BMS compound 4c

Ligand id: 5901

Name: BMS compound 4c

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 88.17
Molecular weight 470.14
XLogP 8.91
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

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

Selectivity at human GPCRs
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Target Type Action Affinity Units Concentration range (M) Reference
P2Y1 receptor Antagonist Antagonist 8.2 pKi - 1
pKi 8.2 (Ki 7x10-9 M) [1]