Molecule ID: mol18690

SMILES: NC(=O)c1ccc(Nc2c3ccccc3nc3ccccc23)cc1

InChI: InChI=1S/C20H15N3O/c21-20(24)13-9-11-14(12-10-13)22-19-15-5-1-3-7-17(15)23-18-8-4-2-6-16(18)19/h1-12H,(H2,21,24)(H,22,23)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization