CHEMBL392316
SMILES | CC(Cc1ccccc1)CN(CCCCCCN)C(=O)c1cc2cc(O)ccc2[nH]1 |
InChIKey | QPEGNJQCCVYSFY-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 3 |
Rotatable bonds | 11 |
Molecular weight (Da) | 407.3 |
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 | Mouse | Melanocortin | A | pKi | 5.54 | 5.54 | 5.54 | ChEMBL |
MC3 | MC3R | Human | Melanocortin | A | pKi | 4.34 | 4.34 | 4.34 | ChEMBL |
MC4 | MC4R | Human | Melanocortin | A | pKi | 5.01 | 5.01 | 5.01 | ChEMBL |
MC5 | MC5R | Human | Melanocortin | A | pKi | 4.51 | 4.51 | 4.51 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |