CHEMBL365044
SMILES | N=C(N)NCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)CCCCc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |
InChIKey | SBGDEADNNXQBAR-YKKXUYLKSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 9 |
Rotatable bonds | 23 |
Molecular weight (Da) | 847.4 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MC1 | MSHR | Human | Melanocortin | A | pEC50 | 6.84 | 6.84 | 6.84 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pEC50 | 7.46 | 7.46 | 7.46 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pEC50 | 7.35 | 7.35 | 7.35 | ChEMBL |