General
Preferred name
Decylsulfonic acid
Synonyms
Decane-1-sulfonic acid ()
Decane-1-sulfonate ()
1-Decanesulfonic acid ()
P&D ID
PD005806
CAS
20283-21-0
Tags
available
drug candidate
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 662
DESCRIPTION 1-Decanesulfonic acid (Decane-1-sulfonic acid) is a potential amyloid beta peptide (A??40) inhibitor, useful for studying cardiovascular diseases.
DESCRIPTION 1-Decanesulfonic acid (Decane-1-sulfonic acid) is a potential amyloid beta peptide (Aβ40) inhibitor, useful for studying cardiovascular diseases. (TargetMol Bioactive Compound Library)
Compound Sets
2
DrugBank
TargetMol Bioactive Compound Library
External IDs
22
Properties
(calculated by RDKit )
Molecular Weight
222.13
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
1
Rotatable Bonds
9
Ring Count
0
Aromatic Ring Count
0
cLogP
3.01
TPSA
54.37
Fraction CSP3
1.0
Chiral centers
0.0
Largest ring
0.0
QED
0.48
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Endogenous Metabolite
Pathway
Metabolism
Source data