Molecule ID: mol19990

SMILES: O=C(NCCN1CCCC1)[C@H]1C[C@@H]1c1ccccc1

InChI: InChI=1S/C16H22N2O/c19-16(17-8-11-18-9-4-5-10-18)15-12-14(15)13-6-2-1-3-7-13/h1-3,6-7,14-15H,4-5,8-12H2,(H,17,19)/t14-,15+/m1/s1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization