Added 202 molecules from epoch 17571 for Q92769

Q92769_molecules.csv

@@ -30125,3 +30125,205 @@ rxn:2:98290:143754,COCCCCN1CCC(Nc2cccc3c(C)cc(N4CCOCC4)nc23)CC1,WQSCWXWTOIPWIO-U
 rxn:2:99156:147839,COCC1(NC(c2ccc(C(C)(C)C)cc2)c2ccc3c(c2)OCCO3)CC2(CCC2)C1,BWFAYFACWCQWSI-UHFFFAOYSA-N
 rxn:2:99753:94431,CC1CC(F)(F)CCC1Nc1cn(CCN(C)C)nc1C1CCCCC1,VUDIKSUKHWRYPF-UHFFFAOYSA-N
 rxn:2:99804:123092,COCCc1cc(N2CCC(Nc3cccn(CCN4CCOCC4)c3=O)CC2)ncn1,XEFHCKOQBRHIQS-UHFFFAOYSA-N
+01F793CF77FDC8B7_AE0E9B89F9F858D7_6038_UN,N(C1=CC2=C(C=C1)C=CC=N2)C(C=C(C)C3=CC=C(C=C3)[N](=O)=O)=O,RJUPNGUNXTZTAR-UHFFFAOYSA-N
+02B90AE024E06372_5550355F24E467E7_6029_DP,OC(=O)CC1=CC(=CC=C1)N[S](C2=CC=CC(=C2)[S](O)(=O)=O)(=O)=O,LZCRIUBYWGAVFP-UHFFFAOYSA-N
+03B16B0C1FEB4F26_D9E8AE274BAFE84C_6038_UN,N(C1=CC=C(C=C1)C[N]2C=CC=N2)C(C3=CSC(=C3)C(C)=O)=O,RXSQFXMBWAQOSD-UHFFFAOYSA-N
+05EF88FAA4CE3CA9_04244902D6E87E54_6029_UN,OC1=CC(=CC=C1)CN(C2CC2)[S](C3=CC=CC(=C3F)CO)(=O)=O,BNDAQCRJKPKERR-UHFFFAOYSA-N
+078CE6E27930721B_28A6E47F0EABCDF4_7017_UN,N3([S](=O)(=O)C1=C(SC=C1)Cl)C(C2=CC=C(C)C=C2)C(CCC3)CN,CVFHOQTWRSBZQS-UHFFFAOYSA-N
+096AEBC66375AEA6_40CF2F270F8E4114_6029_UN,OC1=CC=C(C=C1)CC2CCCCN2[S](C3=CC=CC4=C(Cl)C=CN=C34)(=O)=O,HYJZRHWYHKWWLE-UHFFFAOYSA-N
+0AC3765D8C43014F_089197393555DF69_6041_UN,OC(=O)C1=C(C=CC(=N1)OCC=C)N[CH]3C[C]2(C[CH](N(C)C)C2)C3,MASNYINDUNRXFS-UHFFFAOYSA-N
+0C897A7C3A4EA30A_74FB314924A11AAA_6029_UN,OC1=C(C=CC=C1)CN(C2CCCCC2)[S](C3=CC(=CC(=C3)C(OC)=O)O)(=O)=O,WUYRYKPTCDHAKY-UHFFFAOYSA-N
+0E12596637A06DF0_C0EFE011E8715DAE_6039_UN,CCN(CCOCC1=CSC(=N1)CC(NC2=CC=C(C)C=C2)=O)C3(CCCCC3)C#C,MBFBQYRTVPXDJU-UHFFFAOYSA-N
+0ED493B3406F2F72_52EA47DAAA8773FB_6038_UN,CC3CCN(CC(NC(=O)CCOCC#C)CC1=C[NH]C2=C1C=CC=C2)CC3,IDMQFSQKLHEBBF-UHFFFAOYSA-N
+1009E48571CE8F9A_AABD11A42DEB1BA3_6041_UN,O=[N](=O)C2=C1N=C(C=CC1=CC(=C2)F)NC3CCC(CC3)(C#N)C4=NC=CC=C4,OPUHXKVNVYCEMH-UHFFFAOYSA-N
+101B183F3A5757E1_BA9EC81870F03CC8_6038_UN,N(C(CC1=CN=CC=C1)C2CCCC2)C(=O)C3=CC(=CC=C3)C4(CC4)C#N,VUJAGXLYUBPJJG-UHFFFAOYSA-N
+101EE1EE8A10ED15_C27EF1A3A1ED2171_6038_UN,CC1=NC(=C(C=C1)OC(C2=C(OC)C=CC(=C2)[N](=O)=O)=O)N,MMQSGIBAHKFWFG-UHFFFAOYSA-N
+10FE74EB445D451D_F28B6954869AE3EA_6034_DP,N1CC(C1)N2C=C(C#N)C(=O)N(C2=O)CC3=CC4=C(N=C3)C(=CC=C4)F,WWDBXUAFFOKWDV-UHFFFAOYSA-N
+11517190DB780F82_781ECB5D0CBADE4C_7019_UN,C(C1CCOCC1)=CC2=CC(=C(C=C2)O[S](=O)(=O)C3=C(C=CC(=C3)C)C)OC,CHFCJVXFPSFZRP-UHFFFAOYSA-N
+11740FD998A6CBE7_8CC94EB8C021A036_6039_UN,CN(C)C1(CC1)COCC(=O)C(C#N)C2=NC(=CS2)C3=CC=CS3,YUCXINSBOPGOHG-UHFFFAOYSA-N
+12521049D73BA96A_65049A5870D86A73_6034_DP,N1CC(C1)N2C=C(C#N)C(=O)N(C2=O)CC3=CC(=CC(=C3)F)C#N,ANWWILOUADXUQT-UHFFFAOYSA-N
+1360E69267DD2041_1E4CD415D278DA2E_7019_UN,C(C1COCOC1)=CC2=CC(=C(C=C2)O[S](=O)(=O)C3=C(C=CC(=C3)C)C)OC,YYEUZGKARCMFJU-UHFFFAOYSA-N
+1687414436319CB7_135ABE231CB86D5F_6031_UN,CC2=C1[NH]C=C(C1=CC=C2)CCC(=O)OCCN(C(C)C)CC3CCNCC3,CUDUTFPIYNZCBI-UHFFFAOYSA-N
+17D7314560F96031_D1F85F61BED6AB9C_6041_UN,O=[N](=O)C1=C(C2=C(N=C1)C(=C(F)C=C2)F)NC3(CN(C)C)COC3,GJMYOXCMQPKWRH-UHFFFAOYSA-N
+198EF24B1ABBF606_DDC3B54BDBC713F0_6035_UN,CN(C)C4(COC3=CC=C(C1=NC(=CS1)C2=C(N(C)C(N(C2=O)C)=O)N)C=C3)CCC4,QVQXUXAWDWIOFM-UHFFFAOYSA-N
+1AB6CB02233AC557_6C0D31AB9A1A8540_6026_DP,FC(F)COC2=C1C=CC=CC1=C(C=C2)[S](=O)(=O)N4CCCC3(CCNC3)C4,XIKIEQMVKDXQIH-UHFFFAOYSA-N
+1B65B0D8CCE66DC4_7E6F4CFE33A50A70_6031_UN,CN(C)CC[N]1C(=C(C=N1)C(=O)OCC2=C[N](=CC=C2)=O)C,NMUFDGOTAUCQCF-UHFFFAOYSA-N
+1B6CB01590DB1D17_8E7DC00AD9237FCA_6038_UN,O(CC1=CC=C(C=C1)[S](=O)(=O)O)C(=O)C3CCC2(CC2)CC3,QRNVUBSOOFHVKP-UHFFFAOYSA-N
+1BC2560820874083_C8044D2DDE71A044_6029_UN,OC1=CC=C(C=C1)CN(C2CCCCC2)[S](C3=C(C)C=C(C=C3)O)(=O)=O,ZHBUYVNAAOMOIL-UHFFFAOYSA-N
+1CF56D6ADC23DE2A_CDEC245AFA814877_6038_UN,CCCN(CCC)CCNC(=O)C1=C(C2=C([NH]1)C=CC=C2)C#N,FOSWBXBZOXAAAZ-UHFFFAOYSA-N
+1D37941CF4C25F4F_B3C3EB278181F8FA_6038_UN,CCN3C(=C(C1=CSC(=N1)C2=CC=C(C=C2)OC(C(C)CN(C)C)=O)C(=O)NC3=O)N,PEWQJJNSPCHJAQ-UHFFFAOYSA-N
+1D3E649D058A6A80_76DFA1A06E6F11C4_6038_UN,CCN(CC)CCNC(=O)C1=C(C2=C([NH]1)C=CC=C2)C#N,JZCBOIRWAHXBNC-UHFFFAOYSA-N
+1DAC4227C93FAF53_E62C45B498782F9F_6038_UN,CC[N]1C=CC=C1CCNC(=O)C2=C(C3=C([NH]2)C=CC=C3)C#N,BIWAMDWBRNECOF-UHFFFAOYSA-N
+1F1E2F5FF8734005_E08957F87067B74B_6034_UN,O=[N](=O)C1=CN(C2=C1C=C(C=N2)Br)CCNC3CCN(C)CC3,MRBUIQVFDQMLFI-UHFFFAOYSA-N
+21F5234C3756534F_5BCCB1E4589F41DC_7009_DP,N([S](=O)(=O)C2=C1C=CC=CC1=CC=C2)C(C4=CC3=C(CCCNC3)O4)=O,PJNZFFGFGOHKJX-UHFFFAOYSA-N
+2205EDBB1630273B_BAA5CECD9352524C_6041_UN,CC4=C(C)C1=C(N=CN=C1NC3=CC=C([S](N(C)C2CCN(C)CC2)(=O)=O)C=C3)[N]4C5CCCC5,YZPAESFPFVOPPE-UHFFFAOYSA-N
+23FAC00B58B985A5_FB6724F37EFF6F7E_6038_UN,O(C1=CC2=C(N=C1)C=CC=C2C#N)C(C3=CSC(=C3)[S](N)(=O)=O)=O,MIHXDJQDEIOYGY-UHFFFAOYSA-N
+26DCC7103552D52D_31D8EE674C16547D_6038_DP,CN(C)CC1CCN(CC1)C(=O)C2=CC(=C(C(=C2)NC(C4=C[N](CC3OCCNC3)N=N4)=O)Cl)Cl,WYMPEVCQTOUJOU-UHFFFAOYSA-N
+27C16C1778AB8EA1_42149F8FA0D640CC_6038_UN,CC(C)N(CCNC(C2=C(C1=C(C=CC(=C1)CC)[NH]2)C)=O)C(C)C,DJEJJQTYPWZCHR-UHFFFAOYSA-N
+27F247CAFD4663AF_BF84493DA2BC1C88_6041_UN,CC4=NC1=C(C(=CS1)C2=CC=C(C=C2)NC3CC[Si](C)(CC3)C)C(=O)N4N,HNAFKWRSJHCLJQ-UHFFFAOYSA-N
+283032AB6FAE233C_77F6AEC91EF83A84_6026_UN,CCCOC1=CC=C(C=C1)[S](=O)(=O)N(CC2=CN=CC=C2)C3CC3,WVGVKNXMOAJJOK-UHFFFAOYSA-N
+295D5BAEE7CF93E2_DADABAA2F2F291C6_6026_UN,[S](=O)(=O)(C1=CC2=C(C=C1)COC2)N[S](=O)(=O)C3=CC=C(C=C3)C4CCCCC4,TYMWXAQTYAYAJZ-UHFFFAOYSA-N
+298C55EBA43F82BD_FE589EEE6EBA8118_6004_DP,N1CCC(CC1)NC(=O)C2=CN=C(C=C2)C3=CC=CC(=C3)CO,ORXFXOFUVSLTDX-UHFFFAOYSA-N
+2A5E4134F7C1C072_8FF08CBFC2228FD5_6041_UN,CCC(=O)CC1=CC=C(C=C1)NC3(C2=NOC(=N2)CN(CC)CC)CCCC3,ICOOSOSNBRSIPP-UHFFFAOYSA-N
+2D0C715C93AFB068_03C09FD9364DAEB5_6041_UN,O=[N](=O)C1=C(N=CC(=C1)C#N)NC(C)C2=C(C=CC(=C2)F)N3CCN(C)CC3,QOWIHAALEUFHIZ-UHFFFAOYSA-N
+2D6799254454AF2F_BE8868C07CB4D28D_6026_UN,O=[N](=O)C1=CC(=C(C(=C1)Cl)Cl)[S](=O)(=O)NC2(CCOCC2)C3=NC=CC=N3,HXUXKKNPCHVSNK-UHFFFAOYSA-N
+2D70BECDCFA56362_06CAB9BF69CD90EA_6029_UN,OC1=CC=C(C=C1)CN(C2CCCCC2)[S](C3=C(C=C(C)C=C3)C)(=O)=O,XYZADMSOCRDQHR-UHFFFAOYSA-N
+2D725789FA07D001_27E14912B5766FEC_7017_UN,CC2=C1C=CC=C(C1=CC=N2)[S](=O)(=O)N4CCN(C3=C(C=CC(=C3)N)F)CC4,BGPRXLZXFPFORO-UHFFFAOYSA-N
+2F1F225FC0E1C89E_9A271BA98BBB4EF1_6034_UN,O=[N](=O)C1=CN(C2=C1C=C(C=N2)Br)CC3(CCl)CN(C3)C4CC4,KVUJREIPFROFOF-UHFFFAOYSA-N
+3022D011C8E7B049_C4E5E861D4056E53_6026_UN,O=[N](=O)C1=CC(=C(C(=C1)F)F)[S](=O)(=O)NC2(CCOCC2)C3=NC=CC=N3,ZUILCXIKPYEQRP-UHFFFAOYSA-N
+31E30D96F4DCCC85_D11F3686644357E6_6035_UN,CN(CCOC2=C1C=CC=C(C1=NC=C2[N](=O)=O)OCC(F)(F)F)C3CCNCC3,FPBNMGLJJWOJDW-UHFFFAOYSA-N
+36D78F63BB57C4C5_EA92E5B0F1DA58A0_6029_UN,COC1=CC(=C(C=C1)N[S](C2=C(OC)C=C(C=C2)C3CC3)(=O)=O)[S](=O)(=O)C,SLMHKYKZKQCGRN-UHFFFAOYSA-N
+3AA75FD0F3826575_6E09FF0E8052E02C_7009_UN,N([S](=O)(=O)C2=C1N=CC=CC1=CC=C2)C(=O)C3=CC4CCCC34,WJUKUHLSMYDHOE-UHFFFAOYSA-N
+3DB84E2AF7118693_147CDAF37923A0AC_6041_DP,C1(=CC2=C(C=C1)[NH]C=C2CC#N)NCC(C3CNC3)F,GFEJLSVRRHDRRD-UHFFFAOYSA-N
+3E1D15C5EC3F27F8_94B60720F1F4B883_6038_UN,N(CC1(CCC1)C2=CC=NC=C2)C(=O)C=CC3=CC(=CC=C3)C#N,JYKVHKZZKOTJIP-UHFFFAOYSA-N
+40BCA183E8A47127_41EF9D531526BCD6_6038_UN,O(C1=CC2=C(N=C1)C=CC(=C2)C#N)C(C3=NC=CC(=C3)[S](N)(=O)=O)=O,JCBNVIAGMRPNGB-UHFFFAOYSA-N
+40FD8A31A98FD660_AF42D6ED76386AD3_7013_UN,N2=C(C1=C(C)[N](C(=C1)C)CC#N)[N](C3=C2C=C(C=C3)Br)C4CC4,RSDGDWDRSQNAAC-UHFFFAOYSA-N
+418884B889C6BA8D_813914E1D812AEDA_6029_UN,OC1=C(C=CC=C1)CN(C2CCCCC2)[S](C3=CC(=C(C)C=C3)CO)(=O)=O,SLEIWDBLGABCPS-UHFFFAOYSA-N
+47F3DD8E374C9BE0_38523DE626CB54FA_6035_UN,NC1=NC=C(S1)C4(OC3=C2C=CC=C(C2=NC=C3[N](=O)=O)OC(F)F)CCNCC4,GESDVOHDSKWZNZ-UHFFFAOYSA-N
+48F57D5FDD0491E0_08BAB7C02BA4D7EC_6038_UN,CN(C)CC1CCN(CC1)C(=O)C2=CC(=C(C(=C2)NC(=O)C3=C[N](N=N3)C4CCOCC4)Cl)Cl,IBAPFKFMNRKDRK-UHFFFAOYSA-N
+4B1041A32C924D22_6949DE866A02C617_7019_DP,CC1CCC(CC1)N(C2CC2)C(=O)C=CC3=CC=CC(=N3)C4=CC=C(N)C=C4,RTJHSEDAYXNGBW-UHFFFAOYSA-N
+4C61FAFE70531418_214E097B45ED1AE1_6038_UN,N(C1=CC=C(C=C1)C[N]2C=CC=N2)C(C3=CC=CC(=C3)C(C)=O)=O,ADGBECMAKXMVNU-UHFFFAOYSA-N
+4D54455DA5EADD51_E0507E5AE3274EBC_6038_UN,N(C1=CC=C(C=C1)C[N]2C=CC=N2)C(C3=CN(C)C=CC3=O)=O,GPLJNTFSROCRSO-UHFFFAOYSA-N
+4E0E77076F325234_17CA2A29310EF995_6029_UN,O[S](=O)(=O)C1=CC2=C(C=C1)CCN2[S](C3=NC=CC(=C3O)OC)(=O)=O,OGRXPRCSYLRVCQ-UHFFFAOYSA-N
+4E26278360467B7A_7B361293FDB29FDF_6029_UN,OC1=CC=C(C=C1)CN(C2CCCCC2)[S](C3=C(C=C(OC)C=C3)C)(=O)=O,VMHFARXKQJCLGE-UHFFFAOYSA-N
+502239578C91950F_B73535976D17E533_6031_UN,CC1=C(SC2=C1C(N(C=N2)C)=O)C(=O)OCC4=CC(=C(N3CCN(C)CC3)C=C4)F,DCVSJYANZFGZEW-UHFFFAOYSA-N
+512029954CE4EB6D_DBC7F814DD8041E9_6005_UN,OC(=O)C1=CC(=CC(=C1)O)C2=CC=C(C=C2)C3(O)CCC3,PTRTXEQPAZFOBN-UHFFFAOYSA-N
+525ADE4FC289A455_B28F1337D24E0F0F_6031_UN,COCC[N]1C(=C(C)C2=C1C=CC(=C2)C(=O)OCC(C3=CC=CC(=C3)C)N4CCNCC4)C,JPFCPYXCGJAAMM-UHFFFAOYSA-N
+58A3F52D092575E4_9DDD2EB9FFEFB100_6038_UN,N([C@H](C1CCC1)C2=CN=CC=C2)C(=O)C3=CC(=CC=C3)C4(CC4)C#N,BTMNHLZBRDEAMD-LJQANCHMSA-N
+5A098C8E7AE907ED_FADA591CE04FEEB6_6004_UN,COC(=O)C1=CC(=C(C(=C1)Cl)O)C3=C2CCOC2=CC=C3,DEXIPFSQOYDSAM-UHFFFAOYSA-N
+5BF5F16CE32F16F8_ECAA5C1210ECA77C_6029_UN,N(CC1=C(C(=CC=C1)O)O)[S](C2=CC(=C(C=C2)O)OC)(=O)=O,YAWBDRSZPDVUGR-UHFFFAOYSA-N
+5D119676E900BE01_95A496A8E7D242AC_6039_DP,O[C@@H]2C[C@H](OCC1=CC=C(C[S](C)(=O)=O)C=C1)C23CCOCC3,QOYYXTSODDWLTM-CVEARBPZSA-N
+5DAA3C168D101950_71D728FBDDBD6ACA_7017_UN,N4([S](=O)(=O)C1=CC2=C(C=C1)N=C(Cl)C=N2)CCC(C3=CC(=NC=C3)N)C4,IYYGADRGJOTEMX-UHFFFAOYSA-N
+5DD5F1E08769B507_E32B7CAB9B12AB60_7017_UN,N4([S](=O)(=O)C2=C1N=CC=CC1=CC(=C2)Cl)CCN(C(C)C3=CC=C(C=C3)N)CC4,BVQMZZNCDVSJRS-UHFFFAOYSA-N
+5E3404679319B23D_A23A5CE1CCFDEDA7_6029_UN,N([C@H]1[C@H](CCCCC1)C(=O)O)[S](C2=CC=CC(=C2)[S](Cl)(=O)=O)(=O)=O,DWPIJFFKHVSIMG-QWHCGFSZSA-N
+5EF679946BF64583_B6492F94348F0496_6034_UN,CC1=C(C2=C(S1)N=C(N)N(C2=O)CC3(CN(C)C)COC3)C,DBVINBMANZSHHF-UHFFFAOYSA-N
+5F9E71A006543814_F8DC387626E09FC9_7017_UN,N4([S](=O)(=O)C1=C(C2=C(C=C1)C=CC=C2)F)CCC([N]3N=C(C)C=C3N)CC4,VSLUXKAFZPWKBI-UHFFFAOYSA-N
+6106A083AE18B393_BF1377682761D349_6029_UN,O[S](=O)(=O)C1=CC2=C(C=C1)CCN2[S](C3=CC=CC(=C3OC)CO)(=O)=O,CXTLKWXMAOLJBS-UHFFFAOYSA-N
+62A0D22520FF0054_65D87E9B3B1087AB_6041_UN,C1(=C(C(=CC=C1)C#N)N=C=O)NC3=C([N]2N=C(C)C=C2C)C=CC=C3,OFMKZWCULWAPDB-UHFFFAOYSA-N
+649E603F19A2CD15_6D3E8F4644FEDE59_6029_UN,COC1=CC=C(C=C1)C2CN(CCC2)[S](C3=C(C=CC(=C3)[C@@H](C)O)F)(=O)=O,QIXCAYAEJGWAKE-XPCCGILXSA-N
+6706359914B6458B_D45EF9631D83DF08_6038_UN,N(C1=CC(=CC=C1)C[N]2C=CC=N2)C(C3=C(C=C(C)C=C3)[N](=O)=O)=O,SWZZUJLHHONOGX-UHFFFAOYSA-N
+67C1DFC41A5E8918_69A9C968E32B6243_6029_UN,OC1=CC=C(C=C1)CN(C2CCCCC2)[S](C3=CC(=C(C=C3)CCCO)OC)(=O)=O,JQPZHZNWBYFIBN-UHFFFAOYSA-N
+683244711E6689FB_60CD9882953E32B1_6038_UN,CCN1CCC2=C1C=CC(=C2)CNC(=O)C3=CC(=C[NH]3)C#N,BRGBJEUJVDSHTJ-UHFFFAOYSA-N
+6A33862649B900E8_74316843F476D662_7017_UN,CC1=C(C2=C(C=C1)C=CC=N2)[S](=O)(=O)N4CCN(C3=C(N)C=CC(=C3F)Cl)CC4,GOMJYIQYJXDHCB-UHFFFAOYSA-N
+6B14A64566B734F9_F748A01DC29B05A5_7009_DP,N([S](=O)(=O)C2=C1N=CC=CC1=CC=C2)C(C3NC4(C3)CCC4)=O,ORZOAQUEHRNMME-UHFFFAOYSA-N
+6B8C47023A6F77B7_7F426682C87D16B7_6041_UN,OC(=O)C1=C(C=CC(=C1)NC3(C2=C(OC)C=CC=C2)CCC3)N4CCOCC4,AHIPTTUNNUHGGW-UHFFFAOYSA-N
+6D780C7C04D1601F_0AE86B77AAFC5DF1_6029_UN,COC1=CC=C(C=C1)CC2CCCN2[S](C3=CC(=C(C(O)=O)C=C3)I)(=O)=O,NZKYFKKSAKEXBW-UHFFFAOYSA-N
+6DFBED04847FD5A0_36D4C37A1217E824_6038_UN,N(CC1=CC2=C(C=C1)C=CC=N2)C(C3=CC(=C(C)C=C3)C)=O,MMYDXPDNWHLNBU-UHFFFAOYSA-N
+70D92294A21D2753_B69C9F75225722A7_7017_UN,N4([S](=O)(=O)C1=CC=C(C=C1)C2CC2)CCN(CC3=CC=CC(=N3)N)CC4,JMDWQPGLDVFOES-UHFFFAOYSA-N
+71AFB83B3A3E5DC8_60C33E134AE0165A_6026_UN,O=[N](=O)C1=C(C=C(C(=C1)F)Cl)[S](=O)(=O)NC2(CCOCC2)C3=NC=CC=N3,VLQQULHKKNJAJS-UHFFFAOYSA-N
+73861DB76A2D3FC9_F52E8F79CD0847F1_6029_UN,FC1=CC=C(C=C1)OC2CCN(CC2)[S](C3=CC(=C(C)C=C3)CO)(=O)=O,QYJNSGJKIITCFF-UHFFFAOYSA-N
+73B580C2EABB88A1_753F8CA6E0F714F8_6029_UN,O=[S]1(=O)CCN1[S](C3=C2C=CC=NC2=C(CBr)C=C3)(=O)=O,IMOWBPOXVZKPGA-UHFFFAOYSA-N
+7653EC7011108A1F_02C59CB6AA60CB69_6029_UN,OC1=C(C=CC=C1)CN(C2CCCCC2)[S](C3=CC(=CC(=C3)C(=O)O)OC)(=O)=O,LBJRONBJFULPGW-UHFFFAOYSA-N
+7672682DA0E62AC6_0F896D5B0B109B41_6026_UN,ClC2=C(C=C1C(CCC1=C2)=O)[S](=O)(=O)NCC3=CC=C(C)S3,QTTHBTLKBRCVRJ-UHFFFAOYSA-N
+76B4A53F4B793765_DE68BBDEA82213A0_6029_UN,N([S](=O)(=O)C1=C(C=C(C=C1)Cl)O)[S](C2=C(C=CC=C2)C34CCCCC3O4)(=O)=O,FIRNYRGPRXRBAX-UHFFFAOYSA-N
+78435B6B093269E7_C9823A02433410E8_6029_UN,CC1=CC=C(S1)C2=C(C=CC=C2)N[S](C3=CC(=C(C=N3)[N](=O)=O)C)(=O)=O,HDSBKAKEIZXNJT-UHFFFAOYSA-N
+7B1A77E0CC5E175C_7C9755C9F888B5B6_6029_UN,OC1=CC=C(C=C1)CN(C2CCCCC2)[S](C3=C(C=C(C)C=C3)CO)(=O)=O,ALYLCUBKADOWQH-UHFFFAOYSA-N
+7CC09187DA254A66_14686496FD7C4FEB_7009_UN,N([S](=O)(=O)CC2=C1N=CC=CC1=CC=C2)C(=O)C3=CC4CCCC34,KTJMHDJSTQLTJD-UHFFFAOYSA-N
+7D1D09B08F886647_9936EF53B3BDC45A_6038_UN,CCC1=C(C(=CC=C1)C)OC(CN2[S](N=C(C)C=C2C)(=O)=O)=O,WKHGDDNKEPAUEJ-UHFFFAOYSA-N
+7F6816E198C113A9_B3AA18CC59140D86_6029_UN,OC1=CC(=CC=C1)CN(C2CC2)[S](C3=CC(=C(C=C3)S)C)(=O)=O,UWRLVERAEPADMB-UHFFFAOYSA-N
+820DBBE41A6EDE2A_6C91FACEF560D163_6038_UN,N(C1=CC(=CC=C1)C[N]2C=CC=N2)C(C3=CSC(=C3)C(C)=O)=O,YNLYHLQFEMNQNR-UHFFFAOYSA-N
+82954F0C35DE2A23_F5A08113D7C8A066_6029_UN,COC1=CC(=CC(=C1)N[S](C2=C(OC)C=C(C=C2)C3CC3)(=O)=O)[S](=O)(=O)C,ZMBKEQNOHSMTLQ-UHFFFAOYSA-N
+8342FB161666BD8B_2AAE292D555FCF91_6039_UN,CN(C)CC3(COCC(=O)C(C#N)C1=NC(=CS1)C2=CC=CS2)CC3,BJKSHMFZOOWMGY-UHFFFAOYSA-N
+842FDFBF9644452A_DBE08FAD114EB293_7017_UN,N4([S](=O)(=O)C2=C1C=CN=CC1=C(C=C2)F)CCC(C3=N[N](C)C(=C3)N)CC4,SVBWNYUWVSSUSD-UHFFFAOYSA-N
+8506C4764FE7FACE_DA24329121568A42_7009_UN,N([S](=O)(=O)CC1=CC2=C(C=C1)COC2)C(=O)C4=C3SC=CC3=CC=C4,UJIIGSDBOFDMPW-UHFFFAOYSA-N
+868BC6800282CF3C_E6B1C07E83FC7F59_6004_UN,COC(=O)C1=CC(=C(C(=C1)Cl)O)C2=CC3=C(C=C2)CCO3,GZPYBAXHDWCNSP-UHFFFAOYSA-N
+86D552013A5DE533_2810A37E30EFC9EA_6038_UN,COC1=CC2=C(C=C1)N=CC(=C2OC(C3=NC(=C(C=C3)[N](=O)=O)N)=O)C#N,BAQMGLJOGFWAJN-UHFFFAOYSA-N
+8B62FA0E435364BF_CDD608E9D0BA496F_6029_UN,COC1=CC=C(C=C1)C2CN(CCC2)[S](C3=C(C=CC(=C3)[C@@H](C)O)Cl)(=O)=O,LMBUYYUMFVSPCI-XPCCGILXSA-N
+8B8CB0994CF1237B_BE26CBBD4056BF59_6038_UN,CC1=C(C=CC(=C1)OC(=O)C[N]2C=C(C#N)C=N2)[S](=O)(=O)C,CJMIVXYUQJJRIA-UHFFFAOYSA-N
+8BB75BA155B28781_3A79184A9A79C9EB_6029_UN,OC1=CC=C(C=C1)CN(C2CCCCC2)[S](C3=CC(=C(C)C=C3)S)(=O)=O,CPYAXJCINHQRNA-UHFFFAOYSA-N
+8C165CF858A5BE79_7A2B0BF03EDF4C6C_6041_UN,O=[N](=O)C1=C(N=CC(=C1)NC(C)C2=C(C=CC(=C2)F)N3CCN(C)CC3)C#N,HLACEVWHYBYGNA-UHFFFAOYSA-N
+8C6613548EBD3ADA_597AAA984AC7B962_6034_DP,N1CC(C1)N2C=C(C#N)C(=O)N(C2=O)CC4=C3N=CC=CC3=CC(=C4)Br,WTXQRSSWIAYTKF-UHFFFAOYSA-N
+8CA915CE2585C822_2F1A242877E5B45C_7009_DP,N([S](=O)(=O)CC2=C1N=CC=CC1=CC=C2)C(C3CCNC34CC4)=O,POXIGTIZJDFVJQ-UHFFFAOYSA-N
+8D2AC485E5DA8472_8830E76F6DD18456_6029_UN,OCCCN(C(=C1N=CC=CC1=O)O)[S](C2=CN=C(F)C=C2I)(=O)=O,PMNGXPPHMZJZGD-UHFFFAOYSA-N
+8DC25AC4CA335FE7_B40A6DC0AF181885_6038_UN,O(C1=C(C=CN=C1)C#N)C(C2=C(C)SC(=C2)C(OC)=O)=O,HQCSPUBJWLSWJH-UHFFFAOYSA-N
+8DEF247533B17FC6_E6C82B406EBA56D8_6038_UN,O(C1=CC=C(C=C1)[S](=O)(=O)O)C(=O)C2=CC3(C2)CCOC3,MZMOYGDQOWQGOP-UHFFFAOYSA-N
+8F4E3815CE077873_C0DF1DF372704AC3_6038_UN,CC1=C(C2=C(N=C1)C(=CC=C2)C)OC(C3=NC(=C(C=C3)[N](=O)=O)N)=O,AOTRSMREHZMQPA-UHFFFAOYSA-N
+92C2771D420120A7_A0D36C7000287FEA_6038_UN,N(CCC1=CN=C(C=C1)N2CCC2)C(=O)C3=CC(=CC=C3)C4(CC4)C#N,XSGGDBXHACMMNK-UHFFFAOYSA-N
+92F724FCABEBBDCA_94375D92FB2223CE_6038_UN,N(C1=CC(=CC=C1)C[N]2C=CC=N2)C(C3=CC=CC(=C3)C(C)=O)=O,HQXPATAWABEYNE-UHFFFAOYSA-N
+941A2C83D8E73595_B85D2FC20533130F_6029_UN,OCC1(CCCN1[S](C2=CC=CC(=C2F)C[S](=O)(=O)Cl)(=O)=O)C3=CC=CC=C3,OAQPOETXNXURAU-UHFFFAOYSA-N
+96051C74867881CD_75A72AB065D18C2B_6026_UN,[S](=O)(=O)(C1=CC2=C(C=C1)COC2)N[S](=O)(=O)CC3=CC=C(C=C3)C4CCCCC4,NMDQKXYXXFMUDS-UHFFFAOYSA-N
+96078A07822D0058_442AA83CF1CACCC4_6038_UN,N(CCC1=C(C=CC=C1)C#N)C(C2=C(CC)SC=N2)=O,SWWKGNSHXCOXMJ-UHFFFAOYSA-N
+96E92EF5C911AA84_AFB6FD0618E5DD9F_6038_UN,N(C(CF)C1=CC(=CC=C1)C#N)C(C2=N[N](C=C2CN3CC(N(C)C)CC3)C)=O,XRZAXPHGHUZCSF-UHFFFAOYSA-N
+99BC311E4EE42DD3_DF44A014B9AF1184_6038_DP,N(C1=C(C=CN=C1)C2=CC=C(C=C2)F)C(C4(C3CCNCC3)CCOCC4)=O,PHBIPMDEGDROTD-UHFFFAOYSA-N
+9AAF1D5131BB6AD5_E5D506BA88086F2B_6038_UN,CN(C)CC1CCN(CC1)C(=O)C2=CC(=C(C(=C2)NC(C(C)(C)C3=CSC=N3)=O)Cl)Cl,UJAUEGFXMRJMIP-UHFFFAOYSA-N
+9BDF3A4D336AFB20_609F877478E5C86D_6038_UN,COCCCC(NC(=O)C1(CCF)CC1)C(=O)N(C)C,HRCUPUUIDWUTGB-UHFFFAOYSA-N
+9D90EF725AE4B6DF_8D293B85BFB5AA62_7009_DP,N([S](=O)(=O)CC2=C1N=CC=CC1=CC=C2)C(C3NC4(C3)CCC4)=O,ALZQHTDXPFZXES-UHFFFAOYSA-N
+9DBB878F94061186_198F27A53DB9E993_6038_UN,N(CCCCN1CCN(CC1)C2=NC=CC=N2)C(=O)C(=O)C=CC3=CC(=C(C=C3)F)F,XCHLLFLYOKZZFM-UHFFFAOYSA-N
+9E465E3E0D3E0555_A715252A2E3FAD7C_6038_UN,N(CC=CC1=CC=CC=C1)C(C2=CC(=C(C=N2)C(=O)N)C)=O,ONTCXQXMQRGLDF-UHFFFAOYSA-N
+9F972FA6EDA20542_9CA2E287A8D143A9_6029_UN,OC1=CC=C(C=C1)CN(C2CCCCC2)[S](C3=CC(=C(C=C3)O)OCOC)(=O)=O,UVDZJIILUKWXBX-UHFFFAOYSA-N
+A132F7ED7A925DF0_D6AB924C5766A4A8_6038_UN,N(C1=CC(=CC=C1)C[N]2C=CC=N2)C(C3=CC(=CS3)C(C)=O)=O,GBYMQUZDRMTGDE-UHFFFAOYSA-N
+A1B56BA90841499F_4706E4F290746C94_6026_UN,CC1=C(C=C(C(=C1)Br)[N](=O)=O)[S](=O)(=O)NC2(CC2)C3=CC=C(Br)S3,QNQBIAOQZYBVMX-UHFFFAOYSA-N
+A3E73405282A7E08_5C418ECD3A3432BD_6038_UN,CC5CCN(CC(NC(=O)C1(CCC1)C2=C(C=CC=N2)F)CC3=C[NH]C4=C3C=CC=C4)CC5,BANSCDUGSNYUDA-UHFFFAOYSA-N
+A46BB8F32F57B568_799060C1DA027E13_6038_UN,CC1=NC(=C(C=C1)OC(C2=CC(=C(OC)C=C2)[N](=O)=O)=O)N,WFLJGZHVQJBFBU-UHFFFAOYSA-N
+A76CF30ED1AE3C5C_A2BD808971083566_6036_UN,C(C12N(CCNC1)CCOC2)N(C4=CC=C(C3=CSC(=N3)N)C=C4)[S](=O)(=O)C5=CC=C(C=C5)Cl,ISMSWXVJHBFNKA-UHFFFAOYSA-N
+A7DC135FC25AD852_AB7B8663BE844BEB_6026_DP,FC(F)COC2=C1C=CC=CC1=C(C=C2)[S](=O)(=O)N4CCC3(CCCN3)C4,WBIVEFZSDJCVHD-UHFFFAOYSA-N
+A9219849414FBC3E_755C125FAC53B614_6029_UN,OC1=C(C=CC=C1)CN(C2CCCCC2)[S](C3=C(C)C=C(C=C3)CO)(=O)=O,URIVRTWQXAVPIX-UHFFFAOYSA-N
+A9247D11C5BF0DE2_288282E20EEBA1EF_6026_UN,FC1=C(C=CC(=C1)[S](=O)(=O)NCC3=CC=C(CN2CCN(C)CC2)C=C3)Br,XBKBXCSALLGEBX-UHFFFAOYSA-N
+ABF98CDD0C8FBBC0_AA1DAC5CC3502921_6029_UN,COC1=CC=C(C=C1)C2CN(CCC2)[S](C3=CC=CC(=C3F)CCO)(=O)=O,QLJWOVJHFSMPIP-UHFFFAOYSA-N
+AC0BE3502ACB20B2_F833F0CFFC1C1832_6026_DP,FC(F)COC2=C1C=CC=CC1=C(C=C2)[S](=O)(=O)N3C4(CNCC3)CC4,LTLDQSBUYWOMKI-UHFFFAOYSA-N
+ACACF6B9A248EEB7_BEEE216B1772B541_6038_UN,N(C(CC1=CN=CC=C1)C2CCCC2)C(=O)C3=CC=C(C=C3)C4(CC4)C#N,RLSUWHPEJOZNHO-UHFFFAOYSA-N
+AE7D92B612685CAC_03E47E45FC1BEA41_6035_UN,O(C1=COC=C(Br)C1=O)C3=C2C(OCC2=CC(=C3)OC)=O,QRCFTDJYKZLNCT-UHFFFAOYSA-N
+B05D55E154609BDE_9E92A0D2A80DE6C6_6034_UN,CC1=CN(C(=O)N1C2=CC=C(C=C2)C#N)CCC3=C([NH]N=C3C)C,UKZVPWHKXHQYKZ-UHFFFAOYSA-N
+B354E26A8F30C638_39CA7BABD3C59F13_6034_UN,O=C1N(C(=O)N(C=C1C#N)C2CCCC2)CCSC4=C3C=CC(=CC3=NC=C4)Cl,LKYKUTACROXCFW-UHFFFAOYSA-N
+B3BC20087E95BB5A_C2C3D0C34DD7E339_6038_UN,CC5CCN(CC(NC(=O)C1(CC1)C2=C(C=CC=N2)F)CC3=C[NH]C4=C3C=CC=C4)CC5,MSTIWYCFCPWWPT-UHFFFAOYSA-N
+B4EB2547D58CCB09_2A399406432D5C00_7017_UN,N4([S](=O)(=O)C2=C1C=CC=NC1=C(C=C2)F)CCC(C3=CC(=NC=C3)N)C4,LMVIKYRRLSCHPT-UHFFFAOYSA-N
+B5DCB5174D16A0C7_FD690A8B164E2464_6034_UN,O=[N](=O)C1=CN(C2=C1C=C(C=N2)Br)CCN(C(C)C)CC3CCNCC3,DGOMFFKCTBYQMZ-UHFFFAOYSA-N
+B5E334FFC02B6D32_8C8F72C94EA68B5D_6039_UN,CCN(CCOCC(NC1=CC=CC(=C1)C2=CSC(=N2)C)=O)C3(CCCCC3)C#C,UKXRDYBQMFHSGK-UHFFFAOYSA-N
+B88E7017E0A9A961_38972C609FBDA752_6038_UN,CC=CCCCNC(=O)C1=C(C2=C([NH]1)C=CC=C2)C#N,JXFMGYSMWKSPSN-UHFFFAOYSA-N
+B9A407D8BA8E57EE_141EAA8E298E49A9_6029_UN,N(C1(CC1)C(=O)O)[S](C2=CC(=CC3=C2C=CC=C3)OC)(=O)=O,YUXHODCRBHDIBX-UHFFFAOYSA-N
+BB23C5F66710F54A_BF7FE0F22DF1637C_6031_UN,OC[N]1C=CC(=N1)C(=O)OCC2=C(OC)C(=CC=C2)Br,RVTMJSGSYRHUJR-UHFFFAOYSA-N
+C36E032B084DDC48_D38F9FC9F90AADB3_7019_UN,OC1=C(C=CC=C1)CC=CC2=CC(=C(C)C=C2)C3CC3,LQUGUQVGFIVRFC-UHFFFAOYSA-N
+C3D175739E06444B_F7775C2EFA7137B5_6029_UN,N(C1(CCOCC1)CCC(=O)O)[S](C2=CC=CC3=C2C=CC(=C3)C)(=O)=O,RNKKXPRSRRWHQA-UHFFFAOYSA-N
+C462196958FC763B_731F377877DFE775_6026_UN,O=[N](=O)C1=C(C=C(C(=C1)F)Br)[S](=O)(=O)NC2(CCOCC2)C3=NC=CC=N3,XSBYWTWJCOMKMO-UHFFFAOYSA-N
+C4A1E800BD22C375_152768453F61C147_6029_UN,CCCC2CCC1=C(C=CC=C1)N2[S](C3=NC=CC(=C3O)OC)(=O)=O,STPPGZBSHKBVJQ-UHFFFAOYSA-N
+C5ED4BA9A7668CDB_1A39F9B016070641_6041_DP,O=[N](=O)C1=C(N=CC(=C1)C#N)NCC2(CNC2)C3=NC=C(C=C3)F,RQCJTLBXRYVQIT-UHFFFAOYSA-N
+C7B2F8254DDA5FFE_637CF5A6EB089702_6029_UN,N([S](=O)(=O)C1=CSC=C1)[S](C2=C(C=CC=C2)C34CCCCC3O4)(=O)=O,KALMHWNPYTVZPC-UHFFFAOYSA-N
+C904F853E2DF32CD_792C802ED36D1FB9_7017_UN,CC1=C(C2=C(C=C1)C=CC=N2)[S](=O)(=O)N4CCN(C3=C(N)C=C(C(=C3)Cl)F)CC4,UBWNKPWFLKSDFO-UHFFFAOYSA-N
+C9E58A28F999CB46_6D0E723B4EF015D1_6029_UN,C(N(C1CCC1)[S](C2=CC(=C(C=C2)CO)OC)(=O)=O)C3=CC=CC=C3,BFLJXZQAHJWJGX-UHFFFAOYSA-N
+CB387BD98C37072D_6127AD8AA34CE627_6038_UN,N(C1=CC=C(C=C1)C[N]2C=CC=N2)C(C3=C(C=C(C)C=C3)[N](=O)=O)=O,JDKKXMCIZCWFTC-UHFFFAOYSA-N
+CC60053628456186_63B89C5F40A15FAC_6041_UN,CC(C)C(=O)CC1=CC=C(C=C1)NC3(C2=NOC(=N2)CN(CC)CC)CCCC3,DABPJFNEAQJEBD-UHFFFAOYSA-N
+CC94D9187F8D0C72_E2BE9B3B78184CA8_6039_UN,O(C(C(F)F)C1CCCO1)CC(=O)N2CCC(=CC2)C3=C[NH]C4=C3C=CC=C4,YHFGJNTYMFZKKZ-UHFFFAOYSA-N
+CF4B54FAF7635E51_00D5A279423B283A_6038_UN,CC1=NC(=C(C=C1)NC(=O)CCC2=CC=C(C=C2)[N](=O)=O)N,OKRSRCFFJHWMSQ-UHFFFAOYSA-N
+D13FB1A8319DF705_AB611E685A26BCA9_6038_UN,N(C1=CC=C(C=C1)C[N]2C=CC=N2)C(C3=NC=CC(=C3)OC)=O,LDGYAWXQRZINMT-UHFFFAOYSA-N
+D2102BF6B74798A2_62B1674722DB3C89_6031_UN,CC1=C(N=CC(=C1)C#N)C(=O)OCC2=C(C)SC(=C2)C,CWUWFTAZGAFVNW-UHFFFAOYSA-N
+D24DBEFCD781D081_0678C8E905A38D78_7009_UN,CC1=C(C=CC(=C1)C[S](=O)(=O)NC(=O)C2=C[C@@H]3CCCC[C@H]23)Br,LOJBBGXIRCWIEK-KBPBESRZSA-N
+D4714F314E605A93_FB2DAF83C4AD3398_6039_UN,O(CCCC1=C[NH]C2=C1C=CC=C2)CC(=O)NNC(=O)C3=CC=C(C=C3)C#N,ZVCMPTPOJRUQMV-UHFFFAOYSA-N
+D4F96A8447E24E3E_0DA8736EDD88A100_6038_UN,N(C2=C1CNNCC1=CC=C2)C(=O)C(=CC3=CC4=C(C=C3)OCO4)C#N,FIFPNPQBKYGCOQ-UHFFFAOYSA-N
+D58446F7A75CD529_D7100B25DEBC8D3D_6038_UN,CC4(C)OCC(C)(CCOC(=O)C1CCN(CC1)C(=O)CSC3=C2C=CC=CC2=NC=N3)CO4,DMXZGWUVYZIPHO-UHFFFAOYSA-N
+D63B2630CB328C68_C9E27EB0605CF337_7017_UN,CC1=C(C2=C(C=C1)C=CC=N2)[S](=O)(=O)N4CCN(C3=C(N)C=C(C(=C3)F)Br)CC4,DXFMSKVJSACQNO-UHFFFAOYSA-N
+DA057FB330ABBE23_549039FC26C50472_6038_DP,N(CC(N1CCOCC1)C2=CC=C(C=C2)F)C(C4=C(C3CNCCC3)OC=N4)=O,QYDMEMBFKANCKL-UHFFFAOYSA-N
+DACE70D303178421_90C25175F58B2792_6038_UN,N(CC1(CCC1)C2=CC=NC=C2)C(=O)C=CC3=CC=C(C=C3)C#N,LSJQOPKICIVSJO-UHFFFAOYSA-N
+DE25F6D8447624B6_F459BF0BF4471ED3_6038_UN,O(CC1=CC=C(C=C1)[S](=O)(=O)O)C(=O)[CH]3C[C]2(C[CH2]C2)C3,AXPBKPQLALZQNE-UHFFFAOYSA-N
+DE5DE4C767236EB4_F2D9F7D20EC13B12_6029_UN,CN([C]1(C[C]2(C1)C[CH2]C2)CO)[S](C4=CC=C(C3=CC=C([S](Cl)(=O)=O)S3)S4)(=O)=O,IEWQDVZEVKQVPI-UHFFFAOYSA-N
+DF4C5D637F013AFF_6893D4096E51F17C_6038_UN,N(C(CF)C1=CC(=CC=C1)C#N)C(C2=C(CC)SC=N2)=O,SYENOQIZQCCXJS-UHFFFAOYSA-N
+DFFC9E29A41884E8_8A7FAF25C525392F_7017_UN,CC1=C(C2=C(C=C1)C=CC=N2)[S](=O)(=O)N4CCN(C3=C(N)C=C(C(=C3)F)F)CC4,WLIXEFBNXFIOPF-UHFFFAOYSA-N
+E12994FD50D70A79_02BD1D854D46826F_7009_DP,N([S](=O)(=O)C1=COC2=C1C=CC=C2)C(C3C5=C(C4(CN3)CC4)C=CC=C5)=O,VSHFFGGDXBUOCF-UHFFFAOYSA-N
+E1723034DE37E912_8FAD68D10521DA49_6026_UN,COCCC1=CC(=C(C=C1)OC)[S](=O)(=O)N2CCCCC2C3=CC=CS3,KZGKRZFJWADKPT-UHFFFAOYSA-N
+E1825CAFCEB20492_8185B916B8097BBA_6004_UN,COC(=O)C1=CC(=C(C(=C1)Cl)O)C3=C2OCCC2=CC=C3,KDCVCSPITCWNMK-UHFFFAOYSA-N
+E3233FDB3DF59E0D_034B48F7A1CF1E1B_7022_UN,C1(=C(SC=C1)Cl)NC3=NC(=C(C(N2CCN(CC)CC2)=O)C#N)C4=C3C=CC=C4,LTIJTGVGGHNPHJ-UHFFFAOYSA-N
+E414B7ECB5560F55_A41CB4A919CFE123_6038_UN,CCN3C(=C(C1=CSC(=N1)C2=CC=C(C=C2)OC([C@H](C)N(C)C)=O)C(=O)NC3=O)N,BMWUJYHKJSQWJH-NSHDSACASA-N
+E481508D048AC0AB_C8090E3A57239308_6031_UN,CC1=C(N=CC(=C1)C#N)C(=O)OCC2=CSC(=C2C)C,CRYCKVOTXBMLEZ-UHFFFAOYSA-N
+E84FCCFB656A8629_0605266ECD9E518F_6038_UN,CN(C)CC1CCN(CC1)C(=O)C2=CC(=C(C(=C2)NC(=O)C3=C[N](N=C3C4CCOCC4)C5=CN=CC=C5)Cl)Cl,QZXGLBDRGMZEGO-UHFFFAOYSA-N
+E8EDB068A8F5A958_EF4229D2C9C39F4D_7017_UN,CC1=C(C2=C(C=C1)C=CC=N2)[S](=O)(=O)N4CCN(C3=C(C=C(N)C=C3F)F)CC4,XFSMRRUMBHJPGB-UHFFFAOYSA-N
+EBF4407B41BDE16D_961A8D4BDE631C9D_6038_UN,CN(C)CC1CCN(CC1)C(=O)C2=CC(=C(C(=C2)NC(=O)C4=C[N](CC3CCCO3)N=N4)Cl)Cl,GVABABLQXSFNMD-UHFFFAOYSA-N
+EC4FB7CC114FB35F_AD91C06E5FEDA5C7_6038_UN,N(C1=C(C=CC=C1)C2=CC=C(C=C2)C3=CC=CC=C3)C(C4=NC(=C(C=C4)[N](=O)=O)C)=O,VFYQANBQUVWGDL-UHFFFAOYSA-N
+EC86A1C3E453D027_5D601ABE0C3D4962_6031_UN,CC(=C(C[P](=O)(O)O)C(=O)OCCN([C@H]1CCN[C@H]1C)C)C,DBYVIIBDMLMGEQ-AAEUAGOBSA-N
+EE58A70418F6071F_423624D547B4CBAC_6041_UN,CC(=O)CCCOC1=CC(=C(C=C1)NC3(C2=NOC(=N2)CN(C)C)CCCC3)C,BXDOQBSXLZHGGG-UHFFFAOYSA-N
+EF95CBCD4D69C08B_189F62EFC7C1EC5D_6038_UN,CCCCCCNC(=O)C1=C(C2=C([NH]1)C=CC=C2)C#N,SMGGTKJOHJLQAR-UHFFFAOYSA-N
+EFAC5F8C7D8BF05A_D2FB4A9AA42EB988_6038_UN,N(CCC(=O)NC(=O)N)C(=O)C1=CC2=C(C=C1)CC3=C2C=CC=C3,GWEZTRMSMDHTNN-UHFFFAOYSA-N
+F129CDB6F02EF8A3_23F6EAE014B68298_6029_UN,ClC1=C(C=CC=C1)C(N2CCN(CC2)[S](C3=CC=C(C(C)(O)CO)C=C3)(=O)=O)C4=CC=CC=C4,FRPBWNRAMSJCRM-UHFFFAOYSA-N
+F14B6D79F6A9E0B2_38C9E65E4DC5D28C_6041_UN,C1(=CC2=C(C=C1)C(=C[NH]2)C(=O)CC#N)NC(C3CCCO3)C4=CC=C(C=C4)F,HEAQKHASCXRWBG-UHFFFAOYSA-N
+F1E8689DE8F23018_A2E822971A8333DF_6029_UN,N([S](=O)(=O)C1=CC=C(C=C1)C2CCCCC2)[S](C3=CC=C(C=C3)C4CCO4)(=O)=O,UVGOCZSDACCBLC-UHFFFAOYSA-N
+F2C660E1408D8C0C_C0CDBE5639B99883_6038_UN,CCCCC1=CC=C(C=C1)C(=O)C2=C(C=CC=C2)NC(=O)C3=NC=C(C=C3)C#N,LPWOMUYHLGYSKA-UHFFFAOYSA-N
+F4B022B6C80A6CB2_37E481F90796A0EB_6041_UN,C1(=CC2=C(C=C1)C(=C[NH]2)C(=O)CC#N)NC4=CC=C(N3CC[N+](C(C)C3)(C)C)C=C4,ONAAQCQDVYLVJZ-UHFFFAOYSA-O
+F648FC82EA7C75B0_63D2C6A5E9A99D87_6038_UN,N(C1=CC=C(C=C1)C[N]2C=CC=N2)C(C3=CC(=CS3)C(C)=O)=O,FDZVTAVHYFENFD-UHFFFAOYSA-N
+F70CBB3F4A0B5439_45DA16182D324671_6006_UN,COC1CCN(CC1)C(=O)C2=CC(=C(C=C2)O)C3=CC(=CC=C3)C4CCC4,XUMJTXOAEQDEFI-UHFFFAOYSA-N
+F7239BC6B2538220_17A18884FF41B5EB_6029_UN,N(CC1CC[S](CC1)(=O)=O)[S](C3=C2C=CC=CC2=C(C)C=C3)(=O)=O,BLDBWECXRYMMRY-UHFFFAOYSA-N
+F81D634A916E6742_427D6F76927440C4_6041_UN,CC(C)C(=O)C1=CC=C(S1)C2=C(C=CC=C2)NCC4=C(N3CCCN(C)CC3)[N](N=C4C)C,HHPZMHBWWTWQPE-UHFFFAOYSA-N
+F8315BC97EF1EAE3_0F7DA9D72F137E16_6038_UN,CC5CCN(CC(NC(=O)C1(CCOCC1)C2=C(C=CC=N2)F)CC3=C[NH]C4=C3C=CC=C4)CC5,ZLRMXBNELCHLKS-UHFFFAOYSA-N
+F88519DDEB87D5C0_C0F610402503E8BD_6031_UN,CC1=C(N=CC(=C1)C#N)C(=O)OCC2=CC=C(CC)S2,ACIDFNWOGVJZAG-UHFFFAOYSA-N
+FB0499EEAE22F1BB_893502E01E5D939A_6038_UN,N(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C([C@@H]3CCCN3C(C)=O)=O,LJZATOVHTLZUEM-FQEVSTJZSA-N
+FD4C45E0905D5498_606E50F8EFA550D2_6029_UN,OC1=CC(=CC=C1)CN(C2CC2)[S](C3=C(C=CC(=C3)[S](N(C)C)(=O)=O)CO)(=O)=O,NYHZJXPQHSRPHC-UHFFFAOYSA-N
+FF0F8BA83BB691BE_05F443D9C0D2B115_6031_UN,CC1=C(C=C(S1)C(=O)OCCCNC(=C2N=CC=CC2=O)O)[S](=O)(=O)Cl,XTBSTFRMXRKHCI-UHFFFAOYSA-N
+FF8633FCBEDB55A0_A1258EABC9D208CE_6026_UN,CC1=CC(=CC(=C1)C2=CC=CC=C2)[S](=O)(=O)N4CCN(C3CCC(C)CC3)CC4,BCFSGZGBPIBXFJ-UHFFFAOYSA-N
+FFF3F80E84C6D569_862F42808A7AE6B3_6029_UN,N(CC1=C(C=CC=C1)O)[S](C2=CC(=C(O)C=C2)O)(=O)=O,MWRRONLDQUGCAC-UHFFFAOYSA-N