smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=S(=O)([O-])O/C=C\c1ccc(O)c(O)c1 ZINC000038691534 182902627 /nfs/dbraw/zinc/90/26/27/182902627.db2.gz BGUVCXKOVJXTPG-ARJAWSKDSA-N -1 0 232.213 0.888 1 10 BCCFRM CCOC(=O)c1nc[n-]c1N=NN(C)CCO ZINC000001691766 170286478 /nfs/dbraw/zinc/28/64/78/170286478.db2.gz HIYZPSOAIKYDFP-OUKQBFOZSA-N -1 0 241.251 0.509 1 10 BCCFRM O=c1c2c(O)c(O)c([O-])cc2ccc(O)c1O ZINC000027427049 183000998 /nfs/dbraw/zinc/00/09/98/183000998.db2.gz DFUMZQXIGVXYQM-UHFFFAOYSA-N -1 0 236.179 0.728 1 10 BCCFRM