oxymetazoline

Ligand id: 124

Name: oxymetazoline

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 44.62
Molecular weight 260.19
XLogP 3.55
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
5-HT1B receptor Hs Agonist Full agonist 9.5 pKi - 4
pKi 9.5 [4]
5-HT1D receptor Hs Agonist Partial agonist 9.4 pKi - 4
pKi 9.4 [4]
α2A-adrenoceptor Hs Agonist Partial agonist 8.0 – 8.6 pKi - 3,5,10
pKi 8.0 – 8.6 (Ki 1x10-8 – 2.8x10-9 M) [3,5,10]
α1A-adrenoceptor Hs Agonist Full agonist 8.0 – 8.2 pKi - 2,7-9
pKi 8.0 – 8.2 [2,7-9]
α2C-adrenoceptor Hs Agonist Partial agonist 6.7 pKi - 3,10
pKi 6.7 [3,10]
5-HT2C receptor Hs Agonist Full agonist 6.3 – 6.8 pKi - 1
pKi 6.3 – 6.8 [1]
α1B-adrenoceptor Hs Agonist Full agonist 6.5 pKi - 7-8
pKi 6.5 [7-8]
α1D-adrenoceptor Hs Agonist Partial agonist 6.4 pKi - 7-8
pKi 6.4 [7-8]
α1D-adrenoceptor Rn Agonist Partial agonist 6.2 pKi - 6
pKi 6.2 [6]
α2B-adrenoceptor Hs Agonist Partial agonist 5.5 – 6.2 pKi - 3,10
pKi 5.5 – 6.2 [3,10]
Ligand mentioned in the following text fields