Molecule ID: mol3017

SMILES: O=NC(=O)CCc1ccc(CNCC23CC4CC(CC(C4)C2)C3)cc1

InChI: InChI=1S/C21H28N2O2/c24-20(23-25)6-5-15-1-3-16(4-2-15)13-22-14-21-10-17-7-18(11-21)9-19(8-17)12-21/h1-4,17-19,22H,5-14H2

Experimental Macro pKa Values

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