Molecule ID: mol20053

SMILES: C1=C(c2cccnc2)NCC1

InChI: InChI=1S/C9H10N2/c1-3-8(7-10-5-1)9-4-2-6-11-9/h1,3-5,7,11H,2,6H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
7.21 Baltruschat ChEMBL 1 » 0
7.40 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization