Compound Detail
CHEMBL151658
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Basic Information
| ChEMBL ID | CHEMBL151658 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OOARYLWNROHOKX-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
257.4
MW (Da)
3.67
ALogP
3
HBA
1
HBD
23.5
PSA (Ų)
0.89
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Prostaglandin G/H synthase 1 CHEMBL221 | IC50 | 6.0 | 6.0 | 1000.0 | 1 |
| Prostaglandin G/H synthase 2 CHEMBL230 | IC50 | 5.3 | 5.3 | 5000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Prostaglandin G/H synthase 1 | IC50 | = | 1000.0 | nM | 6.0 | Inhibitory activity was evaluated against human Prostaglandin G/H synthase 1 was... | 9871612 |
| Prostaglandin G/H synthase 2 | IC50 | = | 5000.0 | nM | 5.3 | Inhibitory activity was evaluated against human Prostaglandin G/H synthase 2 was... | 9871612 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9871612 | 10.1016/s0960-894x(98)00068-7 | Prostaglandin G/H synthase 1 | 1 |
| 9871612 | 10.1016/s0960-894x(98)00068-7 | Prostaglandin G/H synthase 2 | 1 |
Data from ChEMBL 36 via Core Engine