Ligand id: 289

Name: AC-42

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 8
Topological polar surface area 20.31
Molecular weight 301.24
XLogP 6.37
No. Lipinski's rules broken 1

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
M1 receptor Hs Agonist Full agonist 6.2 pKi - 1
pKi 6.2 [1]
M1 receptor Hs Allosteric modulator Negative 6.2 pKi - 1
pKi 6.2 [1]
Ligand mentioned in the following text fields