CHEMBL1306030
SMILES | Cc1[nH]c2c(Br)cccc2c1[C@H]1[C@@H](CC#N)C1(C)C |
InChIKey | XBXMATSTHLYKNO-BXUZGUMPSA-N |
Chemical properties
Hydrogen bond acceptors | 1 |
Hydrogen bond donors | 1 |
Rotatable bonds | 2 |
Molecular weight (Da) | 316.1 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
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 |
GPR55 | GPR55 | Human | GPR18, GPR55 and GPR119 | A | pIC50 | 5.83 | 5.83 | 5.83 | ChEMBL |
NPS | NPSR1 | Human | Neuropeptide S | A | Potency | 8.1 | 8.1 | 8.1 | ChEMBL |