Compound Detail
CHEMBL4216761
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Basic Information
| ChEMBL ID | CHEMBL4216761 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BRRVCURODGLQPJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
330.1
MW (Da)
2.78
ALogP
2
HBA
3
HBD
90.4
PSA (Ų)
0.80
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 7.55
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Uracil nucleotide/cysteinyl leukotriene receptor CHEMBL1075162 | EC50 | 7.55 | 7.55 | 27.9 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Uracil nucleotide/cysteinyl leukotriene receptor | EC50 | = | 27.9 | nM | 7.55 | Agonist activity at human GPR17 expressed in human 1321N1 cells assessed as indu... | 30048589 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30048589 | 10.1021/acs.jmedchem.7b01768 | Uracil nucleotide/cysteinyl leukotriene receptor | 2 |
| 30048589 | 10.1021/acs.jmedchem.7b01768 | P2Y purinoceptor 1 | 1 |
| 30048589 | 10.1021/acs.jmedchem.7b01768 | P2Y purinoceptor 2 | 1 |
| 30048589 | 10.1021/acs.jmedchem.7b01768 | P2Y purinoceptor 4 | 1 |
| 30048589 | 10.1021/acs.jmedchem.7b01768 | P2Y purinoceptor 6 | 1 |
| 30048589 | 10.1021/acs.jmedchem.7b01768 | P2Y purinoceptor 12 | 1 |
| 30048589 | 10.1021/acs.jmedchem.7b01768 | P2Y purinoceptor 14 | 1 |
Data from ChEMBL 36 via Core Engine