CHEMBL3616860
SMILES | N[C@@]1(C(=O)O)C[C@H](Sc2c[nH]nn2)[C@H]2[C@H](C(=O)O)[C@H]21 |
InChIKey | RXZDXHKRDHZRKP-JMMKUHNISA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 4 |
Rotatable bonds | 4 |
Molecular weight (Da) | 284.1 |
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 |
mGlu2 | GRM2 | Human | Metabotropic glutamate | C | pKi | 6.96 | 6.96 | 6.96 | ChEMBL |
mGlu3 | GRM3 | Human | Metabotropic glutamate | C | pKi | 7.19 | 7.19 | 7.19 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
mGlu2 | GRM2 | Human | Metabotropic glutamate | C | pEC50 | 7.72 | 8.0 | 8.28 | ChEMBL |
mGlu3 | GRM3 | Human | Metabotropic glutamate | C | pIC50 | 5.55 | 5.55 | 5.55 | ChEMBL |
mGlu3 | GRM3 | Human | Metabotropic glutamate | C | pEC50 | 7.03 | 7.03 | 7.03 | ChEMBL |