MNI-137

Ligand id: 6221

Name: MNI-137

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 78.14
Molecular weight 354.01
XLogP 2.48
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
4-(8-bromo-5-oxo-3,4,5,6-tetrahydro-1,6-benzodiazocin-2-yl)pyridine-2-carbonitrile
Synonyms
MNI 137
Database Links
CAS Registry No. 946619-21-2 (source: Scifinder)
PubChem CID 73755193
Search Google for chemical match using the InChIKey JNLRDCDCGXPNKH-DEDYPNTBSA-N
Search Google for chemicals with the same backbone JNLRDCDCGXPNKH
Search UniChem for chemical match using the InChIKey JNLRDCDCGXPNKH-DEDYPNTBSA-N
Search UniChem for chemicals with the same backbone JNLRDCDCGXPNKH