smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1c2oc3cc(O)ccc3c2[nH+]c2ccccc12 ZINC000007778771 364264849 /nfs/dbraw/zinc/26/48/49/364264849.db2.gz GGUDEBVCPAKUHC-UHFFFAOYSA-N -1 2 249.269 4.148 50 5 BIBALM