CHEMBL3361420
SMILES | COc1cccc(NC2(CNC(=O)CNC(=N)N)CCN(Cc3ccccc3)CC2)c1 |
InChIKey | BODWLLWAGNGKQB-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 5 |
Rotatable bonds | 9 |
Molecular weight (Da) | 424.3 |
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 |
NPFF1 | NPFF1 | Human | Neuropeptide FF/neuropeptide AF | A | pKi | 6.7 | 6.7 | 6.7 | ChEMBL |
NPFF2 | NPFF2 | Human | Neuropeptide FF/neuropeptide AF | A | pKi | 6.05 | 6.05 | 6.05 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |