smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Nc1ccc(O[P@@](=O)([O-])O)cc1 2558168 169292299 /nfs/dbraw/zinc/29/22/99/169292299.db2.gz FXZCCINCKDATPA-UHFFFAOYSA-N -1 2 189.107 0.740 50 10 in-vitro ACCALM Nc1ccc(O[P@](=O)([O-])O)cc1 2558168 169292300 /nfs/dbraw/zinc/29/23/00/169292300.db2.gz FXZCCINCKDATPA-UHFFFAOYSA-N -1 2 189.107 0.740 50 10 in-vitro ACCALM