L-735021

Ligand id: 3117

Name: L-735021

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 12
Hydrogen bond donors 5
Rotatable bonds 20
Topological polar surface area 197.12
Molecular weight 696.31
XLogP 11.12
No. Lipinski's rules broken 3

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(6R,7R)-1-(5-benzylhexyl)-4,7-dihydroxy-6-{[(4E)-6-methyl-9-phenylnon-4-enoyl]oxy}-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid
Synonyms
L 735021
Database Links
CAS Registry No. 160548-95-8 (source: Scifinder)
ChEMBL Ligand CHEMBL131201
PubChem CID 9853075
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