General
Preferred name
Columbin
Synonyms
P&D ID
PD063751
CAS
546-97-4
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)
DESCRIPTION Columbin is an orally active diterpenoid furanolactone from Calumbae radix, has anti-inflammatory and anti-trypanosomal effects. Columbin selectively inhibits COX-2 (EC50=53.1 ¦ÌM) over COX-1 (EC50=327 ¦ÌM)[1][2].
PRICE 39
DESCRIPTION 1. Columbin has anti-inflammatory activity. 2. Columbin has chemopreventive ability against human colon cancer. 3. Columbin inhibits PLA2 hydrolysis of ghost RBC in a dose-dependent fashion. (TargetMol Bioactive Compound Library)
Compound Sets
3
Cayman Chemical Bioactives
24105
MedChem Express Bioactive Compound Library
HY-N0389
TargetMol Bioactive Compound Library
T4S0590
External IDs
14
Properties
(calculated by RDKit )
Molecular Weight
358.14
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
1
Rotatable Bonds
1
Ring Count
6
Aromatic Ring Count
1
cLogP
2.53
TPSA
85.97
Fraction CSP3
0.6
Chiral centers
7.0
Largest ring
6.0
QED
0.61
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
COX
Parasite
PLA2
Pathway
Immunology/Inflammation
Metabolism
Microbiology/virology
Neuroscience
Anti-infection
Source data