CHEMBL1089461
SMILES | C[C@H]1CN(C(=O)[C@H]2CN(c3cccnn3)C[C@@H]2c2ccc(F)cc2F)C[C@@H](C)[C@]1(O)c1ccccn1 |
InChIKey | VAGCPIHLOMMMDJ-SYRFRKFLSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 493.2 |
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 |
MC4 | MC4R | Human | Melanocortin | A | pKi | 7.28 | 7.28 | 7.28 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MC4 | MC4R | Human | Melanocortin | A | pEC50 | 8.15 | 8.15 | 8.15 | ChEMBL |
MC1 | MSHR | Human | Melanocortin | A | pEC50 | 5.73 | 5.73 | 5.73 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pEC50 | 5.44 | 5.44 | 5.44 | ChEMBL |