Compound Detail
CHEMBL415571
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CCNC(=O)[C@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1
Basic Information
| ChEMBL ID | CHEMBL415571 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OVJUBSAGGRBLLG-DXXSMRTMSA-N |
1
Targets
1
Activities
1
Assay Types
2
PK Parameters
2
Publications
0
Known Names
Molecular Properties
1200.4
MW (Da)
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 9.81
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Lutropin-choriogonadotropic hormone receptor CHEMBL2456 | Ki | 9.81 | 9.81 | 0.2 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| CL | 13.3 | mL.min-1.kg-1 | Rattus norvegicus |
| T1/2 | 0.2483 | hr | Rattus norvegicus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Lutropin-choriogonadotropic hormone receptor | Ki | = | 0.1549 | nM | 9.81 | Negative logarithm of equilibrium dissociation constant in the rat pituitary lut... | 1433199 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1433199 | 10.1021/jm00099a017 | Rattus norvegicus | 3 |
| 1433199 | 10.1021/jm00099a017 | Lutropin-choriogonadotropic hormone receptor | 1 |
Data from ChEMBL 36 via Core Engine