TMB-8

Ligand id: 4323

Name: TMB-8

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 16
Topological polar surface area 57.23
Molecular weight 395.27
XLogP 4.29
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
8-(diethylamino)octyl 3,4,5-trimethoxybenzoate
Database Links
CAS Registry No. 57818-92-5 (source: Scifinder)
ChEMBL Ligand CHEMBL258764
PubChem CID 5494
Search Google for chemical match using the InChIKey IBQMHBGFMLHHLE-UHFFFAOYSA-N
Search Google for chemicals with the same backbone IBQMHBGFMLHHLE
Search UniChem for chemical match using the InChIKey IBQMHBGFMLHHLE-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone IBQMHBGFMLHHLE