smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc(C)c(Br)c(CCl)c1 ZINC000217617710 344202747 /nfs/dbraw/zinc/20/27/47/344202747.db2.gz JODXEQMJLOFWSS-UHFFFAOYSA-N 0 0 233.536 3.805 10 50 BHGERN COc1cc(C)c(Cl)cc1CBr ZINC000259500807 385784492 /nfs/dbraw/zinc/78/44/92/385784492.db2.gz ULWMNBCBKOYVGH-UHFFFAOYSA-N 0 0 249.535 3.552 10 50 BHGERN