399_6041_DP,8.049856,00000000000000000001000001000000000000000010000000000000010000100100000000000100100101010011010111100000111101010000101011100100110111110100001011011011110011101111110,JZKLSNWBPAPYLI-MXQZZYIMSA-N
C(C2CCC1CC1C2)=CC3=C[N](C)N=C3C4=C(C=CC=C4)Cl,9F88CDF067BB28CC_7C2FED231D0557A3_7019_UN,8.246713,00000000000000000001001000000000000000000000000000001000000000100100000000010000100100010000011010010001010100000000001011101100110000100100001011011010000010101111010,HFHVYEVNPBTFIH-UHFFFAOYSA-N
CC1=C(C=CC=C1F)NCC2(CCSC2)N3CCOCC3,821D7F7787979649_DC3A18AE7FA9715C_6041_UN,7.9083886,00000000000000000000000000000000000010000010000000000000010000100010000000010001001101111011000110101000000111011000001011100000110011110110001011011011010111101111110,ZELIDORUZNFGFM-UHFFFAOYSA-N
CC1=C(C=CC=C1Br)NCC2(CCSC2)N3CCOCC3,220FB54BE52163E2_EE189D808A368176_7022_UN,7.908397,00000000000000000000000000000000000010000000001000000000010000100010000000010001001101111011000110101000000111011000001011100000110011110110001011011011010111101111110,HIJIZYXITINGNZ-UHFFFAOYSA-N
C2(=C1OC=CC1=CC(=C2)F)NCC3CCN(C)C3C4=CC=CS4,B320A53A06114170_7C62DF35C91072D8_7022_UN,8.160982,00000000000000000000000000000000000010000010000000000000010000100000000000010000111101111011010110001100010110010001101011100100110001110110001000011011110110101111110,MVNIFUWVLKYZNJ-UHFFFAOYSA-N
N(C2=C1OCCCC1=CC(=C2)F)C(C4=CC3=C([N](C)C=C3)C=C4)=O,86F78B74A8DEE4C3_33447923E8EA31DE_6038_UN,8.243517,00000000000000000000000000000000000000000010000000000000010000000100000000010000000101010001110110100100010101100100011011100100100011110100001011011001111011111111110,ZKSINNPVXVLTCB-UHFFFAOYSA-N
CC1=C(C=CC=C1Cl)NCC2(CCSC2)N3CCOCC3,6CC7C2E88C701FE2_321BCF9C23781544_7022_UN,7.9083824,00000000000000000000000000000000000010000000000000000000010000100010000000010001001101111011000110101001000111011000001011100000110011110110001011011011010111101111110,AJNPDTCIOOZOAU-UHFFFAOYSA-N
FC1=C(C=C(C(=C1)F)NC[C@@H]2CCCN(C)[C@H]2C3=C[N](N=C3)C)F,2D382D9253104C9F_E70C519B336D2116_6041_UN,8.536306,00000000000000000000000000000000000000000010000000001000000000100100000000010000101101110011011010101000000110010001101011101100110001110110001011011111010110101111010,IWPWNSZLSLZUEP-APPDUMDISA-N
CC1=C(C(=C(C=C1)C)NC[C@H]2[C@H](CCNC2)C3=CC=C(C=C3)F)C,401ECBA45730F153_6A0B24ECF549B9B0_6041_DP,8.428969,00000000000000000000000000000000000000000010000000000100000000100000000000000000101000110011000000101000100110010000001001000100110101110110011011010111010110101111010,TYDKJGKMPFHUDI-AZUAARDMSA-N
FC2=CC(=C1CCCC1=C2)NC4=CC3=C(C=C[N]3CCN(C)C)C=C4,40BACFEB9BC55C39_60961331EC2D167C_6041_UN,7.953217,00000000000000000000000000000000000000000010000000000000000000000100000000110001100101110011010010001100010100010001101001100100010001110110001011011101010110101111010,KMFQVZQMBLUNNP-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC2C(CCCC2)C3=CC=CC=C3)Cl)C4CC4,7317405C5480EBA7_BB3A4C24F9E9C57B_7022_UN,7.8182344,00000000000000000000001000000000000000000000000000000000000000100000000000000000000000010011000000000001100110010000001000000100110001110000000011010011000010101111010,LLXTZUHXPDQUCT-UHFFFAOYSA-N
NCCC3(COC1=C(C=CC(=C1)C2CNCCC2)F)CCC3,A82DCEB5F6B20E93_4CF4ED8FC9546A1F_6035_UN,8.248793,00000000000100000000000000000000000000000010000000000000000000100010000000000000001010110011000000101000100101011100001001000011110100100110001111010011110101100111110,XMSATFMQIHNHEF-UHFFFAOYSA-N
FC1=C(C2=C(C=C1)SC=C2)NCC3CCCC(CC)CC3,B012E4823D7AAE2A_C845D238F81C5481_6041_UN,8.083369,00000000000000000001000000000000000010000010000000000000000000000000000000000000011100011011000010001100010110000010101000000100110001110100000010010011010110101111010,OXKYNNGNMIYIIW-UHFFFAOYSA-N
FC2=C(C=C1C=C[NH]C1=C2)NC4=CC=C(CN3CCN(C)CC3)C=C4,58EB1FAFC33FCFCF_412D6868E6F02D2B_6041_UN,8.289732,00000000000000000000000000000000000000000010000000000000000000000100000000010001000101110000010010101100010100010001101011100100110101110110001011011011010110101111010,NAPKCQLJOSJWEJ-UHFFFAOYSA-N
FC1=C(C(=CC=C1)C[N]2C=C(C=N2)NC4C[C@H]3CCC[C@H](N3C)C4)F,3E61FE3403D2B43F_3412AC36280A8B44_6041_UN,8.519546,00000000000000000000000000000000000000000010000000001000000000000100000000010001100101010001011010101100110110010000101011101100110001110100001011011011010110101111010,GUPOXHSRKOLBGV-ZXFUBFMLSA-N
CN(CC1=NC=C(N=C1)NC2C(C)(C2)C3=C(C=CC=C3F)F)C4[C@@H]5CNC[C@H]45,54972CE0303BA973_1DE94047B5E17FCD_6041_DP,8.032193,00000000000000000000001000000000000000100010000000000000000000100110000000000101101101110011010010101000110110011001100011100100110101110110001011001111010110101111010,RCAZKWBNAYWSPL-QARAPLMISA-N
O(C(C1CCNCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Br)Br)C#N,165E8102E968E73A_ABDA5F7ACCAF25AB_6035_UN,7.7662153,00000000000000000000000000000000000000000100001000000000000000000000000000000000001000110001000001101000100100010100001001000111110000100110001111010011110001100111110,NVDWLMINEUUANK-UHFFFAOYSA-N
O(C(C1CCNCC1)C2=CC=CC=C2)C3=C(C=C(C=C3Cl)F)C#N,825476B3C276E694_2642A654CFE6F457_6035_UN,7.766217,00000000000000000000000000000000000000000110000000000000000000000000000000000000001000110001000001101001100100010100001001000111110000100110001111010011110001100111110,HGUQKESKICPSGA-UHFFFAOYSA-N
FC1=NC2=C(C=C1)C=C(C=C2)NC3(CC3)C4CCCC4,6D84BF14985CF14D_4B001BC1C79ACEB8_6041_UN,8.527153,00000000000000000000001000000000000000000010000000000000000000100110000000000000000000010011000010100100110100011000001001000100110001110100001001010001000010100111010,RAOYAEFQJPPAMR-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2(C)CCCCCCC2)F,5E6D06F69D81E0C6_59043F0596AF62B1_7022_UN,7.766255,00000000000000000000000000000000000000000010000000000000000000000010000000100000001001110011010000001100000110001001101000100000110001110010011010011111010110101111010,TZLMAGLJSRTFNZ-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2C(CCCC2)F)F,9377A89E9C47C17F_757A60521E048482_7022_UN,7.945858,00000000000000000000000000000000000000000010000000000000000000000000000000100000001001110011010000001000000100000001001000100000110001110010001011011111010110101111010,PTNGDBZZJKJMAK-UHFFFAOYSA-N
CN(C)CC1=C(C=C(C=C1)NCC2C(CCCC2)Cl)F,F6313155D2B9A83D_7E2A630AB25FCF09_7022_UN,7.945856,00000000000000000000000000000000000000000010000000000000000000000000000000100000001001110011010000001001000100000001001000100000110001110010001011011111010110101111010,HANSDRVIHZICCD-UHFFFAOYSA-N
CC1=NC4=C(C(=C1C2CCCNC2)C3=CN=C(C)C=C3)C5=C(S4)CCC5,8E66C8C1E0EFDE88_6738C6F19AC27F96_2201_DP,7.7913275,00000000000000000000000000000000000010000000000100000000000000100100000000000000011100101011000010101100110010010000001011000100110000000110001011010111010010101111010,HVCSMPIMGVPIDC-UHFFFAOYSA-N
CN(C)C3CCN(CC1=CC=C(C=C1)NCC2CC(CCC2)F)C3,A391201E1FBCE917_C92EC814D2FA377E_6041_UN,7.616436,00000000000000000000000000000000000000000010000000000000000000000000000000110001101101110011010010001000000110010000101001100000110001110110001001011101010110101111010,QQGQEINJHRHXAG-UHFFFAOYSA-N
N(CC12CN(CC1)CCC2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)F,540EA01E2815830C_21052B76CC97BE11_6038_UN,7.548909,00000000000100000001000000000000000000000010000000000000000000100010000000000000101101110011100010101001010100111000011001100000110000100110001011011011011110100111110,BEXGHZDGRAKFGE-UHFFFAOYSA-N
N(CC12CN(CC1)CCC2)C(=O)C3(CCC3)C4=CC(=C(C=C4)Cl)Cl,882A5881B0979F03_EEE0717E17A1C737_6038_UN,7.5489035,00000000000100000001000000000000000000000000000000000000000000100010000000000000101101110011100010101001010100111000011001100000110000100110001011011011011110100111110,IMTXWLDTBJJYQI-UHFFFAOYSA-N
C[N]1C=C(C2=C1C=CN=C2)NCC3(C(C)(C3)C)C4=C(C=C(C=C4)F)F,D4C11898C217D6DD_0F892514A3820489_6041_UN,8.419243,00000000000000000000001000000000000000000010000000000000000000100110000000110001101101010011010010101100010110001001100011100100010001110100011011001111010110101111010,DYMVBZCEQDQFHC-UHFFFAOYSA-N
CC1=C(C(=C(C=C1)F)NC[C@@H]2CCCO[C@H]2C3=CC=N[N]3C)F,AF3F2D88856EEBC3_EC49D84818E03A7E_7022_UN,7.8396087,00000000000000000000000000000000000000000010000000001000010000100100000000010000101100010011011111101000000101000000001011101100110011110110001011011111110111101111110,UDECRZMLGUPMLF-YVEFUNNKSA-N
CN(C)C[C@H]1[C@H]4CC[C@@H]([C@H]1OC2=CC(=CC=C2)C3CNCCO3)C4,187C376AB6F5DB75_D565031F22C7BA99_6035_UN,8.096355,00000000000000000000000000000000000000000000000000000000010000100000000000100000001001100001010111101000110001010101001011100011110010000110001101011111110101111111110,JKOBXYJGPWFEHE-GGSJWMRQSA-N
CC1=C(C=C(C(=C1)NCC23COC(C)(C2)CCC3)F)F,69E180EBE85F88BD_51A989AB288B125A_7022_UN,8.104395,00000000000000000001000000000000000000000010000000000000010000000010000000000000001100010011000011001000010111001001101000000000110011110110000011010111110111101111110,HAWNUFWSCWAOEA-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NCC2C3(CCC2)CC3)F,BE461F314CBAB22D_948BDC01337A56F4_6041_UN,7.2391205,00000000000000000000001000000000000000000010000000000000000000000010000000100000001001110011010010001000010100001001001000100000110001110010001010011111010110101111010,JIZDMDZBZNHWCN-UHFFFAOYSA-N
CC1=C(C=C(C=C1)CC2=CN(C(=N)S2)CC3(C(C)CNC3)C)Cl,B07B7546B9CA9237_B7E18941F5ABFBC4_6034_UN,8.060958,00000000000000000000000000000000000010000000000100000000000000000110000000010110111101111011000010001001001110001001100111100100110101110110011010001111010110101111010,QJNNYNPAAQIAHZ-UHFFFAOYSA-N
C[N]1C=NC2=C1C(=CN=C2)NCC(N3CC(C)OC(C3)C)C4=C(C=CC=C4F)F,B371332942CF756D_EC624B957503AE85_6041_UN,8.722923,00000000000000000000000000000000000000000010000000000000010000000100000000010101101101110001010110101100010110010001000011100100110011110110011011001111110111101111110,WDMURDNQBJXZRH-UHFFFAOYSA-N
CC2=CC1=C(C=CC=N1)N2CC3CCN(CC3)C4CNCCC4,F3A670AF561F2B41_B6EAC16DA32E948A_6034_UN,8.146437,00000000000000000000000000000000000000000000000000000000000000100100000000010001101101100011000010101100110000010000101011100100110001000110001011011011010110101111010,KRIJHFXFWLITQH-UHFFFAOYSA-N
N(C1C2CCC(CC1)C2)C(=O)CCC3=C(C=CC(=C3)F)F,C21F6A383B30F397_8C14569BA5D4F195_6038_UN,7.2322946,00000000000000000001000000000000000000000010000000000000000000000000000000000000000000010011100010000000110100110000011000000000110011100000000011010011001110100111110,PVXRZXNDZCJNBJ-UHFFFAOYSA-N
CC34CCC(C=CC1=C[N](N=C1C)C2=C(C=CC=C2)F)(CC3)CO4,7A3CAB8B2E62D9C8_A1A3A389473EC5C5_7019_UN,7.827384,00000000000000000000000000000000000000000010000000001000010000100110000000010000100100010000001010110000010101001001101011101100110011110100001011011110110011101111110,FEDBFQPQLVADES-UHFFFAOYSA-N
CC34CCC(C=CC1=C[N](N=C1C)C2=C(C=CC=C2)Cl)(CC3)CO4,6315FF1255591E98_EC15795145E294FC_7019_UN,7.8273807,00000000000000000000000000000000000000000000000000001000010000100110000000010000100100010000001010110001010101001001101011101100110011110100001011011110110011101111110,RYOYZHFOHOLMJY-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)NC[C@@H]2CCN(C)[C@H]2C3=CN=CC=C3)F)F,3D739B85975433D7_5D7BE52B815978C6_6041_UN,8.958586,00000000000000000000000000000000000000000010000000000000000000100100000000010000101101110011010010101000000110010001101011100100110001110110001011011011010110101111010,QJMSARJKBORATC-SJCJKPOMSA-N
FC1=C(C=C(C=C1)CC=C)NCC(N(C)C)C2CCCCC2,C4F7A32483426ED6_54AEE39B4101E0D7_6041_UN,7.6253257,00000000000000000000000000000000001000000010000000000000000000000000000000100001001001110001010000011000000110010000101000100000110001110000001011011111010110101111010,HGOXDZLLJYRENR-UHFFFAOYSA-N
C[Si](C)(C)C1=CC(=CC=C1)NC[C@]23CC[C@H]2CCCN3,F78F4EC7BDB78145_FDDC2F8AF2644993_6041_DP,7.863339,00000000000100000000100000000010000000000000000000000010000000000010000000100001001000100011010000101100110000011000001001000000110101010110011001011101010110101111010,UOKRVHXUDBNFAE-RHSMWYFYSA-N
FC2=C1N=C(N(C1=CC=C2)C[C@H]3[C@@H](CNC3)C4=CC=C(C=C4)Cl)C5CCNCC5,6CCA018939BE7BE0_9A68E753B90593BB_6034_UN,8.998808,00000000000000000000000000000000000000100010000000000000000000100100000000010101101101110011000010101101110100010000001011100100110100100110001011011011010110100111010,PXBFXBGNGULZBX-HKUYNNGSSA-N
C2(=C1OC=CC1=CC(=C2)F)NC4CCOC(C3=CN=C[N]3C)C4,BD5B856E00DE680D_2F78D06F084C97F5_7022_UN,7.4742393,00000000000000000000000000000000000000000010000000000000010000100100000000010101000101010010010111100100110111010000001011100100110011110100001011011011110011111111110,IMZPIDGTIRFYJB-UHFFFAOYSA-N
C[N]1N=C(N=C1NC2CCCC3=C2N=C(S3)C4=CC=C(C=C4)F)C5CCOCC5,3E5A296A2C4A1C0B_7C765AB672BFD7A8_6041_UN,8.014398,00000000000000000000000001000000000010100010000100001000010000100100000000010101110100111011011010100100111101010000001011101100110011110110001011011011010011101111110,GYWMRYKHVMJXSJ-UHFFFAOYSA-N
C[Si](C)(C)C1=CC=C(C=C1)NCC2CCNC3(C2)CCC3,4E810A187FB821A9_FC757ADE8467632A_7022_DP,7.3048897,00000000000100000000100000000010000000000000000000000000000000000010000000100000001000100011010000101000110000011000001001000000110101010110011001011101010110101111010,BIYWSVNOGAPLCT-UHFFFAOYSA-N
N(CC1C2CCC(C1)C=C2)C(=O)CCC(=O)C3=C(C=C(C=C3)F)F,7AE43672A3836584_670D189D3FCDAA75_6038_UN,7.545479,00000000000000000000000000000000000000000010000000000000000000000000000000000000001000010011100000011000110100110000011000000000110010101000000011010011111110110111110,DDNNSZQDDZWCFA-UHFFFAOYSA-N
FC1=C(C(=C(C=C1)NCC3(CC2(CNC2)C3)C4=CC=CC=C4)F)CC#N,8DDD211367FB4861_FF90524145DA9786_6041_DP,7.7857003,00000000100100000000000000000000000000000110000000000000000000100010000000000000001000110011000000001000010100011000000001000100100101110110001011000011010110100111010,BZJLCHRACBJMHV-UHFFFAOYSA-N
O=[N](=O)C2=C1C=NC=CC1=C(C=C2)NC4=C3OCCCC3=CC(=C4)F,DB8AF379F2925B45_7648D10E3A3EEBE4_6041_UN,8.299041,00000000000000000000000010000000000000000010000001000000110000010100001100000000100000010001001100100110010101000100001111101100101011110100001011111001110011110111110,CKLGGTVOPRAYGC-UHFFFAOYSA-N
C4CC1=C(C3=C(N1C2=CNC(=CC2=O)C)C=CC=C3)CN4,ED24CC1F01BEE901_2F271E3DA6B3A32C_6034_UN,9.018285,00000000000000000000000000000000000000000000000000000000000000100100000000010001101101100001000111101100110000010100001011100101110101010110001111011011111010101111110,CYQGAFCQBBHCLE-UHFFFAOYSA-N
CC2=C(C=C1OCCC(C1=C2)=O)NC3=CC5=C(C=C3)OC4(CCC4)C=C5,79F38F7CC5BE1C4F_40F02FBD83834BBB_6041_UN,8.90044,00000000000100000000000000000000000000000000000000000000010000000010000000000000000000000100000001110100010001001100001010000101000011010100000111110011111011111111110,CMDNTKVMOXNMFP-UHFFFAOYSA-N
C[Si](C)(C)C#CC1=C(C=CC=N1)NC2=CC3=C(C=C2)CCCC=C3,0CB5565A8D287E1E_A7B305CC1D4F1B09_6041_UN,8.042454,00000000000000000101100000000010000000000000000000000000000000000100000000100001000000100000010000110100010000001000001001000100000001010100011011011111000010101111010,KBGTYYLHCQINHS-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NC4=CC2=C([N](C)C(=N2)C3CC3)C=C4)Cl)C5CC5,87081B90B20DFE9F_A91D1CD8CA516D37_7022_UN,8.0231905,00000000000000000000001000000000000000100000000000000000000000100100000000010101100101010000010010000101010110000000001011100100000001110100001011011111000010101111010,IFTUDFHBGKFLQF-UHFFFAOYSA-N
CC2=C1N=CC(=C(C1=CC(=C2)F)NCC4OCC3(CNC3)C4)C#N,A2B7ABAAC68CDBD4_8F9C57D72324DE47_6041_DP,7.2785935,00000000100100000000000000000000000000000110000000000000010000000110000000000000101100110011000111101100010101001000000011000100110111110110001011000011110111101111110,JOGKNOWVMWXFNW-UHFFFAOYSA-N
C(N1CCNCC1)C3=CC2=C(C=CC=C2)N3CC4(CCN(C)CC4)C,BEC6B0A8ADD118A1_4BAD7B4AFA0D6A28_6034_UN,8.096254,00000000000000000000000000000000000000000000000000000000000000000110000000010001001101100001010010101100110000011001101011100100110000000110001011011111010110101111010,KBKJMGPQOLKMBM-UHFFFAOYSA-N
CC1=C(C(=NO1)C2=CC=C(C=C2)F)NC[C@@]34CCCN[C@H]3CCCC4,BEC7D0ACAA783257_483D6F66DECA36FA_6041_DP,7.8906593,00000000000000000000000000000000000000000010000000000100010000100110000100000001101100010011001111101110110110011000001011001100110101110110001011010011110110101111110,NHPWFPFFQFWMFJ-FXAWDEMLSA-N
C[N]1C(=NC2=C1C=CC=C2F)NC3C4CCC(CC3)C4,091AF369B1054612_819DACE8FA6ED929_6041_UN,8.299263,00000000000000000001000001000000000000000010000000000000000000000100000000010101000101010011010010000100111100010000001011100100110001110100001011011011000010101111010,NLJQGQPYADBHOK-UHFFFAOYSA-N
CN(C)CC1=C(C=CC(=C1)NC3=NC=C(C2CC(C)CCC2)S3)F,DFA3B3F376AE1502_8B45706F53CC7A9B_7022_UN,8.239397,00000000000000000000000000000000000010000010000100000000000000100100000000100100010101111001010010001000001110000001101011100100110001110100011011011111010110101111010,BXYLFJRYBGXTAH-UHFFFAOYSA-N
N(C1=CC=C(C=C1)N2CC3CCC(C2)O3)C(=O)C4(CCCC4)C5=CC(=CC(=C5)F)F,215D73AC1A68495E_63BD8B37133A452F_6038_UN,7.6603594,00000000000000000001000000000000000000000010000000000000010000100010000000010000000101110011100110101000010100101000011011100100110011110110001001011001111011110111110,SWJJJZVKLGTJLA-UHFFFAOYSA-N
CC3=C(C=C2N=C1CCCCC1=C(C2=C3)NC5=CC4=C(C(N(C)C)CC4)C=C5)F,5CCF798AE4C96757_A76328D6DD786880_6041_UN,7.195622,00000000000000000000000000000000000000000010000000000000000000000100000000100000100001110011010010100100010110010000101001100100110001110100011011011111000010101111010,ZRLBGCOXODEQGQ-UHFFFAOYSA-N
C[N]2C=C1C=C(C=C(F)C1=N2)NCC3C4(CC3)CCOCC4,631F1CE9B305F186_A84A232C1BFC0168_6041_UN,7.4191203,00000000000100000000000000000000000000000010000000001000010000000110000000010000101100110011011010101100010101001000001011101100110011110110001001011001010111101111110,KKHJQUPRDYWFIZ-UHFFFAOYSA-N
C1(=C(C2=C(C=C1)OCO2)F)N[C@H]4[C@H](C3=C(C)[N](N=C3)C)OCC4,AEE117A9801E847B_03DBC3DD2478AAA7_7022_UN,8.570581,00000000000000000000000000001000000000000010000000001000010000100100000010010000100100010011011111000100110101010100001011111100000011110110001010111111110011111111110,JJAYNLMNTGRSEU-DOMZBBRYSA-N
CN(CC1=NN=C(C=C1)NC2C3=C(CC2)C=CC(=C3F)F)C4[C@@H]5CNC[C@H]45,35C671CE219209E6_6B61C4D3DAFD5228_6041_DP,8.4166355,00000000000000000000001000000000000000100010000000001000000000000100000000000101101101110011011010101100110110010001001011101100110101110110001011011011010110101111010,SFKHKJSDHULQST-IUXSAEICSA-N
FC1(F)CC15CCC(C=CC2=C[N](N=C2C3=CC=C(C)C=C3)C4=C(C=CC=C4)Cl)CC5,5B99F83B389CA39E_A6350E05BD78934D_7019_UN,8.188222,00000000000000000000001000000000000000000010000000001000000000100110000000010000100100010000001010010001010100001000001011101100110001110100001011011010000010101111010,GDJYRQVBJHGXPP-UHFFFAOYSA-N
CC1=CC2=C(C=C1)C(=CN2CC=CC3=CC(=CN=C3)Br)C4=CCNCC4,9C22E987E984F27F_60418E4D22B7A63F_6034_UN,8.495373,00000000000000000000000000000000000000000000001000100000000000100100000000011000001101110001000010111100110100010000001011100100110000100110001001011001010110101111010,BLAKBYWADKRUTA-UHFFFAOYSA-N
CC1=C(C=C(C(=C1)NCC2CCCN(C)C2C3=CC(=CC=C3)Cl)Cl)C4CC4,F1670DF73A470364_8F20DCE31FEA17B2_7022_UN,8.113607,00000000000000000000001000000000000000000000000000000000000000100000000000010000101001110011010000101001000110010001101001100100110001110110001011011111010110101111010,MCQUIPWZWHZLLL-UHFFFAOYSA-N
FC1=CC2=C(C=C1)[NH]C(=C2)NCCC3CCN(C)CC3,09DF148DEC58F1F3_AB3AC836B0E4C5E7_6041_UN,8.411589,00000000000000000000000000000000000000100011000000000000000000000100000000010100001101110011010010101100110100010001101011100100110101110110001001011001010110101111010,ZMZQUCWTIBNBGV-UHFFFAOYSA-N
FC1=CC(=C(C=C1)NC(CC)C2CC3CCC2C3)C4CC4,D77E83518662252D_3850CBD3061679B1_6041_UN,7.5398264,00000000000000000000001000000000000000000010000000000000000000100000000000000000000000010011000010000000110110010010001000000000110001110000000011010011000110101111010,JTTYANBFKJLYNY-UHFFFAOYSA-N
FC1=C(C=CC=C1)C2=CSC(=N2)NC[C@@H]4[C@@H](C3=CC=N[N]3C)N(CCC4)C5CC5,5060238AF79194F8_B629B4B135AC5233_6041_UN,8.272489,00000000000000000000001000000000000010000010000100001000000000100100000000010101111101011011011010101000001100010000001011101100110001110110001011011011010110101111010,FEIIUPHDLGJAHO-VFNWGFHPSA-N
C1(=CC=C(C=C1)CCN2CCCCC2)NCC3CCN(C)C3C4=CC(=C(C=C4)Cl)F,CA54D983583E354E_7E123A157A8CFAD1_7022_UN,8.1478195,00000000000000000000000000000000000000000010000000000000000000100000000000010000101101110011010010101001000110010001101011100100110001110110001011011011010110101111010,VJSHDENJZKUGAV-UHFFFAOYSA-N
CN4CCCN(CC1=C(C=C(C=C1)NC3(C2(C)CC2)CC3)F)CC4,AE51E27FA2DFF084_D2CD2B3A0D3F2468_6041_UN,7.922346,00000000000000000001001000000000000000000010000000000000000000100010000000010001100001110011010000001000100110011001101011100000110001110110001010011111010110101111010,QJKLXIUMPIKWKQ-UHFFFAOYSA-N
N([C@@H]1CCO[C@H]1C2=CC(=C(C=C2)Cl)F)C(C4CC3CCC(N3)C4)=O,A8E5A8C14ECED517_065668064EF25FD3_6038_DP,7.7907195,00000000000000000001000000000000000000000010000000000000010000100000000000000000000100010011100111100001110101110000011011000000110111100100001011010011111011110111110,ROCAVUHVLYZPPZ-NOKNTHEUSA-N
N([C@@H]1CCO[C@H]1C2=CC(=C(C=C2)F)F)C(C4CC3CCC(N3)C4)=O,F43D759C4BDDA80B_31DB1AB15DA1C4EE_6038_DP,7.790722,00000000000000000001000000000000000000000010000000000000010000100000000000000000000100010011100111100000110101110000011011000000110111100100001011010011111011110111110,SHKPMVCPBJPDNV-NOKNTHEUSA-N
CN(C)CC1=C(C=CC(=C1)NC2CCC3(CC2)CCCC3)F,F66C63080351A62E_BBBD92920FFEAB3E_6041_UN,7.623901,00000000000000000000000000000000000000000010000000000000000000000010000000100000000001110011010010001000110100011001001000100000110001110000001011011111010110101111010,OPQLROPXZBGEEF-UHFFFAOYSA-N
N4CCC1=C(C=C(C(N1CC2(CCNC2)C3=CC(=CC=C3)F)=O)C#N)C4,7BF6A0A67C696A73_1A639490D8590BD7_6034_DP,8.357103,00000000000000000000000000000000000000000110000000000000000000100110000000010000101101110011100011101100110100111100011011100101110100100110001111011011011110100111110,CCGLPFMIQWXMKA-UHFFFAOYSA-N
FC1=CC=C(C=C1)CC2=NC5=C(C(=N2)N[CH]4C[C]3(C[C](C)(C3)C)C4)C(=CS5)C6=CC=C(C=C6)F,9EB768B2E436805E_33F07777619EDBBE_6041_UN,8.070388,00000000000100000000000000000000000010100010000100000000000000100110000000100100110100011001000010100100110110011001000011000100100001110100001001000101000110101111010,PYIVITJQXFRWMA-UHFFFAOYSA-N
N3CCOC(CC=CC1=C(C)[N](C(=C1)C)C2=CC(=CC=C2)F)C3,E07D5DD118521D4C_666FEFDB422237F3_7019_DP,8.192782,00000000000000000000000000000000000000000010000000000000010000100100000000010000001101110011000110111000100101010000001011100100110011110110001011011111110111101111110,IZMARDFPYFAKHF-UHFFFAOYSA-N
CN3CCCN(CC1=C(C=C(C=C1)NCC2CCSC2)F)CC3,9448464895F1AB3B_161383BD54725241_6041_UN,7.3212185,00000000000000000001000000000000000010000010000000000000000000000000000000010001101101111011010010001000000110010001101011100000110001110110001010011011010110101111010,ROEKPHHKBBSPIX-UHFFFAOYSA-N
N3CCOC(CC=CC1=C(C)[N](C(=C1)C)C2=CC(=CC=C2)Cl)C3,12321BE7BA799415_0CFEEEBCA2967E51_7019_DP,8.1927805,00000000000000000000000000000000000000000000000000000000010000100100000000010000001101110011000110111001100101010000001011100100110011110110001011011111110111101111110,IYQOIYBQUZNODN-UHFFFAOYSA-N
FC2=C[N]1C=NC=C1C=C2NC4C[C@H]3CCC[C@H](N3C)C4,13F034EA8CC44ACB_29DF34015701856F_6041_UN,8.487803,00000000000000000000000000000000000000000010000000000000000000000100000000010101100101010001010010100100110110010000101011100100110001110100001011011011000010101111010,NUVLUVSYNZUZQJ-YHWZYXNKSA-N
CC1=C(C=CC(=C1)N[C@H]2[C@H](CCNC2)C3=CC(=C(C=C3)F)F)CC#N,54B02697A27A083E_84AB42EABCAFB6F8_6041_DP,7.8643403,00000000000000000000000000000000000000000110000000000010000000100000000000000001001000110011000000101000100100010000101001000100110101110110001011010011010110101111010,QQWBZLOMMKLSNA-YLJYHZDGSA-N
ClC1=CC=C(C=C1)C2=CN(C(=N2)C3NCCC3)C[C@H]5N[C@H]4CCC[C@H]4C5,D5D8B27F3ECBAA6C_AE543BCD2C3F04AF_6034_UN,8.453558,00000000000000000000000000000000000000100000000000000000000000100100000000010101001101010011000010001101110100010000001011100100110100100110001010011011010110100111010,LZGOFCZVQCBCQG-PYUTUISCSA-N
CC1=CC(=C(C=C1)C)[C@@H]2CCCC[C@H]2OCC4=C(C3CNC3)OC=N4,C7E1C3E587792B04_56AAF03F601E3DF7_6039_DP,8.369513,00000000100100000000000000000000000000000000000000000000010000100100000000000000001100100110000111001000000011110000011011000111110010000110001111010111110111111111110,GPPFRMRAMDNBOR-FXAWDEMLSA-N
CN(CC1CCNC1)C2=NC(=NC=C2)N[C@H]3[C@@H](C3)C4=CC(=C(C=C4)F)F,42C0A60594A9615E_8122C9B1728D09C7_6041_DP,8.20021,00000000000000000000001001000000000000100010000000000000000000100100000000000100101101110011010010101000101110010001001011100100110101110110001011011011010110101111010,JMHNEFZCWSGLTR-CRLJJSMGSA-N
C1(=CC(=CS1)F)NC[C@@]3(CCC[C@@]4(C2=C(C=C(C(C)C)C=C2)CC[C@@H]34)C)C,11E7B4DDEB72A665_4A0A2D96DEE47A2F_7022_UN,7.9180064,00000000000000000000000000000000000010000010000100000000000000000010000000100000011100011011000010001100010110001001101000000100110001110100010011010101010110101111010,RUFQHKBYOZNDHD-OEMFJLHTSA-N
C1(=CC(=CS1)Br)NC[C@@]3(CCC[C@@]4(C2=C(C=C(C(C)C)C=C2)CC[C@@H]34)C)C,9A770B139A05D676_65705963E92A40BE_7022_UN,7.9180093,00000000000000000000000000000000000010000000001100000000000000000010000000100000011100011011000010001100010110001001101000000100110001110100010011010101010110101111010,WHYYSDXSHCHBRE-OEMFJLHTSA-N
CC[N]1C=CC2=C1C=C(C=C2)NCC3(C(C)(C3)C)C4=C(C=C(C=C4)F)F,E59EB9A1AB991500_5552BDFF5BF8000C_6041_UN,8.128771,00000000000000000000001000000000000000000010000000000000000000100110000000110000101101010011000010001100010110001011100001100100010001110110011011001111010110101111010,WMBGLWNSMVRQOD-UHFFFAOYSA-N
N1CCCC2=C1C=C(C(=C2)NC3=CC=CC(=C3)CN4C[C@H](C)O[C@@H](C4)C)F,026DE76B9193926A_808048CE9C3DE191_6041_DP,7.8358355,00000000000000000000000000000000000000000010000000000000010000000000000000010000001001110011000100101100110110010001001011100100100111110110001011011111110111101111110,ODLAVPSLOGYRMH-IYBDPMFKSA-N
FC2=C1N(C3=C(C1=CC=C2)CCCC3)C[C@H]4[C@@H](CNC4)C5CCOCC5,7324F9299B598A39_1B0B3D4EFAEBCD85_6034_UN,8.319698,00000000000000000000000000000000000000000010000000000000010000100100000000010000101101110011000010101100010101010000001011100100110010100110001011011011010111100111110,BYGHGRDNGCVZNY-LPHOPBHVSA-N
CC2=C1N=CC=C(C1=C(C=C2)NCC3N(C)CC4(CC3)CCC4)F,12ABBF9203800AE1_620F50793EF8D8AA_6041_UN,7.267007,00000000000100000000000000000000000000000010000000000000000000000110000000010001101001110011010000101100010110011001101011100100110001110110001001011111010110101111010,DIAFBLRBQIWYJW-UHFFFAOYSA-N
COC2=C(C=C1N=CC=C(C1=C2)NCC3(N(C)C)CCSC3)F,330F4A2B8B62D03B_0286BCFC8BC59911_6041_UN,7.7832704,00000000000000000000000000000000000010000010000000000000000000000110000000100001101101111011010010101100010110011100101011100111110001110110011111011111110111101111110,ROTXWGPKNAMEDC-UHFFFAOYSA-N
CC2=C(N=C1C(=CC=C(C1=C2)C)C)NCC3(CCC3)C#C,8393D4AACAD6A3F8_D75013A05B220494_6041_UN,7.9751053,00000000000100000100000000000000000000100000000000000000000000000110000000000100001000000011000000101100010010001000001001000100110001010100011011010111010110101111010,UNWITDVOYZUABP-UHFFFAOYSA-N