smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name N#C/C(=C\c1ccc(OCC(=O)[O-])cc1)C(=O)Nc1ccccc1C(F)(F)F ZINC000006258546 956876077 /nfs/dbraw/zinc/87/60/77/956876077.db2.gz YCIDLIFGPDMOLJ-UKTHLTGXSA-N -1 0 390.317 3.714 40 50 GHGBRM N#C/C(=C/c1ccc(OCc2ccc(C(=O)[O-])cc2)cc1)C(=O)NC1CCCC1 ZINC000409192213 973926188 /nfs/dbraw/zinc/92/61/88/973926188.db2.gz VRCOFSJKXYSUTC-UYRXBGFRSA-N -1 0 390.439 3.930 40 50 GHGBRM N#C/C(=C/c1ccccc1OCc1ccc(C(=O)[O-])cc1)C(=O)NC1CCCC1 ZINC000409193299 973925990 /nfs/dbraw/zinc/92/59/90/973925990.db2.gz IUJWHRDVSLZMSO-UYRXBGFRSA-N -1 0 390.439 3.930 40 50 GHGBRM N#C/C(=C\c1ccc(-c2ccc(C(=O)[O-])cc2)o1)C(=O)NCCc1ccccc1 ZINC000011288151 956890399 /nfs/dbraw/zinc/89/03/99/956890399.db2.gz SVPJKNJKYZLLDL-XMHGGMMESA-N -1 0 386.407 3.911 40 50 GHGBRM