Molecule ID: mol36290

SMILES: O=C1NCCNCCCNCCNC(=O)C1F

InChI: InChI=1S/C10H19FN4O2/c11-8-9(16)14-6-4-12-2-1-3-13-5-7-15-10(8)17/h8,12-13H,1-7H2,(H,14,16)(H,15,17)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.65 QSARToolbox 2 » 1
9.37 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization