Compound Detail
CHEMBL1923609
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
CC[C@H](C)[C@@H]1NCCOc2ccccc2CCCNC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](C)N(C)C1=O
Basic Information
| ChEMBL ID | CHEMBL1923609 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | TUFREBLXGZQYFP-DJCWJLACSA-N |
1
Targets
4
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
522.7
MW (Da)
2.71
ALogP
5
HBA
3
HBD
99.8
PSA (Ų)
0.57
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 10.0
EC50 1 meas. best 9.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Growth hormone secretagogue receptor type 1 CHEMBL4616 | Ki | 10.0 | 8.8033 | 0.1 | 3 |
| Growth hormone secretagogue receptor type 1 CHEMBL4616 | EC50 | 9.0 | 9.0 | 1.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Growth hormone secretagogue receptor type 1 | Ki | = | 0.1 | nM | 10.0 | Displacement of [125I]-Ghrelin from human GSHR1a transfected in HEK293 cell memb... | - |
| Growth hormone secretagogue receptor type 1 | EC50 | = | 1.0 | nM | 9.0 | Agonist activity at human GSHR1a transfected in CHOK1 cells co-expressing Galpha... | - |
| Growth hormone secretagogue receptor type 1 | Ki | = | 6.0 | nM | 8.22 | Agonist activity at ghrelin receptor | 21381769 |
| Growth hormone secretagogue receptor type 1 | Ki | = | 6.4 | nM | 8.19 | Displacement of [125I-His9]-ghrelin from human GRLN receptor by radioligand bind... | 22106937 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22106937 | 10.1021/jm2007062 | Growth hormone secretagogue receptor type 1 | 2 |
| 21381769 | 10.1021/jm1012374 | Growth hormone secretagogue receptor type 1 | 1 |
Data from ChEMBL 36 via Core Engine