Molecule ID: mol18929

SMILES: N=CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2

InChI: InChI=1S/C17H22N2O3/c18-11-19-13-6-7-14(19)9-15(8-13)22-17(21)16(10-20)12-4-2-1-3-5-12/h1-5,11,13-16,18,20H,6-10H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization