smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C([O-])c1sc2cc([O-])cc(F)c2c1Cl ZINC000228938848 526413392 /nfs/dbraw/zinc/41/33/92/526413392.db2.gz NPZDJWUELBQDTB-UHFFFAOYSA-N -2 1 246.646 3.098 40 0 BGABML O=C([O-])c1sc2c(c1Cl)c([O-])ccc2F ZINC000228973115 526413201 /nfs/dbraw/zinc/41/32/01/526413201.db2.gz YOLGTGPDSFGAND-UHFFFAOYSA-N -2 1 246.646 3.098 40 0 BGABML