CGP 12177

Ligand id: 532

Name: CGP 12177

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 4
Rotatable bonds 6
Topological polar surface area 82.62
Molecular weight 279.16
XLogP 1.02
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

View interactive charts of activity data from GtoPdb and ChEMBL (where available) across species

Selectivity at GPCRs
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
β1-adrenoceptor Hs Agonist Partial agonist 9.4 pKi - 4
pKi 9.4 [4]
β2-adrenoceptor Hs Antagonist Antagonist 9.4 pKi - 1,4
pKi 9.4 [1,4]
β1-adrenoceptor Hs Antagonist Antagonist 8.8 – 9.3 pKi - 1,3
pKi 8.8 – 9.3 [1,3]
β3-adrenoceptor Mm Agonist Partial agonist 6.8 pKi - 5
pKi 6.8 [5]
β3-adrenoceptor Rn Agonist Partial agonist 6.8 pKi - 5
pKi 6.8 [5]
β3-adrenoceptor Hs Agonist Partial agonist 6.1 – 7.3 pKi - 2,4-6
pKi 6.1 – 7.3 (Ki 7.94x10-7 – 5.01x10-8 M) [2,4-6]
Ligand mentioned in the following text fields