smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1[n-]n(-c2ccccc2)c(=S)c1C=Nc1cc([N+](=O)[O-])ccc1[O-] ZINC000100433121 222243993 /nfs/dbraw/zinc/24/39/93/222243993.db2.gz BNQLKYDIKIDOTN-GXDHUFHOSA-N -2 1 354.391 3.820 10 10 FHCEML