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

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]