CHEMBL2113028
SMILES | CC(C)(C)NC(=O)C1(C2CCCCC2)CCN(C(=O)[C@@H](Cc2ccc(F)cc2)NC(=O)[C@@H]2CNCCN2C(=O)OC(C)(C)C)CC1 |
InChIKey | AUJXVLHOWUBHBM-IZLXSDGUSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 3 |
Rotatable bonds | 7 |
Molecular weight (Da) | 643.4 |
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 | Human | Melanocortin | A | pEC50 | 5.75 | 5.75 | 5.75 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pEC50 | 7.89 | 7.89 | 7.89 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pIC50 | 7.75 | 7.75 | 7.75 | ChEMBL |