Compound Detail
CHEMBL5465173
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O=c1n(Cc2cncn2-c2cccc(Cl)c2)nc(-c2ccc(Cl)cc2)n1C[C@H](O)C(F)(F)F
Basic Information
| ChEMBL ID | CHEMBL5465173 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QMCAUGCSTANBKK-SFHVURJKSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
498.3
MW (Da)
4.18
ALogP
7
HBA
1
HBD
77.9
PSA (Ų)
0.43
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL5463729 | Unchecked | 10 |
| - | 10.6019/CHEMBL5463729 | Insulin receptor | 3 |
| - | 10.6019/CHEMBL5463729 | Vasopressin V2 receptor | 3 |
| - | 10.6019/CHEMBL5463729 | Vasopressin V1a receptor | 3 |
| - | 10.6019/CHEMBL5463729 | MAP kinase-activated protein kinase 2 | 2 |
| - | 10.6019/CHEMBL5463729 | Tyrosine-protein kinase HCK | 2 |
| - | 10.6019/CHEMBL5463729 | D(2) dopamine receptor | 2 |
| - | 10.6019/CHEMBL5463729 | Protein kinase C beta type | 2 |
| - | 10.6019/CHEMBL5463729 | Ribosomal protein S6 kinase beta-1 | 2 |
| - | 10.6019/CHEMBL5463729 | Vasopressin V1b receptor | 2 |
| - | 10.6019/CHEMBL5463729 | Insulin-like growth factor 1 receptor | 2 |
| - | 10.6019/CHEMBL5463729 | Tyrosine-protein kinase Lck | 2 |
| - | 10.6019/CHEMBL5463729 | cGMP-dependent protein kinase 1 | 2 |
| - | 10.6019/CHEMBL5463729 | Cyclin-dependent kinase 5/CDK5 activator 1 | 2 |
| - | 10.6019/CHEMBL5463729 | Oxytocin receptor | 2 |
| - | 10.6019/CHEMBL5463729 | Phosphatidylinositol 4-phosphate 5-kinase type-1 gamma | 1 |
| - | 10.6019/CHEMBL5463729 | Type-2 angiotensin II receptor | 1 |
| - | 10.6019/CHEMBL5463729 | Type-1 angiotensin II receptor | 1 |
| - | 10.6019/CHEMBL5463729 | Alpha-2B adrenergic receptor | 1 |
| - | 10.6019/CHEMBL5463729 | Alpha-2A adrenergic receptor | 1 |
Data from ChEMBL 36 via Core Engine