cangrelor

Ligand id: 1776

Name: cangrelor

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 17
Hydrogen bond donors 7
Rotatable bonds 16
Topological polar surface area 335.94
Molecular weight 774.95
XLogP -0.92
No. Lipinski's rules broken 3

Molecular properties generated using the CDK

View interactive charts of activity data from ChEMBL and GtoPdb across species (New!)

Selectivity at human GPCRs
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
P2Y12 receptor Antagonist Antagonist 8.0 – 9.4 pIC50 - 1,5
pIC50 9.4 (IC50 4x10-10 M) [1]
pIC50 8.0 [5]
P2Y13 receptor Antagonist Antagonist 8.3 pIC50 - 4
pIC50 8.3 [4]
Selectivity at mouse GPCRs
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
GPR17 Antagonist Antagonist 8.9 pIC50 - 3
pIC50 8.9 (IC50 1.2x10-9 M) [3]
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