compound 15 [Biller et al., 1993]

Ligand id: 3131

Name: compound 15 [Biller et al., 1993]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 10
Topological polar surface area 123.68
Molecular weight 402.14
XLogP 3.39
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Biller SA, Abt JW, Pudzianowski AT, Rich LC, Slusarchyk DA, Ciosek Jr CP. (1993)
Aromatic isosteres as conformational probes for an isoprenyl subunit: application to inhibitors of squalene synthase.
Bioorg. Med. Chem. Lett.3 (4): 595-600.