PNU109291

Ligand id: 3228

Name: PNU109291

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 54.04
Molecular weight 409.24
XLogP 2.94
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(1S)-1-{2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}-N-methyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide
Synonyms
PNU 109291 | PNU-109,291 | PNU-109291
Database Links
CAS Registry No. 187665-60-7 (source: Scifinder)
ChEMBL Ligand CHEMBL71838
PubChem CID 9909448
Search Google for chemical match using the InChIKey UDLSEQDYARNKTL-QHCPKHFHSA-N
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Search UniChem for chemical match using the InChIKey UDLSEQDYARNKTL-QHCPKHFHSA-N
Search UniChem for chemicals with the same backbone UDLSEQDYARNKTL