smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN(C)c1cnc(C(=O)[N-]NC(=O)[O-])cn1 ZINC000833871061 605730743 /nfs/dbraw/zinc/73/07/43/605730743.db2.gz KCRLRFRGFRUGEI-UHFFFAOYSA-N -2 3 225.208 -0.545 20 50 BBGDHL O=C([O-])NCC(=O)NN=Cc1ccc([O-])cn1 ZINC000834200739 605384813 /nfs/dbraw/zinc/38/48/13/605384813.db2.gz ALWHDNQMDOCIIC-UHFFFAOYSA-N -2 3 238.203 -0.495 20 50 BBGDHL