smiles stringlengths 11 172 | product_name stringlengths 41 41 | heavy_atoms int64 8 77 |
|---|---|---|
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(=CC3=C([N](CCC)C(=C3)C)C)C#N)=O | 4C10C21BF8C77E0A_1AD360E072A67DD5_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=NC4=C3C=N[N]4C(C)C)C5=CC=C(C)S5)=O | 5DC47D1B8E49F4F8_0705585D954FC389_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3CCCN3C4=C(C=C(C=C4)[S](=O)(=O)N5CCOCC5)[N](=O)=O | FCF933634400A97C_135E4CA3B865A930_6038_UN | 39 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(C)OC4=C3C(=C(C(=C4F)F)F)F)=O | 7F819C23D97B6AE7_EB6ABA4574B5639A_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CN(C)C(=O)C3=CC=CS3)=O | 4F16FC1120AA4A53_8DD61128C5B05062_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C4=C3SC(=NC3=NC(=C4)C5=CC=CC=C5)N6CCCCC6 | FA3A583325156F72_6E65DA3CCDCE4503_6038_UN | 37 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCC(N(CCOC)C3=C(N)N(CC(C)C)C(=O)NC3=O)=O)=O | 86D784FA01D40012_7098064C9B3F60AF_6038_UN | 38 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CCCN4C=NC3=C(C=CC=C3)C4=O | 8CA06D6F2F8AA428_78BD04984A8849B4_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=CC(=C3OC)OC)[S](=O)(=O)N4CCOCC4)=O | F2DC4D6029D19279_8B4B85D6C716F601_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CN[S](=O)(=O)C3=CN=CC=C3 | 476DC2AD52D9DE8E_C2AD981F51CC9FA4_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C[N]4N=C(C3=CC=C(C)C=C3)N=N4)=O | 3924F293B87F5BC5_FC942E2CE00D7ECB_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(=CC3=C(C)[N](C(=C3)C)C4=CC(=CC=C4)C)C#N)=O | 63E14AA9AE1757E4_342F43D6621EF729_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)COC3CCCC3 | 293313F7FF263DA4_5C77E7F5ECC54C65_6038_UN | 23 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(=CC3=C([N](CCOC)C(=C3)C)C)C#N)=O | F8FA156B5EE44FB9_42DC795FBBF8580C_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCOCC)=O | 5136E73C6D275385_FD4CFAB53398E897_6038_UN | 21 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(COC3=C(C(CC)C)C=CC=C3)=O | 1B474C32C59BEF50_B7A990FF6839619E_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(=CC3=C(C)[N](C(=C3)C)CC4CCCO4)C#N)=O | D2E4198A02F104BA_0A0B66840EBA7BBB_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CCC3=CC=C(O3)C4=CC=CC=C4 | 8B9AF202EE006EA1_DE23871B63E7FB22_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCC4=NC=C(C3=CC=C(CC(C)C)C=C3)O4)=O | 255D803E5A486F10_FF11C0A98BDE6129_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=C(SCC3=CSC(=N3)C)C=CC=C4)=O | 91D05E7C69D41CE0_AE0741E1874AE5CE_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C5CCN(C3=NC=NC4=C3C(=C(C)S4)C)CC5)=O | 14F929EC04CC9931_1C8F5048D50D1689_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C([N](C4=C3C=C(OC)C=C4)C5CC5)C)=O | 4E54540113ACF7A7_ABF8077A928C50BA_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3CCN([S](CCCC)(=O)=O)CC3)=O | A3A242BD2C2DED0A_1391657681B9A56C_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C(=O)CC3=CC=CC=C3 | C07D40CDBB8AAECF_66FA5385C047F968_6038_UN | 25 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3CCCN3C(=O)C4CC4 | 9070D914AE71D14C_27A3224562C8AC53_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C[N](N=C3C4=CC=C(OC)C=C4)CC5=CC=CC=C5)=O | BD792BD567938ED9_C3B9E7F24F99D74B_6038_UN | 36 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=NC4=C(C(N)=O)N=C[N]34)C5=CC=CO5)=O | 5FE1A6A250D65EA3_F817CDC3008683AB_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4CCN([S](C3=C[N](C)C(=C3)C(=O)N)(=O)=O)CC4)=O | C2077A67EFACEB2C_6BBE66D41F76B09E_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC(=C(C(=C3)F)F)F | 314C76E7FDCED78E_8D39CD590FA0C7C4_6038_UN | 25 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC=CC(=C3)[S](N4CCN(C(C)=O)CC4)(=O)=O)=O | CCA18757398B4DB7_4662F12897774202_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C=CC(N(C)CC3=CC=CC=C3)=O)=O | BE51E5F1098EA650_0B0C75B4B72F1014_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(C)C4=C(S3)N=C(NC4=O)CSC5=C(C=CC(=C5)C)C)=O | E22DF29C47768BA8_DEBC180EBF8EFFCB_6038_UN | 37 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CC3=CSC(=N3)C4=NC=CC=C4 | D0F8F53070F8D075_1F030A3D2CA606D8_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CCCCC4=NC3=C(C=CC=C3)S4 | 4E4BF8F7481BFE2F_5A3CDBA91A123C5A_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4C(C3=CC=C(OC)C=C3)N(C(CC4)=O)C5=CC=C(C=C5)C)=O | 7A629756B0513C1B_E48F4C6056E2B2F3_6038_UN | 38 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=CC=C(CN[S](C3=CC=C(C(C)=O)C=C3)(=O)=O)C=C4)=O | B257B3593E49E7D2_DB03A8E0B7134CEA_6038_UN | 36 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(C=CC(=C3)[S](N4CCCCC4C)(=O)=O)C)=O | DE6CA3F1937D74E6_AEAD3D480D9F94D7_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(C3=C([N](N=C3C)C4=CC=CC=C4)C)=O)=O | 31EA56B08059A68C_DB6B011E368FE375_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(C=CC(=C3)[S](N(C)C)(=O)=O)N4CCCC4)=O | 2400BF66FAAA12E8_330C4FF3EF3AC4A1_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=C(SC4=C3CCCC4)[N]5C=CC=C5 | B0B8AA11D6AAF2F7_42E65526A02C1D89_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C4CC3=C(C=CC=C3)C(=O)O4 | B950AE86D7131553_5571FB86D0DBC2F0_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CCC(=O)C3=CC4=C(C=C3)CCC4 | ADCE80B15DD2CD89_D48FD7718673DAC5_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(C(C)C)N[S](=O)(=O)C3=CC4=C(C=C3)OCCCO4)=O | C10955D25E9B7FA4_FE30A041F7D24F2E_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCC4=CC=C(C3CC3C)O4)=O | BE1D64CFC6026E63_ED81BAF8DC9EFB84_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(C)C5=C(S3)N=C4CCCCCN4C5=O)=O | 85EA4D4A1F591C68_6053337DD8C43372_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CC3=CC=C(S3)[S](=O)(=O)Cl | 0C49B32A6CB538C9_FD036A20EEDE88B9_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(SC(=C3C)C)NC(=O)C4CC4)=O | 775FDA511910DDC9_9E2624B848CF0185_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3CCNCC3)=O | B8E7B7AD1A6038D8_32A3868FABA5844F_6038_DP | 22 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCN(C3=C(OC)C=CC=C3)[S](=O)(=O)C4=CC=C(C=C4)C)=O | E7D8ACA7141B8175_FAFED1E79780FEE5_6038_UN | 37 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCN[S](C3=C(C(=C(C)C(=C3C)C)C)C)(=O)=O)=O | 9CC2282CD123DDB4_CF255E2CF284AA0A_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CC(=CC3=CC=C(C=C3)[N](=O)=O)C5=NC4=C(C=CC=C4)S5 | B1ED9E5B22E8D287_2BF61A730C3E2F47_6038_UN | 37 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(C=CC(=C3)[S](NC4=CC=C(OC)C=C4)(=O)=O)C)=O | C67AA6C07FBE554A_070DBE27EC75ABE5_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC=CC4=C3OC(=C(C)C4=O)C5=CC=CC=C5)=O | 94BA85A4D71517D0_8750D6D6FAB2B9C0_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CSC3CC(=O)N(C3=O)C4=CC=CC=C4 | 85D398A2D673968B_864806F569D467FF_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(CC(C)C)N4C(=O)C3CC=CCC3C4=O)=O | 5B9530A50AC1633F_62B702EA96EBED16_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=C([N]3C(=CC=C3C)C)SC(=C4C)C)=O | 4888D00B2622E2AC_7F3F39B9DD612668_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CCC3=CN=CC=C3 | F0F8BE1113BB06FE_7DF064805346D1E8_6038_UN | 24 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CSC3=NC=C[N]3C4=CC=CC(=C4)OC)=O | 7BCC744683D8007D_043677500B0252FA_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCC(C3=CC=C(C)S3)=O)=O | 153F5EC683C824A1_54343A9753644241_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(C(=C(CC)[NH]3)C(=O)OC)C)=O | 3C610D4E40F69111_ED308706044885FC_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCCOC3=CC=C(C(C)(C)C)C=C3)=O | A9D2266A0C8FE5E0_CC75FF2F09F67081_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CSC6=NN=C(C3=CC(=NC4=C3C=CC=C4)C5=CC=C(C)C=C5)[N]6C7=CC=CC=C7)=O | 34C4C11131C53C26_5F28BB5056B3E4F5_6038_UN | 46 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=C(C=CC=C3)N6C(=O)C5=C4C(=CC=C(C4=CC=C5)[N](=O)=O)C6=O | 62EB0926C97764F7_A29A978D3D39851B_6038_UN | 40 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=NC4=C3C=CC=C4)C5=C(C=C(C)C=C5)C)=O | A0CA5C9F2085289E_5F285B04B78CFE5C_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CSC3=NN=C([N]3CC)C4=CC=CO4)=O | 5D11263E1936923B_ED7D16F5CC03CA84_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4(CCN([S](C3=CC=CC(=C3)C(C)=O)(=O)=O)CC4)C5=CC=CC=C5)=O | 2ABFE0BD84F62531_F70BD50C358D9BA1_6038_UN | 40 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CCN[S](=O)(=O)C3=CC=CS3 | 78DE3D70ABD0E53D_DB0849177AEEB356_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CN6C(=O)N(CC3=CC=CC=C3)C4=C([N](C=N4)CC5=CC=CC=C5)C6=O | 2F0E64521D67C111_384DDC061F166BAF_6038_UN | 42 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCOC)=O | E5CB332082443049_E7B74D0624CB2291_6038_UN | 20 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=NC4=C3C(=N[N]4C5=CC=CC=C5)C)C6=CC=C(OC)C=C6)=O | 15B1C7D1A276E215_783FC91C1F5A718B_6038_UN | 40 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C4=CC3=C(C=CC=C3)S4 | 23B347FDE4D04C5E_CCD19B061E92381E_6038_UN | 25 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=C3C=CC=CC3=NC5=C4CC(CC5=CC6=CC=C(OC)C=C6)C)=O | CA5342D7B044C656_3592096EF64FDCAF_6038_UN | 40 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C[N](N=C3C4=CC(=C(OC)C=C4)OC)CC5=CC=CC=C5)=O | A036527C020CB634_0E11EBD06846D4DC_6038_UN | 38 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC=C(C=C3)[S](=O)(=O)N4CCCC5=C4C=CC=C5 | 5FD4221E0D6BA86A_1C1503C040B5142C_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=C(C)C=C3)[S](=O)(=O)NC4=CC=C(C=C4)F)=O | D7BF715E36EA8A72_6521617C71C11EC9_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)COC3=CC4=C(C=C3)OC5=C4C=CC=C5 | 97FBEA46F4600664_A8527B7D545D66C2_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(C)C4=C(S3)[S](NC4=O)(=O)=O)=O | 861AFF65A5F06BFC_A73BDF3892CE04EA_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=C(C=CC=C3)CSC5=NC4=C(C=CC=C4)O5 | E3EEFC602C820B2B_46070BC3519BBD46_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCC4=C(C3=CC=C(OC)C=C3)[NH]C5=C4C=C(C=C5)F)=O | E0A552731911C2BC_3B8428A9F11D6949_6038_UN | 36 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(CC[S](C)(=O)=O)N[S](=O)(=O)C=CC3=CC=CC=C3)=O | 0918E3E315B10917_5B58A2E0270D4B0C_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC(=CC=C3)N[S](=O)(=O)C4=CC5=C(C=C4)OCCO5 | EF58F1DCDFD55D4B_47ED0B2E3F90B9D7_6038_UN | 36 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CSC3=C(C=C(C(N)=O)C=C3)[N](=O)=O)=O | B7E7FCCF45C4F64C_E1FB84DB5F71C31C_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=NN(CC(C)C)C(C4=C3C=CC=C4)=O)=O | AFA48ED5965BBD02_5BCBCAA49068C307_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CN5C(=O)C4C3CC(C=C3)C4C5=O | 1568ACD247F8FA0B_CEEA2CC86F85E404_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC=C(C=C3)CN[S](=O)(=O)C4=CC(=C(C=C4)Cl)Cl | C0B17F31C10C4132_5C77B99F8D3DF73D_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=CC=C([S](NC3=CC(=C(C)C=C3)C)(=O)=O)C=C4)=O | 3B1B18BF3BB1E803_491CE054AB7BBF67_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=C(C(=C3)OC)OCC4=CC=CC=C4)OC)=O | AFEB2F4EEAE9AD0C_6733BD9775FEB96D_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(=CC3=C([N](CCCC)C(=C3)C)C)C#N)=O | 9B43B024E8A67DDE_68EEC75CA9519F9D_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(COC4=CC=C(N(C)[S](=O)(=O)C3=C(C(=CC(=C3C)C)C)C)C=C4)=O | B48117506E495E16_C6C8798DE29D3491_6038_UN | 39 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(C)SCC4=NC3=C(C(=C(S3)C)C)C(=O)N4)=O | 5E93AAFB79D59E79_5FEF2BC450DC188D_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3CC5=C(CN3[S](C4=C(C=CC(=C4)C)C)(=O)=O)C=CC=C5)=O | E6CD5E401E59EE2B_D395B2B95E6141F0_6038_UN | 37 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CN([S](C3=C(C=C(C)C=C3C)C)(=O)=O)CCC4=CC=CC=C4)=O | 6EDDE1BB61BB6CC6_9D74AC99031ED66E_6038_UN | 38 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(CCC(N)=O)N[S](=O)(=O)C3=CC4=C(C=C3)C=CC=C4)=O | C5A9D20C1A8A21D0_59462CF55FEA616B_6038_UN | 36 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(C)SC3=N[S](=O)(=O)C4=C3C=CC=C4)=O | 666A322C535A13B2_CB38B18610944E99_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(OCC)OC(=N3)C4=CC=CO4)=O | 97533407F3C11290_C87BD175AA6675C5_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(OCC)OC(=N3)C4=CC=C(C=C4)F)=O | BC3AB078D328C065_089FEC99EB204328_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCC3=C(OCC)C=CC=C3)=O | BF29E39F324F7AAE_A20F83F8A414F8AD_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C5=CC3=C([N](N=C3C)CC4=CC=C(C=C4)F)S5)=O | FCF5227731D82CB6_4C179CE3024F31AC_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(N[S](C3=CC=C(OC)C=C3)(=O)=O)C(C)C)=O | B86F5BC70594EE38_41ECDC632F1F4F1C_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC=C(C=C3)N5N=C(SCC4=CC=CC=C4)SC5=S | C2FCF77D7CE961C5_09AE0E04ABDC4527_6038_UN | 36 |
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