Molecule ID: mol5052

SMILES: CSC1(N(C)C)Nc2ccc3c(c2N1)CCCC3

InChI: InChI=1S/C14H21N3S/c1-17(2)14(18-3)15-12-9-8-10-6-4-5-7-11(10)13(12)16-14/h8-9,15-16H,4-7H2,1-3H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.70 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization