Ligand id: 7914

Name: BV-6

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 18
Hydrogen bond donors 8
Rotatable bonds 37
Topological polar surface area 239.28
Molecular weight 1204.74
XLogP 15.89
No. Lipinski's rules broken 4

Molecular properties generated using the CDK

1. Varfolomeev E, Blankenship JW, Wayson SM, Fedorova AV, Kayagaki N, Garg P, Zobel K, Dynek JN, Elliott LO, Wallweber HJ et al.. (2007)
IAP antagonists induce autoubiquitination of c-IAPs, NF-kappaB activation, and TNFalpha-dependent apoptosis.
Cell, 131 (4): 669-81. [PMID:18022362]