smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc(C(=O)[N-]c2n[n-]c(-c3ccc(C)o3)n2)on1 ZINC000160341902 358479490 /nfs/dbraw/zinc/47/94/90/358479490.db2.gz WBFLKMIRGSVCOO-UHFFFAOYSA-N -2 3 273.252 1.922 20 70 CDIDHL Cc1ccc(-c2nc([N-]C(=O)c3cnns3)n[n-]2)o1 ZINC000160219454 390945499 /nfs/dbraw/zinc/94/54/99/390945499.db2.gz RAGOUNJLKOOBFF-UHFFFAOYSA-N -2 3 276.281 1.477 20 70 CDIDHL Cc1ccc(-c2nc([N-]C(=O)c3cocn3)n[n-]2)o1 ZINC000160248220 538847867 /nfs/dbraw/zinc/84/78/67/538847867.db2.gz HTMIUXBXGCCUOM-UHFFFAOYSA-N -2 3 259.225 1.613 20 70 CDIDHL Cc1ccc(-c2nc([N-]C(=O)c3ccon3)n[n-]2)o1 ZINC000160280285 390965565 /nfs/dbraw/zinc/96/55/65/390965565.db2.gz GDWSLHPLBFBJIU-UHFFFAOYSA-N -2 3 259.225 1.613 20 70 CDIDHL