Compound Detail
CHEMBL1261
CITRIC ACID 💊 Approved Drug
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💊 Approved Drug
Basic Information
| ChEMBL ID | CHEMBL1261 |
| Name | CITRIC ACID |
| Phase | Approved |
| Structure Type | MOL |
| InChI Key | KRKNYBCHXYNGOX-UHFFFAOYSA-N |
2
Targets
16
Activities
3
Assay Types
0
PK Parameters
20
Publications
29
Known Names
6
Indications
Molecular Properties
192.1
MW (Da)
-1.25
ALogP
4
HBA
4
HBD
132.1
PSA (Ų)
0.43
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| First Approval | 1982 |
| Availability | Prescription |
| Chirality | Achiral |
Indications
Nephrocalcinosis Renal Insufficiency Cataract Kidney Calculi Tension-Type Headache Osteoarthritis
ATC Classification
A09AB04
citric acid
Level 1: ALIMENTARY TRACT AND METABOLISM
Level 2: DIGESTIVES, INCL. ENZYMES
Activity Summary
IC50 11 meas.
Ki 3 meas.
Kd 2 meas. best 5.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 3-dehydroquinate dehydratase CHEMBL4680 | Kd | 5.6 | 5.6 | 2500.0 | 1 |
| 3-dehydroquinate dehydratase CHEMBL5276 | Kd | 5.14 | 5.14 | 7300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 3-dehydroquinate dehydratase | Kd | = | 2500.0 | nM | 5.6 | Binding affinity for Helicobacter pylori DHQase 2 | 16480265 |
| 3-dehydroquinate dehydratase | Kd | = | 7300.0 | nM | 5.14 | Binding affinity for Streptomyces coelicolor DHQase 2 | 16480265 |
Literature References
Data from ChEMBL 36 via Core Engine