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(=CNCCCO)C(=O)N1 ZINC000006015774 351375904 /nfs/dbraw/zinc/37/59/04/351375904.db2.gz VZIMUGNIEWHRQG-UHFFFAOYSA-N -1 0 213.193 -1.792 10 10 BACERM