smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCOc1nc2cc(C(=O)Nc3cc([N+](=O)[O-])ccc3O)ccc2[nH]1 ZINC000346849266 475909284 /nfs/dbraw/zinc/90/92/84/475909284.db2.gz RYYGNDOQCPDMFW-UHFFFAOYSA-N -2 2 342.311 2.828 20 5 EFBDLL