Molecule ID: mol21299

SMILES: CCCNC1=Nc2ccccc2C(C)N1

InChI: InChI=1S/C12H17N3/c1-3-8-13-12-14-9(2)10-6-4-5-7-11(10)15-12/h4-7,9H,3,8H2,1-2H3,(H2,13,14,15)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.70 OCHEM 0 » -1
10.70 Baltruschat ChEMBL 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization