APHE-3

AlkaPlorer ID: AK002117

Synonym: 'APHE-3'

IUPAC Name: 3-methyl-1H-pyrazolo[1,5-b]isoquinolin-9-one

Structure

SMILES: CC1=CNN2C(=O)C3=CC=CC=C3C=C12

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InChI: InChI=1S/C12H10N2O/c1-8-7-13-14-11(8)6-9-4-2-3-5-10(9)12(14)15/h2-7,13H,1H3

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InChIKey: LHQKZRJESIWELY-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 198.225

TPSA: 37.27

MolLogP: 2.08922

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information