smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCN1CCC[C@@H]1CNC(=O)CC[C@@H]1NC(=O)N(CCc2c[nH]c3ccccc23)C1=O ZINC000218364040 557195692 /nfs/dbraw/zinc/19/56/92/557195692.db2.gz YLYGPNWDUGLILD-XLIONFOSSA-N 0 3 425.533 2.012 50 70 IEIAHN CCN1CCC[C@H]1CNC(=O)CC[C@@H]1NC(=O)N(CCc2c[nH]c3ccccc23)C1=O ZINC000218364118 557195601 /nfs/dbraw/zinc/19/56/01/557195601.db2.gz YLYGPNWDUGLILD-PXNSSMCTSA-N 0 3 425.533 2.012 50 70 IEIAHN