CHEMBL4876953
| SMILES | CC(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccc2ccccc2c1)C(N)=O |
| InChIKey | ZFJFDRSQWHNSSJ-NZKHRDNMSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 9 |
| Rotatable bonds | 18 |
| Molecular weight (Da) | 871.3 |
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 |
| MC3 | MC3R | Mouse | Melanocortin | A | pKd | 6.0 | 6.8 | 7.6 | ChEMBL |
| MC3 | MC3R | Mouse | Melanocortin | A | pKi | 6.0 | 6.8 | 7.6 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |