smiles stringlengths 11 172 | product_name stringlengths 41 41 | heavy_atoms int64 8 77 |
|---|---|---|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=CC=C([S](N3CC(CC(C)C3)C)(=O)=O)C=C4)=O | 2E600259F83F362B_314FF8FB0D8878E7_6038_UN | 35 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC=CC(=C3)[S](OC4=C(OCC)C=CC=C4)(=O)=O)=O | BE6FA3C043EC982F_5B34EADC4704AF7F_6038_UN | 37 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCOCC3=CC=CC=C3 | 327E77EABA71A89E_5FCBE587A357A78F_6038_UN | 28 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C4=C3C=CC=CC3=NC5=C4CCC5=CC6=CC(=CC=C6)OC7=CC=CC=C7 | 1D96E72DF124BCB9_14595D4E941B5C3E_6038_UN | 45 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CSC3=NC=NC4=C3C(=C(C)S4)C)=O | CEE8B20385A9A8AB_412B2ECEF060D618_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C(C)[N](C(=C3)C)C4=CC=C(C=C4)C)=O | 0D58B4142C217C37_9EB66C4D0F819902_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)COC3=CC4=C(C=C3)C=CC(=O)O4 | 1DE8EE95B1412A40_37872C7B0B400255_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=CC(=CC=C3)OCC4=CC=CC=C4 | 3EA91BA41FFB4597_E392AAB77DC32EE5_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=C(C=C3)OC)[S](NC4=CC=C(CC)C=C4)(=O)=O)=O | CBD56E4A65E2FA9C_460701D5ACFC6FC3_6038_UN | 38 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=N[N](N=C3C)C4=C(C=C(C=C4)C)C)=O | 2E6E932C67C0866C_2D8B923A0894415B_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCCSC4=NC3=C(C=CC=C3)[NH]4 | A84BCC1E3FE4E530_96A0AE6B4E68425B_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(COC3=CC=CC(=C3)CC)=O | 007A8AF96B7EAC04_4FEB9AD5E21BD818_6038_UN | 28 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=C(C=C3)F)C)=O | 69A2CF67728DCDA1_B5217EA101B30B6B_6038_UN | 26 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCC3=C[N](N=C3)C4=CC=CC=C4 | B965E79D083B9892_54D82C79E1682F04_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C=CC(OCCCC)=O)=O | 007A269D1D15C7DB_943C158E5C278687_6038_UN | 27 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C4=C3C=CC=CC3=NC5=C4CCC5 | A5D8929E4D30E8C9_99458B46DB1BAE6F_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=C(C=CC=C3)SCC(=O)N5C4=C(C=CC=C4)SC6=C5C=CC=C6 | 5E32FE7A45D83D62_463059D812A39215_6038_UN | 42 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CCOC3=CC=CC(=C3)C)=O | E99BE33DD58BB5A7_781874ED56F3105B_6038_UN | 28 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C5=CC3=C([N](N=C3C)CC4=CC=CC=C4)S5)=O | 9B83D491DDC401F4_9826D9779D14A59B_6038_UN | 34 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=CC5=C(C=C3)C(=O)N4CCCCCC4=N5 | 07EA2CB716F4693A_6F9B19F7BF7FDAA0_6038_UN | 34 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=C(N[S](C3=CC(=C(C(=C3)[N](=O)=O)C)C)(=O)=O)C=CC=C4)=O | 30645EA1A871579B_7B088FDCD3DC18FE_6038_UN | 39 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)COC3=CC=C(C=C3)C#N | BD934777DBFB8952_55BF6480D0874860_6038_UN | 28 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCCC4=NC3=C(C=CC=C3)S4 | 69D898EF698D5B0F_59A33EFBE9F8A06D_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CC3=CC4=C(C=C3)CCCC4 | 170B1F3A0E67AB0C_11CB6C660A8E3E48_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C=CC(C3=CC=C(OCCCCC)C=C3)=O)=O | 42B85A3D2F1C3827_AF64E0D58D49B201_6038_UN | 34 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=C(N[S](C3=CC(=CC(=C3C)C)C(C)(C)C)(=O)=O)C=CC=C4)=O | 6644B8DC82DCADFE_EF6D36DC4BA2E93F_6038_UN | 40 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=CC=C(N[S](C3=CC(=CC(=C3C)C)C(C)(C)C)(=O)=O)C=C4)=O | EBAFD96CE189CE2E_8C7AB46B88668A84_6038_UN | 40 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC=CC(=C3)N[S](C4=CC(=C(C)C=C4)F)(=O)=O)=O | B14574BD5F2C0CA6_5501968AF2DB3F4A_6038_UN | 36 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C(CC3=CC=CC=C3)N5C(=O)C4=C(C=CC=C4)C5=O | 82CAFCF61270035A_2BE72BF0FE33E540_6038_UN | 37 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3CC5=C(CN3[S](C4=CC=C(OC)C=C4)(=O)=O)C=CC=C5)=O | BE1620DAC29E362B_5AFAE247BAC0FA83_6038_UN | 39 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=C(SCC(OC3CC(CCC3C(C)C)C)=O)C=CC=C4)=O | 6C5F8EB8C43D1C44_593D3F1DB5B0A31C_6038_UN | 39 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C4=C3C=CC=CC3=NC5=C4CCC5=CC6=CC7=C(C=C6)OCO7 | 2299657A91153437_FC63536BE25C8D90_6038_UN | 41 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCC4=NC3=C(C=CC=C3)S4 | EEA604C61FCA50C4_EBDC6B5075D0D2E0_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(COC3=C(OCC)C=CC=C3)=O | 5B46D6DA801F07C4_A010041218D235EB_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C4=C[N]3C=CC=CC3=N4 | D533C043E544A534_01D2369C03C6BF73_6038_UN | 27 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C5=CC=C([S](NC3=C(C)N(N(C3=O)C4=CC=CC=C4)C)(=O)=O)C=C5)=O | 77EC26DA69E6C9EB_CE863E828B0BEFCC_6038_UN | 42 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=CC4=C(C=C3)[NH]C=C4 | AAD76246AD81B04C_EE40AE721DB1B009_6038_UN | 27 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=C(N[S](C3=C(C)C=CC(=C3)C(C)(C)C)(=O)=O)C=CC=C4)=O | FBFDE1FCDEA39C6B_D3D12A82CE94CB8C_6038_UN | 39 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=CC(=C3)N[S](C4=CC=C(OCC)C=C4)(=O)=O)N[S](=O)(=O)C5=CC=C(C=C5)OCC)=O | 912677C4928146D8_2F62D42A9EC1EF9E_6038_UN | 50 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=CC=C(C=C3)N[S](=O)(=O)C4=CC5=C(C=C4)OCCO5 | A424B7BAD5C2362D_22238907F5339716_6038_UN | 38 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCCOCC3=CC=CC=C3 | 29150FCE5EC4DE45_5BB014E57C32AD2E_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=C(OC)C=C3)[S](=O)(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5)=O | FF57F83D670DEA2C_5552BAD8D010EEFE_6038_UN | 43 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CN4C(=O)C3=C(C(=CC=C3)[N](=O)=O)C4=O | 30AE6337BF8CF432_FE38F56886ABF43B_6038_UN | 33 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4CCN([S](C3=C(C(=CC(=C3C)C)C)C)(=O)=O)CC4)=O | E30BAEE920606455_361C740156FA21AA_6038_UN | 37 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=C(OC)C=C3)[S](=O)(=O)NCCN(C)C)=O | 954FB1EACE360467_858ED941B9571DEA_6038_UN | 35 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=CC=C(C=C3)SCC5=C[N]4C=CC=CC4=N5 | CAD6E967CDA8E019_E07E9BE421751BDB_6038_UN | 35 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=C(N[S](C3=CC(=C(OC)C=C3)OC)(=O)=O)C=CC=C4)=O | 00129A371C276A1C_D61BF9F032C58A37_6038_UN | 38 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3CC5=C(CN3[S](C4=CC=C(C)C=C4)(=O)=O)C=CC=C5)=O | 95DA63749275DB6F_ECADBF6B3930B5CC_6038_UN | 38 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCN4C(=O)C3CCCCC3C4=O | 71C581E85960E277_A72C0863A8E46CC7_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCN4C(=O)C3CC=CCC3C4=O | 552CACDE7CBBE63D_2C75555D28A37D6A_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=CC=C(C=C3)N6C(=O)C5=C4C(=CC=CC4=CC=C5)C6=O | D1AC29B4D8936A42_20BB18F3B3A0869F_6038_UN | 39 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=CC=C([S](NC3=C(C)C=CC=C3)(=O)=O)C=C4)=O | 7123BD7C55429B37_C4FE77D82CA2863F_6038_UN | 35 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=CC=C(O[S](C3=C(C=CC(=C3)C)C)(=O)=O)C=C4)=O | 1A61A30816D7D722_9B7DE198B3CDDBC8_6038_UN | 36 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=C3C=CC=CC3=NC5=C4CCCC5=CC6=CC(=C(OC)C=C6)OC)=O | EC52F087B4891436_39CC3BA42D058895_6038_UN | 43 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=C3C=CC=CC3=NC5=C4CCCC5=CC6=CC=C(C)C=C6)=O | 8ABEB2DBDA37CDD6_45E0DC51E62AE007_6038_UN | 40 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C5=C4CCC(=CC3=CC=C(OC)C=C3)C4=NC6=C5C=CC=C6)=O | 01A948E0053CC535_A378FE0FD55A73B5_6038_UN | 40 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CCOC3=C(C=CC(=C3)C)C)=O | DF8FB5086E53EC8B_E1AA28AB9D7597B3_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC=CC(=C3)N[S](C)(=O)=O)=O | D91D42DB63778C4F_759F64351D393401_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=C(SC3=NN=N[N]3C)C=CC(=C4)[N](=O)=O)=O | 7FE1F976A7727B33_49A597D5A83B7F53_6038_UN | 34 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=NC4=C3C=CC=C4)C)=O | A8908618D82506CC_343A31A4D456595C_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CCOC3=CC=C(OCC)C=C3)=O | 1D044B00D3933236_E995E8826393BCCE_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C(CC3=CC=CC=C3)N[S](=O)(=O)C5=C4N=[S]=NC4=CC=C5 | 3BFA2C9F425F0AC2_852BC12F73EBC80D_6038_UN | 39 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CC(=CC3=CC=C(OCCCC)C=C3)C5=NC4=C(C=CC=C4)S5)=O | 1F42658AF54FE18F_630566B8A68028DD_6038_UN | 41 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C[N](N=C3C4=CC=C(C)C=C4)CC5=CC=CC=C5)=O | DD3F10B62682E313_CEF4BA5DC83F373C_6038_UN | 37 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=C(OC)C=C3)[S](=O)(=O)N(C)CC4=CC=CC=C4)=O | B9EC7AB073E9A8C5_2D8C14F77B7DAEF9_6038_UN | 38 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C4=C3C=CC=CC3=NC5=C4CCC5=CC6=CC=CO6 | 99BB21FC15B9A5CA_9982ADDE30251CA9_6038_UN | 37 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C([NH]C(=C3C)C(OCC)=O)C)=O | 59218954ABF57E38_E7FE25A50E560B5D_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C(NC(C)=O)SC4=C3CCCC4)=O | F36075F522E2E066_B017E990A833E7C1_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C(C)[N](C(=C3)C)C4=CC(=CC=C4)C)=O | 071596994D40CEF7_DE22ACD243A607CD_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CC(=CC3=C(OC)C=CC=C3)C5=NC4=C(C=CC=C4)S5)=O | 6815A22AC98A59D8_EBCEA7778475B45F_6038_UN | 38 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)COC3=C(C=CC=C3)CC4=CC=CC=C4 | 3658DF1B8CDF1DC5_3A8145693D89B8C5_6038_UN | 33 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CC4C3=C(N(CCCC)C(N(C3=O)C)=O)NC4=O)=O | 5A075BE9A4820AD5_451D650DA63C97D0_6038_UN | 36 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C5=C(SC3=NC=NC4=C3C(=C(C)S4)C)C=CC=C5)=O | A2D265C6695DD238_4B6372B3F325768F_6038_UN | 36 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCCN5C(=O)C4=C3C(=CC=CC3=CC=C4)C5=O | D1CD5D4678AA4D87_D1E8F14D8E5E4DE5_6038_UN | 36 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=CC(=CC=C3)[S](=O)(=O)N(CC=C)C4=CC=CC=C4 | 336A7C19CE30B253_4B9628422465194E_6038_UN | 37 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCCN4C(=O)C3=C(C=CC=C3)C4=O | 2C7A7F2783B99E3C_430CD91394D8EA88_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCCCCN3C(=O)CSC3=S | EDE35643C8F562D6_DFAC6D9BAB707DED_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCCN3C(=O)CSC3=S | 462E5B95DBE7727D_CA9A33E2132F463A_6038_UN | 28 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC=CC(=C3)[S](N(C4=C(OC)C=CC=C4)CC5=CC=CC=C5)(=O)=O)=O | 5AA0F3EBCB796628_E26FE423E2A1D6F5_6038_UN | 43 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=C3C=CC=CC3=NC5=C4CC(C(C)(C)C)CC5=CC6=CC7=C(C=C6)OCO7)=O | 7156AE1D912E46D5_8B3032D3CB0E5E15_6038_UN | 46 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CCCOC3=CC=C(OCC)C=C3)=O | 45C3BFCAE8E787E1_D1FB60972F6796EA_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CC[S](C3=CC=C(C)C=C3)(=O)=O)=O | 394C45403F22D23E_0CA9DBC515D52A28_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CCC[S](N)(=O)=O)=O | F361BBF311A7B3BF_D48698BB40E35DC2_6038_UN | 25 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C4=CC3=C(CCC3)S4 | 6EBD18C238F7029E_7B85C3D5FA5089B6_6038_UN | 26 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C(C)C4=C(S3)N=CNC4=O)=O | 2B9186CB49C20AD1_268C4C7AA2695D92_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(COC3=C(C(C)C)C=CC=C3)=O | 7CB40ED40BB4F411_9BA97A31D617CB16_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=C(C4=C(O3)C=CC=C4)COC5=CC=CC=C5 | 80F49DE7FF522C7D_20FC481FE054CD0F_6038_UN | 35 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CCN[S](C3=C(C=CC(=C3)C)C)(=O)=O)=O | 0913D9D8A3829A5D_8647A1007B57F0B5_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=NN(C(=O)CC3)C4=CC=CC=C4 | B82F60105ECB50A5_9D6E3A825F736455_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CSC3=NC(=C(C(=C3C#N)C)C)C)=O | 50BFE3545823CCC3_32D5831B114687EA_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=CC=C(C=C3)[S](=O)(=O)NC4=CC=C(C=C4)F | 663547A942D0BB15_2DADCFC46492FCC0_6038_UN | 35 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=CC(=C(C=C3)SC4=CC=C(C=C4)F)[N](=O)=O | DE14AA95840932E7_EBED1FDAEDA7C4D6_6038_UN | 35 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CCOC3=CC=C(OC)C=C3)=O | 2F8D5FF23FA20E63_3F9D05F8E1C3C316_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CCOC3=C(C)C=CC=C3)=O | C21A829DA940FD1C_A999F90E81484FD3_6038_UN | 28 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CCC3=NC4=C([N]3CCCC)C=CC(=C4)[S](=O)(=O)N5CCOCC5)=O | E40E79D2ADD8D257_91DCEC925D23B319_6038_UN | 42 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=NN(C(C=C3)=O)CC4=CC=CC=C4 | CB6EBD17DD50EB84_0C49DF94F3D490F3_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCC4=NC3=C(C=CC=C3)[N]4C5=CC=CC=C5 | 65CB3A9EDEE87AD5_6ECE36536F8D2AA9_6038_UN | 35 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C4=CC3=C(CCCCC3)S4 | DA44177685D06FC1_34CC94BEACA4E553_6038_UN | 28 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CCC(C3=C(OC)C=CC(=C3)C)=O)=O | 2A74D4FE83BB0B73_E7BBBFCB4C92568F_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CCC(C3=C(C=CC(=C3)C)C)=O)=O | DE4919C057E3A193_61552FE9FB871742_6038_UN | 30 |
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