Compound Detail
CHEMBL426272
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Basic Information
| ChEMBL ID | CHEMBL426272 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NNEJIDTYNNKUKV-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
335.4
MW (Da)
3.97
ALogP
4
HBA
2
HBD
75.6
PSA (Ų)
0.47
QED
0
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.98
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Transient receptor potential cation channel subfamily V member 1 CHEMBL4794 | IC50 | 4.98 | 4.98 | 10380.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Transient receptor potential cation channel subfamily V member 1 | IC50 | = | 10380.0 | nM | 4.98 | Inhibition of 100 nM capsaicin effect on intracellular [Ca2+] concentration in H... | 16000002 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16000002 | 10.1021/jm050139q | Transient receptor potential cation channel subfamily V member 1 | 1 |
Data from ChEMBL 36 via Core Engine