Ligand id: 9365

Name: CHIR-124

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 2
Topological polar surface area 68.76
Molecular weight 419.15
XLogP 3.73
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Ni ZJ, Barsanti P, Brammeier N, Diebes A, Poon DJ, Ng S, Pecchi S, Pfister K, Renhowe PA, Ramurthy S et al.. (2006)
4-(Aminoalkylamino)-3-benzimidazole-quinolinones as potent CHK-1 inhibitors.
Bioorg Med Chem Lett, 16 (12): 3121-41. [PMID:16603354]