General
Preferred name
Dimethylcrocetin
Synonyms
Crocetine dimethyl ester ()
P&D ID
PD125033
CAS
5892-54-6
Tags
available
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 397
DESCRIPTION Crocetine dimethyl ester (Dimethylcrocetin) is a saffronin derivative exhibiting antioxidant properties, inhibition of AChE activity, and suppression of cell growth and differentiation. (TargetMol Bioactive Compound Library)
Compound Sets
2
MedChem Express Bioactive Compound Library
HY-N6899
TargetMol Bioactive Compound Library
T10886
External IDs
15
Properties
(calculated by RDKit )
Molecular Weight
356.2
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
0
Rotatable Bonds
8
Ring Count
0
Aromatic Ring Count
0
cLogP
4.79
TPSA
52.6
Fraction CSP3
0.27
Chiral centers
0.0
Largest ring
0.0
QED
0.36
QED
0.36
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
antioxidant
DNA/RNA Synthesis
Pathway
Cell Cycle/DNA Damage
oxidation-reduction
Source data