compound 23i [PMID: 17929793]

Ligand id: 6348

Name: compound 23i [PMID: 17929793]

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 82.7
Molecular weight 384.04
XLogP 2.44
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(5R)-14-(4-chlorophenyl)-5-methyl-6-oxa-11-thia-3,9,14,16-tetraazatetracyclo[8.7.0.0^{2,7}.0^{12,17}]heptadeca-1,7,9,12(17),15-pentaen-13-one
Database Links
ChEMBL Ligand CHEMBL241327
GtoPdb PubChem SID 178102966
PubChem CID 16659802
Search Google for chemical match using the InChIKey LFUPTQIEOBBAJE-SECBINFHSA-N
Search Google for chemicals with the same backbone LFUPTQIEOBBAJE
Search UniChem for chemical match using the InChIKey LFUPTQIEOBBAJE-SECBINFHSA-N
Search UniChem for chemicals with the same backbone LFUPTQIEOBBAJE