CHEMBL1979954
SMILES | NC(=S)N/N=C/c1ncc(C(F)(F)F)cc1Cl |
InChIKey | WSXXMOKRJVTMCX-CRKCGEKBSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 2 |
Molecular weight (Da) | 282.0 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
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 |
κ | OPRK | Human | Opioid | A | pIC50 | 4.65 | 4.65 | 4.65 | ChEMBL |
NPS | NPSR1 | Human | Neuropeptide S | A | Potency | 5.7 | 5.7 | 5.7 | ChEMBL |