CHEMBL4871577
SMILES | CCC[C@@H]1CN([C@H](Cc2ccccc2)N2CCC[C@H]2CN2C(=N)NC[C@H]2CC(C)C)C(=N)N1CC12CC3CC(CC(C3)C1)C2 |
InChIKey | CRBHITDMDNQMDY-GVBQWOKBSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 3 |
Rotatable bonds | 12 |
Molecular weight (Da) | 601.5 |
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 |
MC5 | MC5R | Mouse | Melanocortin | A | pEC50 | 6.21 | 6.21 | 6.21 | ChEMBL |
MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 5.16 | 5.16 | 5.16 | ChEMBL |
MC4 | MC4R | Mouse | Melanocortin | A | pEC50 | 5.88 | 5.88 | 5.88 | ChEMBL |