Compound Detail
CHEMBL269306
CDDO-CN Enter ChEMBL ID:
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CC1(C)CC[C@]2(C#N)CC[C@]3(C)C(C(=O)C=C4[C@@]5(C)C=C(C#N)C(=O)C(C)(C)[C@@H]5CC[C@]43C)C2C1
Basic Information
| ChEMBL ID | CHEMBL269306 |
| Name | CDDO-CN |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VKTPMWHWKXESHY-PSLRDTHTSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
472.7
MW (Da)
6.73
ALogP
4
HBA
0
HBD
81.7
PSA (Ų)
0.39
QED
1
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 9.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RAW CHEMBL614631 | IC50 | 9.0 | 9.0 | 1.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| RAW | IC50 | = | 1.0 | nM | 9.0 | Inhibition of interferon gamma-stimulated NO production in RAW 264.7 cells after... | 17367124 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11909709 | 10.1016/s0960-894x(02)00105-1 | Mus musculus | 1 |
| 17367124 | 10.1021/jm070141c | RAW | 1 |
Data from ChEMBL 36 via Core Engine