Molecule ID: mol19083

SMILES: N#Cc1ccc(-c2n[nH]c3c2Cc2ccc(OCCCN4CCCOCC4)cc2-3)cn1

InChI: InChI=1S/C24H25N5O2/c25-15-19-5-3-18(16-26-19)23-22-13-17-4-6-20(14-21(17)24(22)28-27-23)31-11-2-8-29-7-1-10-30-12-9-29/h3-6,14,16H,1-2,7-13H2,(H,27,28)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
9.10 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization