APHE-4

AlkaPlorer ID: AK049629

Synonym: 'APHE-4'

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

Structure

SMILES: CCCCC1=CNN2C(=O)C3=CC=CC=C3C=C12

copy

InChI: InChI=1S/C15H16N2O/c1-2-3-6-12-10-16-17-14(12)9-11-7-4-5-8-13(11)15(17)18/h4-5,7-10,16H,2-3,6H2,1H3

copy

InChIKey: KDCMAABJEFHCHD-UHFFFAOYSA-N

copy

Properties Information

Molecule Weight: 240.306

TPSA: 37.27

MolLogP: 3.123400000000001

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