smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ncc[nH+]c1NNC=C1C(=O)NC(=S)NC1=O ZINC000763364168 582148610 /nfs/dbraw/zinc/14/86/10/582148610.db2.gz VRZNHLXNKLOXSJ-UHFFFAOYSA-N 1 2 294.296 -1.184 20 10 CACDLO