CHEMBL3718007
SMILES | COc1cc(OCc2csc(N3CCC[C@H]3C)n2)c2cc(-c3cn4nc(C)ccc4n3)oc2c1 |
InChIKey | PTAHPJGEVGAFSS-MRXNPFEDSA-N |
Chemical properties
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 0 |
Rotatable bonds | 6 |
Molecular weight (Da) | 475.2 |
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 |
PAR4 | PAR4 | Human | Proteinase-activated | A | pEC50 | 8.38 | 8.38 | 8.38 | ChEMBL |
PAR4 | PAR4 | Human | Proteinase-activated | A | pIC50 | 5.58 | 5.58 | 5.58 | ChEMBL |