CHEMBL184275
SMILES | O=C(NCCc1ccc(Cl)cc1Cl)c1ccc(N/C(=N/C2CCCCC2)N2CCNCC2)cc1 |
InChIKey | YEXGHTGVNJDCFJ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 3 |
Rotatable bonds | 6 |
Molecular weight (Da) | 501.2 |
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 |
MC1 | MSHR | Human | Melanocortin | A | pKi | 6.4 | 6.4 | 6.4 | ChEMBL |
MC5 | MC5R | Human | Melanocortin | A | pKi | 7.75 | 7.75 | 7.75 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pKi | 5.66 | 5.66 | 5.66 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pKi | 6.19 | 6.19 | 6.19 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
MC5 | MC5R | Human | Melanocortin | A | pIC50 | 6.34 | 6.34 | 6.34 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pEC50 | 5.72 | 5.72 | 5.72 | ChEMBL |