CHEMBL3398218
SMILES | COc1ccc(-c2nn(CC3CCc4c(cccc4OCC(=O)O)C3)c(=O)cc2-c2ccccc2)c(F)c1 |
InChIKey | SIPCNNPEUCKFSM-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 514.2 |
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 |
IP | PI2R | Rat | Prostanoid | A | pEC50 | 6.95 | 6.95 | 6.95 | ChEMBL |
DP1 | PD2R | Human | Prostanoid | A | pEC50 | 7.51 | 7.51 | 7.51 | ChEMBL |
IP | PI2R | Human | Prostanoid | A | pEC50 | 7.7 | 7.7 | 7.7 | ChEMBL |