compound 17 [PMID: 15300839]

Ligand id: 715

Name: compound 17 [PMID: 15300839]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 7
Topological polar surface area 75.81
Molecular weight 438.2
XLogP 6.98
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Kessler A, Faure H, Roussanne MC, Ferry S, Ruat M, Dauban P, Dodd RH. (2004)
N(1)-Arylsulfonyl-N(2)-(1-(1-naphthyl)ethyl)-1,2-diaminocyclohexanes: a new class of calcilytic agents acting at the calcium-sensing receptor.
Chembiochem., 5: 1131-1136. [PMID:15300839]