CHEMBL1916686
SMILES | COc1ccc(CC(=O)O)cc1-c1ccc(C(F)(F)F)cc1CN1C(=O)O[C@H](c2ccccc2)[C@@H]1C |
InChIKey | ICMOGANJAUQPKT-LMKMVOKYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 7 |
Molecular weight (Da) | 499.2 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
DP1 | PD2R | Human | Prostanoid | A | pIC50 | 4.5 | 4.5 | 4.5 | ChEMBL |
TP | TA2R | Human | Prostanoid | A | pIC50 | 4.2 | 4.2 | 4.2 | ChEMBL |
DP2 | PD2R2 | Human | Prostanoid | A | pIC50 | 5.35 | 6.05 | 6.75 | ChEMBL |