Molecule ID: mol17983

SMILES: c1cn2ccc3cc4c(nc3c2n1)CCCC4

InChI: InChI=1S/C14H13N3/c1-2-4-12-10(3-1)9-11-5-7-17-8-6-15-14(17)13(11)16-12/h5-9H,1-4H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.59 Baltruschat ChEMBL 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization