smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[N@@H+](CCO)Cc1cc(Nc2c3ccccc3[nH+]c3ccccc32)ccc1O ZINC000004366365 570371131 /nfs/dbraw/zinc/37/11/31/570371131.db2.gz YETIACSWUXENPF-UHFFFAOYSA-N 2 1 387.483 4.651 40 10 GJCBMP Cc1cc(C[NH+](C)C)c(O)c(C(c2cc(C)cc(C[NH+](C)C)c2O)C(C)C)c1 ZINC000255189961 209046859 /nfs/dbraw/zinc/04/68/59/209046859.db2.gz UBIFAXWQROZSRI-UHFFFAOYSA-N 2 1 384.564 4.626 40 10 GJCBMP