(-)-(S)-BayK8644

Ligand id: 4065

Name: (-)-(S)-BayK8644

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 81.47
Molecular weight 356.1
XLogP 6.31
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
methyl (4S)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate
Database Links
CAS Registry No. 98625-26-4 (source: Scifinder)
GtoPdb PubChem SID 178100888
PubChem CID 6603728
Search Google for chemical match using the InChIKey ZFLWDHHVRRZMEI-ZDUSSCGKSA-N
Search Google for chemicals with the same backbone ZFLWDHHVRRZMEI
Search UniChem for chemical match using the InChIKey ZFLWDHHVRRZMEI-ZDUSSCGKSA-N
Search UniChem for chemicals with the same backbone ZFLWDHHVRRZMEI