smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccccc1-n1[n-]c(C(=O)[O-])cc1=O ZINC000059546253 175336282 /nfs/dbraw/zinc/33/62/82/175336282.db2.gz HBHYHEDQTJKSII-UHFFFAOYSA-N -2 0 234.211 0.873 10 10 BCCERL O=C([O-])c1ccc2c(c1)[N-]S(=O)(=O)N2 ZINC000002524382 541301749 /nfs/dbraw/zinc/30/17/49/541301749.db2.gz YSQVVDWEPHJIPT-UHFFFAOYSA-N -2 0 214.202 0.467 10 10 BCCERL