General
Preferred name
INDOLE-3-BUTYRIC ACID
Synonyms
3-Indolebutyric Acid ()
IBA ()
Hormodin ()
3-Indolebutyric acid (IBA) ()
Indolebutyric acid ()
P&D ID
PD007678
CAS
111150-79-9
133-32-4
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)
DESCRIPTION Indole-3-butyric acid (3-indolebutyric acid) is a plant growth auxin and a good rooting agent. It can promote herbs and woody ornamental plant rooting and used for improving fruit rate. Indole 3-butyric acid is an auxin precursor, and is converted to indole 3-acetic acid (IAA) in a peroxisomal ¦Â-oxidation process[1].
PRICE 29
DESCRIPTION 3-Indolebutyric acid(IBA) is a plant hormone in the auxin family and is an ingredient in many commercial plant rooting horticultural products. (BOC Sciences Bioactive Compounds)
DESCRIPTION Indole-3-butyric acid (IBA) is a plant hormone in the auxin family and is an ingredient in many commercial plant rooting horticultural products. (TargetMol Bioactive Compound Library)
Compound Sets
8
Cayman Chemical Bioactives
Drug Repurposing Hub
DrugBank
Enamine BioReference Compounds
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
External IDs
36
Properties
(calculated by RDKit )
Molecular Weight
203.09
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
2
Rotatable Bonds
4
Ring Count
2
Aromatic Ring Count
2
cLogP
2.58
TPSA
53.09
Fraction CSP3
0.25
Chiral centers
0.0
Largest ring
6.0
QED
0.8
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Endogenous Metabolite
B2M, HLA-A, TRAC, TRBC1
Pathway
Metabolism
Metabolic Enzyme/Protease
Solubility
Soluble in DMSO (Slightly), Methanol (Slightly)
Source data