A-794278

Ligand id: 6354

Name: A-794278

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 2
Topological polar surface area 64.68
Molecular weight 342.15
XLogP 2.84
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
5-cycloheptyl-13-(dimethylamino)-8-thia-3,5,10-triazatricyclo[7.4.0.0^{2,7}]trideca-1(13),2(7),3,9,11-pentaen-6-one
Synonyms
A 794278 | A794278 | compound 1ac [PMID: 16279797] [1]
Database Links
CAS Registry No. 869802-57-3 (source: Scifinder)
ChEMBL Ligand CHEMBL225032
PubChem CID 11537456
Search Google for chemical match using the InChIKey WOADNNTWYZOWNV-UHFFFAOYSA-N
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Search UniChem for chemical match using the InChIKey WOADNNTWYZOWNV-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone WOADNNTWYZOWNV