smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Oc1cc(F)ccc1C[NH2+]C12CC3CC(CC(C3)C1)C2 ZINC000095582191 185011034 /nfs/dbraw/zinc/01/10/34/185011034.db2.gz CAFMEFBXDAOXDX-UHFFFAOYSA-N 1 1 275.367 3.590 1 10 CHCFMO