smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)[PH+](CCCC[PH+](C(C)C)C(C)C)C(C)C ZINC000002553983 567848179 /nfs/dbraw/zinc/84/81/79/567848179.db2.gz HRZSNESBRSONNG-UHFFFAOYSA-N 2 0 290.412 6.364 40 0 CKABRP CCCC[NH+](CCCC)CCC[NH+](CCCC)CCCC ZINC000004691834 566878036 /nfs/dbraw/zinc/87/80/36/566878036.db2.gz GFQVCRLEDYPCAB-UHFFFAOYSA-N 2 0 298.559 5.181 40 0 CKABRP CC(C)[PH+](CCC[PH+](C(C)C)C(C)C)C(C)C ZINC000059436710 567896250 /nfs/dbraw/zinc/89/62/50/567896250.db2.gz QRPNDOFSVHOGCK-UHFFFAOYSA-N 2 0 276.385 5.974 40 0 CKABRP