smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C1NC(=O)C(=Cc2cc(I)c(O)c(I)c2)C(=O)N1 ZINC000024543570 563020353 /nfs/dbraw/zinc/02/03/53/563020353.db2.gz QZDXZMLQQKNCOB-UHFFFAOYSA-N 0 2 483.987 2.191 10 10 JECELN