smiles stringlengths 11 172 | product_name stringlengths 41 41 | heavy_atoms int64 8 77 |
|---|---|---|
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C4=C3C=CC=CC3=NC(=C4)C5=CC=C(C=C5)C6CCCCC6 | FDA1201A245028AD_8C519324F2D195FE_6038_UN | 38 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CSC3=C([N](N=C3C)C4=CC=CC=C4)C)=O | 0999BC84BBBA5F96_181F7CAE5809CE62_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CC3=CSC(=N3)NC(=O)C4=CC=CC=C4 | 42C87BBBC639B163_780C7126BAACCD14_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CSC3=NN=C([N]3CC)C4=CC=CC=C4)=O | 25DD0AE08746A9E8_D8593F955A55FEA9_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CSCC3=CC=CS3 | F23686A0FCEFDB6E_789D260D14F55A45_6038_UN | 24 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CN3N=C(C(N)=O)C4=C(C3=O)C=CC=C4)=O | 255A5E62F4895465_EA95D6F1E07FB371_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4(C)CC3=C(C=CC=C3)C(=O)O4)=O | 0E0F6AD7B94AF0E5_FC43DD529BEF6398_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(C=C(OC)C=C3)F)=O | B99FADE36D786579_A44F19DFFEEC9A32_6038_UN | 25 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CN([S](C3=CC=C(C)C=C3)(=O)=O)CC4=CC=CO4)=O | 8E0FDFAD24C4F2DC_33B9A0850E3328AE_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C[N](N=C3C4=CC=CC(=C4)OC)C5=CC=C(C=C5)C)=O | 86A48B83AB255E21_E10B5030207564CD_6038_UN | 36 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=C[N](C3=CC=C(C)C=C3)N=C4C5=CC=CC=C5)=O | 8400D7589D5E3EFF_DEC9F8EA0936E298_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=C(C=CC(=C3)[S](=O)(=O)N4CCCCC4)N5CCCC5 | 723FC4F78D9BDF5D_0A5A1F2B70FFDF05_6038_UN | 36 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(N(CC)C(=O)C)C3=CC(=C(C=C3)F)F)=O | E70C2A3A9D3F4C56_FB6A19E346FAD012_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CCN[S](=O)(=O)C3=CC=C(C=C3)F | DFE60FF131B5AA07_803481B5B8E655C7_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C[N](N=C3C4=C(OC)C=CC=C4)C5=CC=CC=C5)=O | 7C4653A22E0E39EA_ACA112ECF652C457_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CC3=CSC(=N3)C4=CC=C(CC)C=C4)=O | 659D759BA47BA9FE_A9277D50B10F766A_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC(=NC=C3)[N]4C=NC=C4 | 2CB570554A9624FA_8211B0A3E98FF9E7_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(C)C4=C([NH]3)CC(CC4=O)(C)C)=O | F1EF76F6C5BBA4B2_92DD923929FE921A_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC(=CC=C3)[S](=O)(=O)NCC=C | 51F1C6BEE7B1EA29_4154D7149EBD537E_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CC3=CC=C(S3)[S](=O)(=O)N4CCOCC4 | 7AD2F441FB43DDFF_17F0A2856E092B48_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CN3N=C(OC3=O)C4=CC=C(C=C4)F | E89E84726AB63439_64A76A5B7B8E6341_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCN4C3=C(C=C([S](N)(=O)=O)C=C3)OC4=O)=O | 5BF58C003B86100C_581EAAB369E1541C_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=C(N=CC=C3)SC4=CC5=C(C=C4)OCCO5 | DCF0BE0AB06D3613_5D79C6C456DD8908_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=C(N=CC=N3)C5=NC4=C(C=CC=C4)S5 | 02E4ABCB441B4791_CD3ACF9F6DBAA3EE_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC=CC(=C3)OCC(C)C)=O | 8B834309A7BC0ED8_5B6BC87B614CA6A0_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CSC3=C(C(=CC(=O)N3)C)C#N)=O | 92010EA8E869D588_0F62AD89246992E0_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(N[S](C3=C(C(=C(C(OC)=O)S3)C)C(=O)OC)(=O)=O)CC4=CC=CC=C4)=O | 61FC29F360E9FD21_FF2F4F25D45EB9ED_6038_UN | 42 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC=CC(=C3)[S](N4CCCCC4C)(=O)=O)=O | 60617BC226C4A880_9F6083B7DE9D8B16_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CCN[S](=O)(=O)C3=CC4=C(C=C3)CCCC4 | EB4DFC6F5EDE404E_79C69C6A7FC3DED0_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=CC=C(C=C5)F | 5704F941CE288E0D_80CCDC7DA54D7E6E_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC5=C(C=C3)C(=O)N(CC4=CC=CC=C4)C5=O | 62C5E1CE11C3382B_7F4B12195117D002_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CN3C(=O)C=CC3=O | C626EE6C29C2403A_3939D6F4F459BCCE_6038_UN | 24 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CN3C(=O)COC4=C3C=CC=C4 | EE300924B3553601_B9FE7BC864B78FD5_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CSC4=C3CCCC4 | 773A5D3ACF3B71E1_041DEEF00A726C55_6038_UN | 25 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC=C([S](N(OC)C)(=O)=O)C=C3)=O | F97B0228D0DDE0B9_01F80E7ADB82894E_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=C(C(C)(C)C)C=C3)[N](=O)=O)=O | A277B636BBD1D1BD_7FFFEAEEFC0DCDB3_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(COC(C)C)C4=C(O3)C=CC=C4)=O | 554685A0EBD9F735_907493B6EE9D6D08_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=NN(C3=CC=CC(=C3)C)C(CC4)=O)=O | 05DAAABF2A6F2AC9_E41005AA56FDB5BF_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3CCN(CC3)[S](=O)(=O)C5=C4N=[S]=NC4=CC=C5 | 931F2D1AAAD192D0_C3E84F281652824A_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CSC4=NN=C(COC3=C(C)C=CC=C3C)[N]4C5=CC=CC=C5)=O | 7B2A11F27CC715A8_09CD1421644E7CFC_6038_UN | 39 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC(=CC=C3)[S](=O)(=O)NCC4CCCO4 | CC7714ECA26C1C0D_5D25154EB3199C66_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=CC=C(N[S](C3=CC=C(C(C)(C)C)C=C3)(=O)=O)C=C4)=O | 3BD64272C0E1E4CA_1BD4880932814E08_6038_UN | 36 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC=C(C=C3)N[S](=O)(=O)C4=CC5=C(C=C4)N=N[N]5O | 7F9555ACB0363F4E_AED5CC843D96DA8B_6038_UN | 36 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC(=CC=C3)N[S](=O)(=O)C4=CC5=C(C=C4)N=N[N]5O | 2CF1FE4FCA820957_3248F3B251DA42A8_6038_UN | 36 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C[S](=O)(=O)C3=CC=C(C=C3)[N](=O)=O | 9D3C1F457B880EAF_FC90821A5AD25245_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(C)OC3=CC=C(C=C3)C#N)=O | 8651DF349E314E35_8E6D429C821A76AF_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C(CCC(N)=O)N[S](=O)(=O)C3=CC4=C(C=C3)OCCO4)=O | B5233B792A163DD8_B0F188FF23716E39_6038_UN | 36 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C(CC3=C[NH]C4=C3C=CC=C4)N[S](=O)(=O)C5=C(C(=CC=C5)Cl)Cl | 53CE75E0CCE55CAC_C7CB7C17515F2926_6038_UN | 39 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CSC4=NC3=C(C=CC=C3)O4 | E1E12A43DC1E1563_8DE77F7CBA06FD92_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4CN(C3=CC=CC(=C3)SC)C(C4)=O)=O | CE742FF72DDAA2CA_4890806EA8B34B2B_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3(CCN(CC3)[S](=O)(=O)C4=CC=CS4)C5=CC=CC=C5 | C2709B129DA8F3C4_A1D6BB3317EBB9DD_6038_UN | 36 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC=C(C=C3)[S](=O)(=O)NCCC#N | 82A88AFEA3373CB3_54E4844B2F610945_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(SCC(C)=O)C=CC=C3)=O | 8EEED808551C0F1C_9F3E9226B06DA9D1_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4CCN(C3=C(C=C([S](N)(=O)=O)C=C3)[N](=O)=O)CC4)=O | F6554AB647D0F7E6_D5F3690278DFC339_6038_UN | 35 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CSC3=NC=NC4=C3C(=CS4)C5=CC=C(C)C=C5)=O | 08F243D028B638AB_19C9337A197C4E31_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3CCN(CC3)C(=O)C=CC4=CC=CC=C4 | 717A59BDFF6353A1_4A4D7B4D638B1D73_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4CN(C3=C(CC)C=CC=C3)C(C4)=O)=O | 9006EC95C34FEF69_B918C95BBE2512FF_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=C(C(=CC=C3)F)F | 569978657AD817DB_0FDA93BB9F42C6EF_6038_UN | 24 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3(CCCC3)C4=CC=C(C=C4)F | 624DCF4A3B9AECC1_DDF8C6E3381C6BEA_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CSC4=NC3=C(C=CC=C3)C(N4CC5=C(OC)C=CC=C5)=O)=O | 68E1370C936B6C6E_BEBDAAE45606AB9F_6038_UN | 38 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CN3CCCCCC3=O | B0063FDE51B12E0F_1CE283C6D792D9CE_6038_UN | 25 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CC3=NN(C)C(C4=C3C=CC=C4)=O)=O | 65A355D6E516A6FB_614D612847656575_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(C(C)C)ON=C3C)=O | DEC63442929A1C3D_BBCF101C819BCA56_6038_UN | 25 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4CCN([S](C3=C(C=C(C)C=C3C)C)(=O)=O)CC4)=O | D47C53E1CF1CFD93_3B69FBBC5A620505_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCC3=NC4=C([N]3C)C=CC(=C4)[S](=O)(=O)N5CCCCC5)=O | AE2F05AF89717886_01FA7CF4CE99D868_6038_UN | 37 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=C(OC)C=C3)[S](=O)(=O)NC(C)C)=O | DC199AEB1F40B184_2E94399EA5B53518_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CC3=CC=C([S](N)(=O)=O)S3)=O | 2E65040A76EA9F90_8943750F73EDA2A2_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC(=CC=C3)N4C(=O)C=CC4=O | CDDA02A54A73CCD2_11496096ABCF88C3_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CC3=CC4=C(C=C3)CCC4 | 770737CD293EA372_6A932388E7C90CF3_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(C)C4=C(O3)C=CC(=C4)F)=O | 71A31DCB315F1F7B_F15713388695D344_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(C)N=NS3)=O | C87CA077C035D491_25C7ABE525001C44_6038_UN | 22 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CN[S](C3=CC=C(C(OCC)=O)C=C3)(=O)=O)=O | CEE431FE06F1F6C1_1F3A229EB85156C9_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CN3C=CSC3=N | CEBA7443FB81867B_B34F99F76FBF06CC_6038_UN | 23 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=C(C=CC=C3)C(=O)C4=CC=CS4 | AA588786DEE3C8B3_52B6DAB57EE9F4B3_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CSCC4=NC3=C(C=CC=C3)S4 | C6B46E034C0C91D7_04158519BD8BE836_6038_UN | 28 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3CCCN3[S](C)(=O)=O)=O | 4AE0CBBA0DFF69B7_2E0D8B545FF95C66_6038_UN | 25 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCCN(C)C)=O | 178051868A21DABE_9B287F8CAECB00F9_6038_UN | 22 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CSC3=NC(=NC4=C3C(=O)N(C)C(=O)N4CCC)CCCCCC)=O | 1A2F9F8115EF6F11_66BE195BDCF6719A_6038_UN | 40 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C[N](N=C3C4=CC=CC(=C4)C)C5=CC=CC=C5)=O | 187B0735991EDEBF_47490D00A23B7FBC_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CN[S](C3=CC=CC(=C3)C(C)=O)(=O)=O)=O | F52227F795FFE8C7_EB77A78735CD0A3C_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=C(C=C3)OC)[S](NCCOC)(=O)=O)=O | 6E73F41F1C78BECB_14E8B315F62EC00A_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CN3C(=O)OC4=C3C=CC(=C4)[N](=O)=O | 24EF4A046D2E79B3_0E08ABBF02CBF634_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C(SCC)C=CC=C3)=O | 17B918060DD5B373_459CB683C3C49DDD_6038_UN | 25 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC(=CC=C3)[S](=O)(=O)N4CCCC4 | 3380DE5F9E6E5899_46A98C9317886B12_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC=C(C=C3)[S](=O)(=O)Cl | 00B848B2E4EC3EDB_867BA7C1DAE505AA_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC=C([S](NC(CC)C)(=O)=O)C=C3)=O | EE06E20078B6CD4D_C8CECA342ED2BF56_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4=CC(=C3C=CC=CC3=N4)C)=O | B9DC8FA076635436_99441334C9BD73D1_6038_UN | 27 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C4CCN([S](C3=CC=C(C(C)=O)C=C3)(=O)=O)CC4)=O | 4A3741CC9AEE5BBF_551DD5C7CF034C08_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C([N](C4=C3C=C(OC)C=C4)C5CCCCC5)C)=O | 35C0596EE0A2251D_BECEE51C1C5D40EA_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CON[S](=O)(=O)C3=CC=C(C=C3)F | 02C0B4DBB7AB5314_D331C4C30DB9AED1_6038_UN | 29 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CCSCC5=NC3=C(C4=C(S3)CCC4)C(=O)N5 | 8EE62CEC4BA2EFC2_B214474AB423C2B3_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC=C(C=C3)N[S](=O)(=O)C4=CC(=C(C=C4)F)Cl | D20D3CADC53EA5E9_BE8250E902BFBCE1_6038_UN | 34 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3CCN(CC3)C4=C(C=C(C=C4)[S](=O)(=O)N5CCCCC5)[N](=O)=O | AC1F1E46E4897E94_F56D6B2441ABB9AB_6038_UN | 40 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CCN[S](C3=CC=C(C(C)C)C=C3)(=O)=O)=O | B921AA8618BCA607_0C86169B946C562A_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC(=C(C=C3)OC)[S](N(CC)CC)(=O)=O)=O | D322EE504A840C00_FDCA3C079B3B5BAA_6038_UN | 32 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(CSC3=NC=C[N]3C4=C(C=C(C)C=C4)C)=O | 3F6E9164F6036867_269BF2D3A422676F_6038_UN | 31 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)C3=CC=C(C=C3)CSC4=CC=CC=C4 | 7CDEEF98716A96C5_94DE461FEBC76079_6038_UN | 30 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=C[N](N=C3C4=CC=C(C)O4)C5=CC=CC=C5)=O | EDB19F17038357AB_DBB7D9359685E2C5_6038_UN | 33 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(C3=CC=C(CSCC)C=C3)=O | CB07A542F7A6D008_EC06E4FEF3DDD2E8_6038_UN | 26 |
CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2OC(=O)CSCC3=CC=C(C=C3)F | 4C29133895D019B6_A5D51FE44925DB37_6038_UN | 26 |
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