ML SA1

Ligand id: 6386

Name: ML SA1

Structure and Physico-chemical Properties

2D Structure
Click here for structure editor
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 3
Topological polar surface area 57.69
Molecular weight 362.16
XLogP 3.6
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Shen D, Wang X, Li X, Zhang X, Yao Z, Dibble S, Dong XP, Yu T, Lieberman AP, Showalter HD et al.. (2012)
Lipid storage disorders block lysosomal trafficking by inhibiting a TRP channel and lysosomal calcium release.
Nat Commun, 3: 731. [PMID:22415822]