smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name c1ccc(Oc2c3ccccc3[nH+]c3ccccc32)cc1 ZINC000003953394 567019728 /nfs/dbraw/zinc/01/97/28/567019728.db2.gz MFCLDPQGJMEEBE-UHFFFAOYSA-N 1 1 271.319 5.180 40 5 CKBBMO