S-5751

Ligand id: 1898

Name: S-5751

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 9
Topological polar surface area 114.87
Molecular weight 441.2
XLogP 5.37
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(Z)-7-[(1R,2R,3R,5S)-2-[(5-hydroxy1-benzothiophene-3-carbonyl)amino]-7,7-dimethyl-3-bicyclo[3.1.1]heptanyl]hept-5-enoic acid
Synonyms
S5751
Comments
The ChEMBL links above show alternative stereoisomers of this compound.
Database Links
GtoPdb PubChem SID 135650972
PubChem CID 5311213
Search Google for chemical match using the InChIKey ZXBHFWFKSIYJEK-VAIANQQOSA-N
Search Google for chemicals with the same backbone ZXBHFWFKSIYJEK
Search UniChem for chemical match using the InChIKey ZXBHFWFKSIYJEK-VAIANQQOSA-N
Search UniChem for chemicals with the same backbone ZXBHFWFKSIYJEK