Compound Detail
CHEMBL499491
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N=C(N)NCCC[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)c2cc([N+](=O)[O-])ccc2SC[C@@H](C(N)=O)NC(=O)[C@H](Cc2ccccc2)NC1=O
Basic Information
| ChEMBL ID | CHEMBL499491 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DWZVYIZZTXACDW-RTMXLORFSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
855.0
MW (Da)
-0.06
ALogP
11
HBA
10
HBD
322.3
PSA (Ų)
0.03
QED
3
Ro5 Violations
12
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18412316 | 10.1021/jm701181n | Melanocyte-stimulating hormone receptor | 3 |
| 18412316 | 10.1021/jm701181n | Melanocortin receptor 3 | 3 |
| 18412316 | 10.1021/jm701181n | Melanocortin receptor 4 | 3 |
| 18412316 | 10.1021/jm701181n | Melanocortin receptor 5 | 3 |
Data from ChEMBL 36 via Core Engine