CHEMBL3616858
SMILES | Nc1nnc(S[C@H]2C[C@@](N)(C(=O)O)[C@@H]3[C@@H](C(=O)O)[C@H]23)[nH]1 |
InChIKey | PZICKINIOPPAGP-CWOZVJDESA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 5 |
Rotatable bonds | 4 |
Molecular weight (Da) | 299.1 |
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 |
mGlu3 | GRM3 | Human | Metabotropic glutamate | C | pKi | 7.16 | 7.16 | 7.16 | ChEMBL |
mGlu2 | GRM2 | Human | Metabotropic glutamate | C | pKi | 7.56 | 7.56 | 7.56 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
mGlu3 | GRM3 | Human | Metabotropic glutamate | C | pIC50 | 5.41 | 5.41 | 5.41 | ChEMBL |
mGlu3 | GRM3 | Human | Metabotropic glutamate | C | pEC50 | 6.95 | 6.95 | 6.95 | ChEMBL |
mGlu2 | GRM2 | Human | Metabotropic glutamate | C | pEC50 | 7.7 | 7.95 | 8.19 | ChEMBL |