General
Preferred name
Indole-3-carboxylic acid
Synonyms
3-Indoleformic acid ()
3-Indoleformic acid, 3-Carboxyindole, β-Indolylcarboxylic acid, 3-indolecarboxylate, 3-indoleformate ()
3-Indoleformic acid, 3-Carboxyindole, ??Indolylcarboxylic acid, 3-indolecarboxylate, 3-indoleformate ()
3-Indoleformic acid, 3-Carboxyindole, ¦Â-Indolylcarboxylic acid, 3-indolecarboxylate, 3-indoleformate ()
P&D ID
PD088356
CAS
81546-15-8
771-50-6
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)
DESCRIPTION Indole-3-carboxylic acid is an orally active urinary indolic tryptophan metabolite. Indole-3-carboxylic acid is a mediator of priming against Plectosphaerella cucumerina. Indole-3-carboxylic acid enhances the anti-colorectal cancer potency of Doxorubicin (HY-15142A) by inducing cell senescence. Indole-3-carboxylic acid can be used in liver disease research[1][2][3][4].
PRICE 29
DESCRIPTION Indole-3-carboxylic acid is a plant metabolite derived from tryptophan. It has been found in Arabidopsis. It has diverse biological activities. (Enamine Bioactive Compounds)
DESCRIPTION Indole-3-carboxylic acid (3-Indoleformic acid) is a normal urinary indolic tryptophan metabolite . (TargetMol Bioactive Compound Library)
Compound Sets
5
Cayman Chemical Bioactives
31166
Enamine Bioactive Compounds
EBC-04079
MedChem Express Bioactive Compound Library
HY-40161
Selleckchem Bioactive Compound Library
indole-carboxylic-acid
TargetMol Bioactive Compound Library
T5984
External IDs
30
Properties
(calculated by RDKit )
Molecular Weight
161.05
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
2
Rotatable Bonds
1
Ring Count
2
Aromatic Ring Count
2
cLogP
1.87
TPSA
53.09
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.67
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Endogenous Metabolite
Human Endogenous Metabolite
Bacterial
Pathway
Metabolism
Anti-infection
Metabolic Enzyme/Protease
Source data