compound 20 [PMID: 7473541]

Ligand id: 3114

Name: compound 20 [PMID: 7473541]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 12
Topological polar surface area 30.49
Molecular weight 305.24
XLogP 5
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
{3-[4-butoxy-2-(prop-2-en-1-yl)phenoxy]propyl}(propan-2-yl)amine
Database Links
ChEMBL Ligand CHEMBL132881
PubChem CID 10780929
Search Google for chemical match using the InChIKey BLGFFZRIKMFSOM-UHFFFAOYSA-N
Search Google for chemicals with the same backbone BLGFFZRIKMFSOM
Search UniChem for chemical match using the InChIKey BLGFFZRIKMFSOM-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone BLGFFZRIKMFSOM