UCM 765
SMILES | COc1ccc(cc1)N(c1ccccc1)CCNC(=O)C |
InChIKey | PWTCGLHUMIIRML-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 6 |
Molecular weight (Da) | 284.2 |
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 |
MT2 | MTR1B | Human | Melatonin | A | pKi | 10.2 | 10.2 | 10.2 | Guide to Pharmacology |
MT2 | MTR1B | Human | Melatonin | A | pKi | 7.56 | 7.56 | 7.56 | ChEMBL |
MT1 | MTR1A | Human | Melatonin | A | pKi | 6.11 | 6.11 | 6.11 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |