Compound Detail
CHEMBL360348
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Basic Information
| ChEMBL ID | CHEMBL360348 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IXLVEZSJEWZGBG-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
2
PK Parameters
2
Publications
0
Known Names
Molecular Properties
486.5
MW (Da)
7.24
ALogP
4
HBA
0
HBD
32.3
PSA (Ų)
0.40
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.84
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 7.84 | 7.61 | 14.4 | 3 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 15.0 | mL.min-1.kg-1 | Rattus norvegicus |
| F | 36.0 | % | Rattus norvegicus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 14.45 | nM | 7.84 | Displacement of [125I]o-CRF from recombinant human CRF receptors expressed in Ch... | 15946843 |
| Unchecked | IC50 | = | 28.18 | nM | 7.55 | Displacement of [125I]o-CRF from recombinant human CRF receptors expressed in Ch... | 15946843 |
| Unchecked | IC50 | = | 36.31 | nM | 7.44 | Displacement of [125I]o-CRF from recombinant human CRF receptors expressed in Ch... | 15946843 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15946843 | 10.1016/j.bmcl.2005.05.040 | Unchecked | 3 |
| 15946843 | 10.1016/j.bmcl.2005.05.040 | ADMET | 3 |
Data from ChEMBL 36 via Core Engine