CHEMBL91957
| SMILES | N=C(N)NCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NS(=O)(=O)c1ccc(Cl)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |
| InChIKey | NPVNOTIZHSHLKZ-YRCZKMHPSA-N |
Chemical properties
| Hydrogen bond acceptors | None |
| Hydrogen bond donors | None |
| Rotatable bonds | None |
| Molecular weight (Da) |
Drug properties
| Molecular type | Protein |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| MC1 | MSHR | Human | Melanocortin | A | pKi | 6.77 | 6.77 | 6.77 | ChEMBL |
| MC3 | MC3R | Human | Melanocortin | A | pKi | 6.36 | 6.36 | 6.36 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pKi | 7.18 | 7.18 | 7.18 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| MC1 | MSHR | Human | Melanocortin | A | pEC50 | 7.48 | 7.48 | 7.48 | ChEMBL |
| MC3 | MC3R | Human | Melanocortin | A | pEC50 | 6.41 | 6.41 | 6.41 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pEC50 | 7.96 | 7.96 | 7.96 | ChEMBL |