CHEMBL1761872
SMILES | C[C@H]1CN(C(=O)N[C@H](Cc2ccc(F)cc2)C(=O)N2CCC(C(=O)NC(C)(C)C)(C3CCCCC3)CC2)C[C@@H](C)N1C |
InChIKey | JMZSDACYKDRROH-FMGHJNRGSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 6 |
Molecular weight (Da) | 585.4 |
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 |
MC1 | MSHR | Human | Melanocortin | A | pEC50 | 6.04 | 6.04 | 6.04 | ChEMBL |
MC1 | MSHR | Human | Melanocortin | A | pIC50 | 5.11 | 5.11 | 5.11 | ChEMBL |
MC5 | MC5R | Human | Melanocortin | A | pIC50 | 5.85 | 5.85 | 5.85 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pIC50 | 6.12 | 6.12 | 6.12 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pEC50 | 7.22 | 7.22 | 7.22 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pIC50 | 7.8 | 7.8 | 7.8 | ChEMBL |