Molecule ID: mol8183

SMILES: Cc1nc2cnc(N(C)C)nc2n([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1=O

InChI: InChI=1S/C15H21N5O6/c1-6-13(25)20(12-7(17-6)4-16-15(18-12)19(2)3)14-11(24)10(23)9(22)8(5-21)26-14/h4,8-11,14,21-24H,5H2,1-3H3/t8-,9-,10+,11-,14-/m1/s1

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
1.99 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization