compound 3 [PMID: 19097791]

Ligand id: 8185

Name: compound 3 [PMID: 19097791]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 4
Topological polar surface area 93.3
Molecular weight 454.21
XLogP 3.71
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Trujillo JI, Kiefer JR, Huang W, Thorarensen A, Xing L, Caspers NL, Day JE, Mathis KJ, Kretzmer KK, Reitz BA et al.. (2009)
2-(6-Phenyl-1H-indazol-3-yl)-1H-benzo[d]imidazoles: design and synthesis of a potent and isoform selective PKC-zeta inhibitor.
Bioorg. Med. Chem. Lett.19 (3): 908-11. [PMID:19097791]