smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name c1cc(/N=N\c2ccccc2)c2cccccc1-2 ZINC000018101416 183388084 /nfs/dbraw/zinc/38/80/84/183388084.db2.gz FILMYAMPKWRDQD-ZCXUNETKSA-N 0 0 232.286 5.207 1 10 BKCFRN c1cc(/N=N/c2ccccc2)c2cccccc1-2 ZINC000097971496 183387827 /nfs/dbraw/zinc/38/78/27/183387827.db2.gz FILMYAMPKWRDQD-ISLYRVAYSA-N 0 0 232.286 5.207 1 10 BKCFRN CC1(C)C=CCC(C)(C)[C@H]1/N=N/c1ccccc1 ZINC000086862054 385054649 /nfs/dbraw/zinc/05/46/49/385054649.db2.gz SQLAQHGVFABVSY-YWMAMYRUSA-N 0 0 242.366 5.151 2 10 BKCFRN CC1(C)C=CCC(C)(C)[C@@H]1/N=N/c1ccccc1 ZINC000086862056 385054631 /nfs/dbraw/zinc/05/46/31/385054631.db2.gz SQLAQHGVFABVSY-IAFNSTAXSA-N 0 0 242.366 5.151 2 10 BKCFRN c1cc(N=Nc2ccccc2)c2cccccc1-2 ZINC000252602451 526432908 /nfs/dbraw/zinc/43/29/08/526432908.db2.gz FILMYAMPKWRDQD-UHFFFAOYSA-N 0 0 232.286 5.207 3 10 BKCFRN