smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Nc1cccc(-c2nc(-c3ccc(Cl)cc3Cl)cs2)c1 ZINC000004245320 563326813 /nfs/dbraw/zinc/32/68/13/563326813.db2.gz WUBGZYDJPUCHPQ-UHFFFAOYSA-N 0 0 321.232 5.366 30 0 DKACRN Nc1cccc(-c2nc(-c3ccc(Cl)c(Cl)c3)cs2)c1 ZINC000004245321 563327059 /nfs/dbraw/zinc/32/70/59/563327059.db2.gz IOVPNBQFDMAQEY-UHFFFAOYSA-N 0 0 321.232 5.366 30 0 DKACRN CC(C)c1cc(Br)cc(C(C)C)c1Br ZINC000067802560 563457779 /nfs/dbraw/zinc/45/77/79/563457779.db2.gz WKGQNYMQIYJEDX-UHFFFAOYSA-N 0 0 320.068 5.458 30 0 DKACRN