Compound Detail
CHEMBL117663
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Basic Information
| ChEMBL ID | CHEMBL117663 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FZRVIHRVKSRALK-KTKRTIGZSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
421.5
MW (Da)
6.00
ALogP
2
HBA
3
HBD
86.6
PSA (Ų)
0.14
QED
1
Ro5 Violations
19
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.71
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Lysophosphatidic acid receptor 2 CHEMBL3724 | EC50 | 5.71 | 5.71 | 1960.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Lysophosphatidic acid receptor 2 | EC50 | = | 1960.0 | nM | 5.71 | Agonistic activity against lysophosphatidic acid receptor 2 using [35S]GTP-gamma... | 15177455 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15177455 | 10.1016/j.bmcl.2004.04.061 | Lysophosphatidic acid receptor 1 | 2 |
| 15177455 | 10.1016/j.bmcl.2004.04.061 | Lysophosphatidic acid receptor 2 | 2 |
| 15177455 | 10.1016/j.bmcl.2004.04.061 | Lysophosphatidic acid receptor 3 | 2 |
Data from ChEMBL 36 via Core Engine