General
Preferred name
CMP-sialic acid
Synonyms
CMP-Neu5Ac sodium salt ()
CMP-Sialic Acid (sodium salt) ()
CMP-Neu5Ac (sodium salt) ()
CMP-Sialic acid sodium salt ()
Cytidine-5'-Monophosphate-5-N-Acetylneuraminic Acid ()
P&D ID
PD047542
CAS
3063-71-6
1007117-62-5
Tags
available
drug candidate
Drug indication
Discovery agent
Drug Status
experimental
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
PRICE 283
DESCRIPTION CMP-Sialic acid sodium salt (CMP-Neu5Ac sodium salt) is a variant inhibitor of UDP-GlcNAc 2-epimerase, the activated form of sialic acid, which is widely found in animals and is involved in the metabolism of organisms. (TargetMol Bioactive Compound Library)
Compound Sets
10
Cayman Chemical Bioactives
Concise Guide to Pharmacology 2017/18
Concise Guide to Pharmacology 2019/20
Concise Guide to Pharmacology 2021/22
Concise Guide to Pharmacology 2023/24
DrugBank
DrugMAP
Guide to Pharmacology
MedChem Express Bioactive Compound Library
TargetMol Bioactive Compound Library
External IDs
47
Properties
(calculated by RDKit )
Molecular Weight
614.15
Hydrogen Bond Acceptors
17
Hydrogen Bond Donors
10
Rotatable Bonds
11
Ring Count
3
Aromatic Ring Count
1
cLogP
-5.27
TPSA
322.91
Fraction CSP3
0.7
Chiral centers
11.0
Largest ring
6.0
QED
0.1
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Endogenous Metabolite
Pathway
Metabolic Enzyme/Protease
Metabolism
Source data