smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC1(C)C[C@H](NC(=O)C[N-]S(=O)(=O)c2cccs2)c2ccccc2O1 ZINC000159922529 531800507 /nfs/dbraw/zinc/80/05/07/531800507.db2.gz OLWSUYCDZFNQOF-ZDUSSCGKSA-N -1 3 380.491 2.445 10 70 GEIEHM CC1(C)C[C@@H](NC(=O)C[N-]S(=O)(=O)c2cccs2)c2ccccc2O1 ZINC000159922673 531800119 /nfs/dbraw/zinc/80/01/19/531800119.db2.gz OLWSUYCDZFNQOF-CYBMUJFWSA-N -1 3 380.491 2.445 10 70 GEIEHM