Compound Detail
CHEMBL5763475
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CN(CCN(C)Cc1ccc(C#N)cc1)CC(=O)N/N=C/c1cc(C(C)(C)C)cc(C(C)(C)C)c1O
Basic Information
| ChEMBL ID | CHEMBL5763475 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QBJGEAJIEOKISY-FDAWAROLSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
491.7
MW (Da)
4.37
ALogP
6
HBA
2
HBD
92.0
PSA (Ų)
0.40
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.11
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hypoxia-inducible factor 1-alpha CHEMBL4261 | EC50 | 5.11 | 5.11 | 7750.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hypoxia-inducible factor 1-alpha | EC50 | = | 7750.0 | nM | 5.11 | Stabilization of HIF-1alpha: The compounds were formulated with DMSO to form 30 ... | - |
Data from ChEMBL 36 via Core Engine