smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=S(=O)(CS(=O)(=O)[n+]1ccccc1)[n+]1ccccc1 ZINC000001703751 534973698 /nfs/dbraw/zinc/97/36/98/534973698.db2.gz FWGVXOWUXXYLLA-UHFFFAOYSA-N 2 0 300.361 -0.725 40 10 DBCBRP C[NH+]1CCN(C[C@@H]2OC[C@H]([NH2+]Cc3ccccc3O)[C@H]2O)CC1 ZINC000514289436 257216210 /nfs/dbraw/zinc/21/62/10/257216210.db2.gz UEPWZVGKXBJMAZ-BHYGNILZSA-N 2 0 321.421 -0.143 40 10 biogenic,in-vitro DBCBRP