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(=O)C(=Cc2cc(I)c([O-])c(I)c2)C(=O)N1 ZINC000024543570 563020352 /nfs/dbraw/zinc/02/03/52/563020352.db2.gz QZDXZMLQQKNCOB-UHFFFAOYSA-N -2 0 483.987 2.191 10 10 JECERL