smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COCCN1CCN(CCc2cn(CC(=O)OC)nn2)C[C@H]1C ZINC000159920477 377223304 /nfs/dbraw/zinc/22/33/04/377223304.db2.gz HJGVUPQFFIXQLX-CYBMUJFWSA-N 0 1 325.413 -0.354 10 70 EBIEMN COCCN1CCN(CCc2cn(CC(=O)OC)nn2)C[C@@H]1C ZINC000159920612 377223115 /nfs/dbraw/zinc/22/31/15/377223115.db2.gz HJGVUPQFFIXQLX-ZDUSSCGKSA-N 0 1 325.413 -0.354 10 70 EBIEMN CN(CC(=O)N1CCOCC1)C(=O)C[NH+]1CCC(c2cc[nH]n2)CC1 ZINC000160655499 378295257 /nfs/dbraw/zinc/29/52/57/378295257.db2.gz IUVKKVDOKHXMCM-UHFFFAOYSA-N 0 1 349.435 -0.094 10 70 EBIEMN