smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)[C@H](C)N)C1 ZINC000161288719 179348696 /nfs/dbraw/zinc/34/86/96/179348696.db2.gz ZYJWGKORXCVAQI-AVGNSLFASA-N 0 3 246.354 2.047 50 70 BEIAHN CC[C@H](N)C(=O)N1CCCc2ccc(C)cc21 ZINC000159749429 385728540 /nfs/dbraw/zinc/72/85/40/385728540.db2.gz HFPWPEJIGOBOLD-LBPRGKRZSA-N 0 3 232.327 2.012 50 70 BEIAHN Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)[C@@H](C)N)C1 ZINC000161289747 179330161 /nfs/dbraw/zinc/33/01/61/179330161.db2.gz ZYJWGKORXCVAQI-JHJVBQTASA-N 0 3 246.354 2.047 50 70 BEIAHN Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)[C@@H](C)N)C1 ZINC000161289858 179349820 /nfs/dbraw/zinc/34/98/20/179349820.db2.gz ZYJWGKORXCVAQI-UPJWGTAASA-N 0 3 246.354 2.047 50 70 BEIAHN Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)CN)cc1 ZINC000161234676 388443976 /nfs/dbraw/zinc/44/39/76/388443976.db2.gz BIRGLZHIHITJAN-SWLSCSKDSA-N 0 3 246.354 2.253 50 70 BEIAHN Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)[C@H](C)N)C1 ZINC000161288969 179349806 /nfs/dbraw/zinc/34/98/06/179349806.db2.gz ZYJWGKORXCVAQI-AGIUHOORSA-N 0 3 246.354 2.047 50 70 BEIAHN Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)CN)cc1 ZINC000161234442 388442966 /nfs/dbraw/zinc/44/29/66/388442966.db2.gz BIRGLZHIHITJAN-IUODEOHRSA-N 0 3 246.354 2.253 50 70 BEIAHN Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)CN)cc1 ZINC000161234319 388443064 /nfs/dbraw/zinc/44/30/64/388443064.db2.gz BIRGLZHIHITJAN-DOMZBBRYSA-N 0 3 246.354 2.253 50 70 BEIAHN Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)CN)cc1 ZINC000161234568 388444181 /nfs/dbraw/zinc/44/41/81/388444181.db2.gz BIRGLZHIHITJAN-WFASDCNBSA-N 0 3 246.354 2.253 50 70 BEIAHN Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)[C@H](C)N)C1 ZINC000161288571 179332294 /nfs/dbraw/zinc/33/22/94/179332294.db2.gz ZYJWGKORXCVAQI-RWMBFGLXSA-N 0 3 246.354 2.047 50 70 BEIAHN Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)[C@H](C)N)C1 ZINC000161288851 179330316 /nfs/dbraw/zinc/33/03/16/179330316.db2.gz ZYJWGKORXCVAQI-FRRDWIJNSA-N 0 3 246.354 2.047 50 70 BEIAHN Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)[C@@H](C)N)C1 ZINC000161289505 179331996 /nfs/dbraw/zinc/33/19/96/179331996.db2.gz ZYJWGKORXCVAQI-YNEHKIRRSA-N 0 3 246.354 2.047 50 70 BEIAHN Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)[C@@H](C)N)C1 ZINC000161289617 179349784 /nfs/dbraw/zinc/34/97/84/179349784.db2.gz ZYJWGKORXCVAQI-XQQFMLRXSA-N 0 3 246.354 2.047 50 70 BEIAHN