[3H]iloprost

Ligand id: 1966

Name: [3H]iloprost    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 8
Topological polar surface area 77.76
Molecular weight 360.23
XLogP 3.19
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(5Z)-5-[(3aS,4R,5R,6aR)-5-hydroxy-4-[(E,3S)-3-hydroxy-4-methyloct-1-en-6-ynyl]-1-tritio-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]pentanoic acid
Synonyms
[3H]-Iloprost
[3H]ciloprost
[3H]ventavis
Database Links
ChEMBL Ligand CHEMBL1628635
PubChem CID 53320668
Search Google for chemical match using the InChIKey HIFJCPQKFCZDDL-URMZZKEUSA-N
Search Google for chemicals with the same backbone HIFJCPQKFCZDDL