CHEMBL2113280
| SMILES | NC(N)=NCCC[C@H](N)C(=O)N(Cc1cccc2ccccc12)Cc1c[nH]c2ccccc12 |
| InChIKey | BJCYJTZOIYTVTC-QHCPKHFHSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 4 |
| Rotatable bonds | 9 |
| Molecular weight (Da) | 442.2 |
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 |
| MC1 | MSHR | Human | Melanocortin | A | pKi | 4.96 | 4.96 | 4.96 | ChEMBL |
| MC5 | MC5R | Human | Melanocortin | A | pKi | 4.92 | 4.92 | 4.92 | ChEMBL |
| MC3 | MC3R | Human | Melanocortin | A | pKi | 4.28 | 4.28 | 4.28 | ChEMBL |
| MC4 | MC4R | Human | Melanocortin | A | pKi | 4.16 | 4.16 | 4.16 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |