CHEMBL565474
SMILES | N=C(N)NCCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)CCc1c[nH]cn1)C(N)=O |
InChIKey | UXEANADRNJPXAY-VSKRKVRLSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 9 |
Rotatable bonds | 17 |
Molecular weight (Da) | 579.3 |
Drug properties
Molecular type | Small molecule |
Endogenous/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 |
MC5 | MC5R | Mouse | Melanocortin | A | pEC50 | 4.15 | 4.15 | 4.15 | ChEMBL |
MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 5.5 | 5.5 | 5.5 | ChEMBL |
MC4 | MC4R | Mouse | Melanocortin | A | pEC50 | 4.41 | 4.41 | 4.41 | ChEMBL |