Compound Detail
CHEMBL279597
ALANINE 🧪 Phase III
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🧪 Phase III
Basic Information
| ChEMBL ID | CHEMBL279597 |
| Name | ALANINE |
| Phase | Phase III |
| Structure Type | MOL |
| InChI Key | QNAYBMKLOCPYGJ-REOHCLBHSA-N |
1
Targets
3
Activities
2
Assay Types
4
PK Parameters
20
Publications
7
Known Names
7
Indications
Molecular Properties
89.1
MW (Da)
-0.58
ALogP
2
HBA
2
HBD
63.3
PSA (Ų)
0.45
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Single Enantiomer |
Indications
Coronary Disease Asthma Fructose Intolerance Alzheimer Disease Cognitive Dysfunction Glioma Severe Acute Respiratory Syndrome
Activity Summary
IC50 2 meas. best 4.11
Ki 1 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 4.11 | 4.11 | 78000.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| KA | 54.0 | uM | - |
| KA | 150.0 | uM | - |
| KA | 66.0 | uM | - |
| T1/2 | 1.292 | hr | Canis lupus familiaris |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 78000.0 | nM | 4.11 | Inhibition of binding of [3H]strychnine to N-methyl-D-aspartate glutamate recept... | 2549245 |
Literature References
Data from ChEMBL 36 via Core Engine