smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(=O)c1cc2cc(NCc3cc(NC(=O)c4ccc(CN5CCN(C)CC5)cc4)ccc3C)cnc2[nH]1 ZINC000217076651 562877502 /nfs/dbraw/zinc/87/75/02/562877502.db2.gz POFMIZPRPLFRFO-UHFFFAOYSA-N 0 3 510.642 4.686 1 70 KJIFHN CC(=O)c1cc2cc(NCc3cc(NC(=O)c4ccc(CN5CCN(C)CC5)cc4)ccc3C)c[nH]c-2n1 ZINC000217076651 562877501 /nfs/dbraw/zinc/87/75/01/562877501.db2.gz POFMIZPRPLFRFO-UHFFFAOYSA-N 0 3 510.642 4.686 1 70 KJIFHN