CHEMBL1688108
SMILES | CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CSCC(=O)N([C@@H](Cc2c[nH]c3ccccc23)C(N)=O)C[C@H](CCCNC(=N)N)NC1=O |
InChIKey | DPRUDGOHUWTPRM-KELWCDABSA-N |
Chemical properties
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 10 |
Rotatable bonds | 17 |
Molecular weight (Da) | 814.4 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MC3 | MC3R | Mouse | Melanocortin | A | pEC50 | 5.12 | 5.12 | 5.12 | ChEMBL |
MC4 | MC4R | Mouse | Melanocortin | A | pEC50 | 6.19 | 6.19 | 6.19 | ChEMBL |
MC1 | MSHR | Mouse | Melanocortin | A | pEC50 | 6.79 | 6.79 | 6.79 | ChEMBL |
MC5 | MC5R | Mouse | Melanocortin | A | pEC50 | 6.47 | 6.47 | 6.47 | ChEMBL |