smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC1=NN(c2ccc(C)c(Cl)c2)C(=O)C1C=Nc1ccccc1C(=O)[O-] ZINC000408531776 570513451 /nfs/dbraw/zinc/51/34/51/570513451.db2.gz LODLCTKBKPUUHP-GDNBJRDFSA-N -1 2 369.808 4.065 40 10 FICBLM