smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccc(/C=C/C(=O)c2cc(Cl)ccc2O)c(C)c1 ZINC000039024173 174161846 /nfs/dbraw/zinc/16/18/46/174161846.db2.gz SZJSECXUIKKWES-FNORWQNLSA-N 0 2 286.758 4.559 1 30 CJEFLN