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(=O)CCCOC3=C(C=C(C=C3)[S](=O)(=O)Cl)F | F4E67F090C8E82A4_31BE2D13E8D0FE06_6038_UN | 33 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C(C)C4=C(O3)C(=CC=C4C)C)=O | 0FD3E242F413B631_570BD276EE3C53B8_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=NC4=C3C(=NO4)CCC)C5=CN=CC=C5)=O | 6F7A771637287EEB_516887D6F3E3F48B_6038_UN | 36 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=CC(=CC=C3)N[S](=O)(=O)C4=CC5=C(C=C4)C=CC=C5 | D92C1BEF49D00167_910EEE919F5DA1DD_6038_UN | 38 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=N[N](C)C=C3)=O | 6CB9120F0D74A7D8_A58F0681371F1751_6038_UN | 24 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3(CCNCC3)C)=O | 16A2996A30B7EA7B_E551C28DF494FC29_6038_DP | 25 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3(CCCNC3)C)=O | 240252394EF7B0AF_B2C02034235EB387_6038_DP | 25 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3(CC)CCNC3)=O | 129D20C2FB44C235_D8B247822201FD6F_6038_DP | 25 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C(C)SC(=N3)C)=O | 6CDB245F8C736E79_1A17EE510268D2E4_6038_UN | 25 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3CCN(C(N(CC)C(C)C)=O)CC3)=O | A41AB88F999A96D0_CDE49C2096A194BC_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=CN=C(C=C3)OCC4CC4 | DA0F2D7E3BB4076B_3D447EBFA82AC6E5_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC=C(C(N(CCC)CC)=O)C=C3)=O | 7F264C50E5E4090C_103D18D2B3497ECC_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C(OC3=C(CC)C=CC=C3)C4=CC=CC=C4)=O | 46BBAB5838C75E28_2C950661540B23B6_6038_UN | 34 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=CC=C(C=C3)[S](=O)(=O)NCC4=CC=CS4 | 48E23CFE20BCAE79_7591F9AA3115D547_6038_UN | 34 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=NC4=C3C(=NO4)CCC)C)=O | 17116AA9FEBCCE44_54F667DF30E4FBCE_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C4=C3C=N[N](C3=NC(=C4)C5CC5)CC6=CC=NC=C6 | B791D2E3BB6CC537_3837D41F590BD0EA_6038_UN | 37 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=NC4=C3C(=NO4)C5CC5)C)=O | CDE23B0F805A5FC1_55CD27FA88C59F97_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C4=C3C(=NOC3=NC(=C4)C5=CC=CS5)C6CC6 | 60BA361C33B0ED18_1BDB03A8A255AED6_6038_UN | 35 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C(C)OC3=CC=C(C=C3)N(C)[S](=O)(=O)C4=CC(=C(C=C4)C)C)=O | 6E258679595803A6_681A3E7CE6B40492_6038_UN | 40 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C(C)[N]3C(=CC(=N3)C)C)=O | 0F2337F5140A7311_1E7E451F17099E90_6038_UN | 27 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CCOC3=CC=C([S](C)(=O)=O)C=C3)=O | 6E53306250CBBC79_DEE358746FB5BC5B_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCC3=CSC=N3 | 109F2545C5010A75_1192EDB4A48BE25B_6038_UN | 25 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CN=C(N(CC)CC)C=C3)=O | 9427FDD4F36EA6DD_8740978410B3E1BC_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C([N](CC(OC)=O)C(=C3)C)C)=O | 68F7D172DD61D000_D31D0758A148BBBF_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=CC(N(C3=NC(=CC(=N3)C)C)N4)=O)=O | 545790B2D1ED6516_CFCBCE8D1A30DC45_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CN3C(=O)N(CC=C)C(=O)C3=O | BDF200BEAB07D655_AAD146322304BD46_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=CC3=C(ON=C3C(C)(C)C)N=C4)=O | EBC1574997498328_D83E0590EC568906_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CCOC3=CC=C(C(C)C)C=C3)=O | 063A8397A3688894_CFF86DB51A7E8A62_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CN[S](=O)(=O)C3=C[NH]C4=C3C=CC=N4 | 29B9A8C2C4EB197C_B87F25581ABB8FCE_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3CN(C(=O)C3)C4=CC(=CC(=C4)F)F | 4D3616B9EF7BE5F8_6F513A12D20CC0F7_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=NC=C3)N4CCCCC4C)=O | A84A218679AE0E66_737317E44ADE1374_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4(C3=CC=C(OC)C=C3)CCOCC4)=O | 1E5084436FF65218_EB96CBA0AAB6D6B1_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C[N]3C=C(N=C3C)[N](=O)=O)=O | 8B84A7BEE37FD8B7_8BD48B94535C215C_6038_UN | 28 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC4=C([N]3C)N(C(N(C4=O)C)=O)C)=O | BD6D459E27A2C4CC_EF7370E4F21C58FC_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=C(OCCOC)C=C3)OC)=O | 72305C31116EE6ED_AD2546B56AD8A6E4_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CSC(=N3)C4=C(C=C(C)C=C4)C)=O | B26551E585FDCD1B_BC48D4022191B29F_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C5=CN=C4SC=C(C3=CC=CC=C3)N4C5=O | D1A9632A818F3845_E49F3D322C6CB1E7_6038_UN | 34 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C[N](C)N=C3C4=CC=NC=C4)=O | F08C5B99071B72FA_4B6B39201B33E1B0_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=CC=C(N3CCN(C(C)C)CC3)C=C4)=O | 90E21DD27FCD7E22_009C7745F6C2AC4A_6038_UN | 33 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4(C3=C(C)C=CC=C3)CCOCC4)=O | 1A18C7B25953F01C_73623F18B3BEB940_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C(C)OC3=CC(=C(C=C3)F)F)=O | 20E2B17F5755926F_70D85AEDCDA04485_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=C[N](CCC#N)N=C3C4=CC=C(C=C4)[N](=O)=O | 2F64C243F4AD5209_4A05A40279A44ED3_6038_UN | 36 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CCCOC3=CC=C(OC)C=C3)=O | FEDB812CCF15DB41_8F9967697DBE7A2F_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC=C([S](NCCOC)(=O)=O)C=C3)=O | 6355DFCAE582EDAD_F71FFB5F431A2B22_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CC4=C(C3=CC(=C(C)C=C3)C)N=C(S4)N)=O | 2D4E9EF65C0C74B8_E7600497398862CD_6038_UN | 33 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=C([N]3C(=CC=C3C)C)SC=C4)=O | BB8E8C5174C4C471_CDDAC14B94ACCC35_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=CN=C[N]3C4=CC=C(C=C4)F | 225AA015C64DE9EB_412BBE69EBB7D787_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3CCN(CC3)C(=O)C5=C4C=CC=CC4=CC=C5 | A3DD4D26B5094386_FC8BFF8A957B8638_6038_UN | 36 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=NN(C(C=C3)=O)CCOC4=CC=CC=C4 | 421D23919BCA3E4E_0B1F50600AE17003_6038_UN | 34 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C(C)[N](C(=C3)C)C4=NC=CS4)=O | E54A457C0CB80BC2_D9AF898AA7AD40A4_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3(CCN(CC3)[S](=O)(=O)C4=CC5=C(C=C4)OCCO5)C6=CC=CC=C6 | 35E8577B3FA8CADB_B0959A617731F270_6038_UN | 43 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=NC4=C3SC(=N4)N5CCCCC5)C6=CC(=C(OC)C=C6)OC)=O | 7D9F55CF5D7A66CD_5803FE3525402D49_6038_UN | 43 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CN(C3=CC=C(C(C)C)C=C3)[S](=O)(=O)C4=CC=CC=C4)=O | 2E873A80D30F6E9B_DDDFED5304B7FD73_6038_UN | 38 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=CC=C(C3=CC=C(OC(C)=O)C=C3)C=C4)=O | D256DB0EFE57031B_C3C0196E430FA351_6038_UN | 34 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3CCCN(C3)C(=O)C4=NC=CC=C4 | 1D93BF1C84A8E8CE_11A59D8D0496DB3E_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=C[NH]N=C3C4=CC5=C(C=C4)OCCO5 | 07A948D6465E3E17_B6CB96C6FEAAEE4C_6038_UN | 33 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)COC3=CC(=CC=C3)N4CCCC4=O | 345B5EBC0A4820B7_B1650934DDF4C614_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=CC4=C(N=C3)C=CC=C4 | 01886D8E022BCA1D_87A1244442980717_6038_UN | 28 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC=CC(=C3)[S](NC4=C(C)N(N(C4=O)C5=CC=CC=C5)C)(=O)=O)=O | 30C2BC40B3459467_4C566DCBB51D6E58_6038_UN | 42 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C=C(C)C3=CC=CC=C3)=O | 178BBB1407EE123E_C4A8D280F8F83F76_6038_UN | 27 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C4=C3C=CC=CC3=NC(=C4)C6=C5C=CC=CC5=CC=C6 | 847E6416253AF29F_24923D00AAAAA546_6038_UN | 38 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=CC3=C(N=C(N)S3)C=C4)=O | 6E2DF037FE85199D_EC24592E4C82EFFE_6038_UN | 28 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=C(C=CC=C3)SCC(=O)N4CCCC4 | 9D30F93E9D34BEF4_1828697D6736A8F4_6038_UN | 33 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=C(C(=C3)C)OCC4=CN=CC=C4)C)=O | EA3C49379C47BC44_0C9D9A7ACFCE5D3A_6038_UN | 34 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=C(C=C3)OCC4=CN=CC=C4)OCC)=O | DEC54D0122F406BF_0336D1709EF8006F_6038_UN | 35 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CN4N=CC3=C(C=CC=C3)C4=O | 7EF5D3F9BA516D52_0F882D31F0C180B3_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C(C=CC(=C3)[S](NCC(N)=O)(=O)=O)F)=O | 5D8FE108273F63F5_08E1A83FEF9AC3F0_6038_UN | 33 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C(NC(C(C)(C)C)=O)N=CC=N3)=O | 0D353C31FF122860_B29485E107428548_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=C(C=C3)F)[S](N)(=O)=O)=O | 81E2FFE0B3B1443B_07861DD405DE0CB1_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CN4C3=C(C=C(CC)C=C3)C(C4=O)=O)=O | F6F6E6DA880D3462_CAE972C41A3A210C_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=CC=C(C=C3)CN4C(=O)CSC4=O | 89A6A68C59FAC904_8C50CFB42F2133C7_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=C(C=C3)OCC4=CC=NC=C4)OC)=O | D997E9D61E2ACF1A_B797BA728524B7F3_6038_UN | 34 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C4=CC=C(COC3=C(C=CC=C3)F)O4 | AEC75C92F4B00BB9_AD231331BB911240_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C(C=CC(=C3)[S](N(C(C)C)C)(=O)=O)F)=O | 4F99AD0F7017BD34_8F6D2B7B728E45D9_6038_UN | 33 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCOC3=CC(=C(C=C3)F)Cl | 3DF61B2D9E16B305_5DE933AC75F938E8_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCC3=CC=C(C=C3)[S](=O)(=O)NC4CC4 | BD59A9D4751158DF_C7D2ADD4A1F85612_6038_UN | 33 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C[NH]C=C3C)=O | 57968285BF1E594F_A87B853BC05A9DD6_6038_UN | 24 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=N[N](C4=C3CCC4)C5=C(C=CC=C5)F | 91D99608D0E77678_73B71E4A666B3ECF_6038_UN | 33 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C4=C3C=N[NH]C3=CC=C4 | 24B9EC2979CFA28C_D4AB382E131FB089_6038_UN | 27 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C(C=CC(=C3)[S](NC)(=O)=O)F)=O | C916C6B4EBD9572A_E864F1F9F2B1E0EF_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C[N]3C=C(C(OC)=O)C4=C3C=CC=C4)=O | 8991F87B926DC103_C87F027F63E04A1D_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C(C=CC(=C3)[S](N(CC)CC)(=O)=O)N4CCC(C)CC4)=O | A955ECA5CC32C14D_4E0C958A0959A6B7_6038_UN | 39 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CN3C(N(C)C4(C3=O)CCCCC4)=O)=O | ABCB8C41963228BE_A67C3B60AA6E5F53_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C(C=CC(=C3)[S](NC)(=O)=O)C)=O | F799597C4557D714_34011CDAEB6F4E83_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCC[N]3C=NC4=C3C=CC=C4 | A1BDABD9C0071296_97A528D8864F4FDD_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=C(OCC)C=C3)[N](=O)=O)=O | F29EF623F442B405_B920EBD1A3E52C0C_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=C(OCC3=C(ON=C3C)C)C=CC=C4)=O | D58EBE456EFB7CD3_8400260D6557612F_6038_UN | 33 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CN(C)[S](=O)(=O)C3=CC=C(C=C3)F)=O | 1DDF05CAC4821D85_EB9B786532B84ABF_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=C(C)[N]3N=CN=C3N=C4)=O | CBD7E9AD1E470857_6AB236ADF4A63C9C_6038_UN | 28 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CC3CN(C)C4=C3C=CC=C4)=O | 854F75A606CC0E29_F7254516D4E543C7_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CSC(=N3)C4=CC=C(OCC)C=C4)=O | 44515F7693EF7C88_CF7D9BAFEDC2A3A6_6038_UN | 32 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C(C=CC(=C3)[S](N(CC)CC)(=O)=O)OC)=O | 5C20CDC5021C25BF_ABFFF262C928BD34_6038_UN | 34 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3CN(CCC3)CC4=NC=CC=C4 | 4FB4737449227B7D_B2BC7DD694901D7F_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4CCN([S](C3=CC=C(C(OCC)=O)O3)(=O)=O)CC4)=O | A67F291D188BA1D3_F1E5FF4832ABFCDA_6038_UN | 37 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C(CC(C)C)N[S](=O)(=O)C)=O | C3B494C551395811_3E9B01D4E44AEDA4_6038_UN | 28 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=C(C=CC=C3)OCC4=CSC=N4 | 0C23E9EC0BC697B5_468DA2260A70A5A2_6038_UN | 31 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3CCN([S](CC)(=O)=O)CC3)=O | 501A6B15FD9E722C_954671CF0A8B2D43_6038_UN | 29 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(COC3=CC=C(OCCC)C=C3)=O | 8BEDDD46FE599970_00A6EE0EC809A38A_6038_UN | 30 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCC(=O)N3CCN(CC3)[S](=O)(=O)C4=CC=CC=C4 | 3AC4F99DFC20E024_24D7AD539B6D243B_6038_UN | 37 |
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=NN(C)C(C4=C3C=CC=C4)=O)=O | BA585AA16CC2E254_CE3179B21194511C_6038_UN | 30 |
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