General
Preferred name
Caprylic acid
Synonyms
Mgk glyceride ()
OCTANOIC ACID ()
EDENOR C 8-98-100 ()
Kortacid-0899 ()
Prifac-2901 ()
NSC-5024 ()
N-octanoic acid ()
FEMA NO. 2799 ()
Octanoic Acid-d3 ()
Octanoic Acid-d15 ()
Octanoic Acid-13C ()
Octanoic Acid ()
P&D ID
PD006035
CAS
124-07-2
68937-75-7
156779-05-4
69974-55-6
59669-16-8
Tags
natural product
drug
available
Drug indication
Antifungal
Discovery agent
Drug Status
investigational
approved
Max Phase
Phase 2
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
1
Organisms
0
Compound Sets
18
ChEMBL Drugs
Concise Guide to Pharmacology 2017/18
Concise Guide to Pharmacology 2019/20
Concise Guide to Pharmacology 2021/22
Concise Guide to Pharmacology 2023/24
Drug Repurposing Hub
DrugBank
DrugCentral
DrugCentral Approved Drugs
DrugMAP
DrugMatrix
Enamine BioReference Compounds
Guide to Pharmacology
MedChem Express Bioactive Compound Library
NPC Screening Collection
ReFrame library
Selleckchem Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
70
Properties
(calculated by RDKit )
Molecular Weight
144.12
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
1
Rotatable Bonds
6
Ring Count
0
Aromatic Ring Count
0
cLogP
2.43
TPSA
37.3
Fraction CSP3
0.88
Chiral centers
0.0
Largest ring
0.0
QED
0.58
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Metabolic Enzyme/Protease
Target
Endogenous Metabolite
Source data
