Molecule ID: mol2766

SMILES: C1=C(c2ccc3ccccc3c2)N2CCN=C2c2ccccc21

InChI: InChI=1S/C21H16N2/c1-2-6-16-13-18(10-9-15(16)5-1)20-14-17-7-3-4-8-19(17)21-22-11-12-23(20)21/h1-10,13-14H,11-12H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.20 Novartis 1 » 0
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Charge States and Microspecies Visualization