smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=c1[n-]c(-c2ccc(Br)cc2)nn1-c1ccc([N+](=O)[O-])cc1 ZINC000015444210 220155152 /nfs/dbraw/zinc/15/51/52/220155152.db2.gz SVSCPBYEVOLTAI-UHFFFAOYSA-N -1 0 361.155 2.898 30 5 FFBCRM