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-]N(c2ccc(F)c(Cl)c2)C(=O)C1=C1C(=O)NC(=O)NC1=O ZINC000005943922 483416806 /nfs/dbraw/zinc/41/68/06/483416806.db2.gz VTKGKFWROYATJO-UHFFFAOYSA-N -1 1 352.665 -0.481 40 10 FBCBMM