Compound Detail
CHEMBL265064
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](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1[nH]c2ccc(OCCCCCN=C(N)N)cc2c1CCCCCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)O.O=C(O)C(F)(F)F
Basic Information
| ChEMBL ID | CHEMBL265064 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RCGFLSZYRYRIBJ-AWAWMKESSA-N |
| Parent Compound | CHEMBL1182770 |
| Active Moiety | CHEMBL1182770 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
835.1
MW (Da)
3.56
ALogP
8
HBA
10
HBD
298.6
PSA (Ų)
0.03
QED
2
Ro5 Violations
27
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 5.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neurotensin receptor CHEMBL2111438 | Kd | 5.48 | 5.48 | 3300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neurotensin receptor | Kd | = | 3300.0 | nM | 5.48 | Equilibrium dissociation constant at human Neurotensin receptor (NT) receptor in... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(01)80338-3 | Neurotensin receptor | 1 |
Data from ChEMBL 36 via Core Engine