CHEMBL140324
SMILES | CC(=O)N(CCc1c[nH]cn1)CC(=O)N(CC(=O)N(CCCCN)CC(=O)N(CCc1c[nH]c2ccccc12)CC(N)=O)Cc1ccccc1 |
InChIKey | YYBOUVZNKIGKBH-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 4 |
Rotatable bonds | 20 |
Molecular weight (Da) | 685.4 |
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 | 5.13 | 5.13 | 5.13 | ChEMBL |
MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 4.57 | 4.57 | 4.57 | ChEMBL |
MC4 | MC4R | Mouse | Melanocortin | A | pEC50 | 4.57 | 4.57 | 4.57 | ChEMBL |