smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Fc1cc(-c2[nH]cc[nH+]2)ccc1Br ZINC000238539004 387856369 /nfs/dbraw/zinc/85/63/69/387856369.db2.gz HJCQNBDFRMNGBQ-UHFFFAOYSA-N 1 2 241.063 2.978 30 0 BFACLO