rivipansel

Ligand id: 8307

Name: rivipansel

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 37
Hydrogen bond donors 15
Rotatable bonds 34
Topological polar surface area 592.21
Molecular weight 1446.36
XLogP -2.74
No. Lipinski's rules broken 3

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(2S)-2-[(2R,3R,4S,5S,6R)-3-benzoyloxy-2-[(1R,2R,3S,5R)-3-[(2,4-dioxo-1H-pyrimidine-6-carbonyl)amino]-5-[2-[[2-[2-[2-oxo-2-[(3,6,8-trisulfonaphthalen-1-yl)amino]ethoxy]ethoxy]acetyl]amino]ethylcarbamoyl]-2-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxycyclohexyl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3-cyclohexylpropanoic acid
International Nonproprietary Names
INN number INN
9776 rivipansel
Synonyms
GMI-1070 | PF-06460031 | PF-0646003102
Database Links
CAS Registry No. 927881-99-0
PubChem CID 44232546
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Comments
Rivipansel is a synthetic glycomimetic molecule, rationally designed as a pan-selectin inhibitor [1].