CHEMBL1819622
SMILES | CN1C[C@@H](COc2ccc(C(=O)Nc3cc(CC(=O)O)ccc3Cl)c(Cl)c2)Oc2ccccc21 |
InChIKey | UQHKLJCYYLWRGF-KRWDZBQOSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 2 |
Rotatable bonds | 7 |
Molecular weight (Da) | 500.1 |
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 |
DP1 | PD2R | Mouse | Prostanoid | A | pKi | 7.89 | 7.89 | 7.89 | ChEMBL |
EP1 | PE2R1 | Mouse | Prostanoid | A | pKi | 5.18 | 5.18 | 5.18 | ChEMBL |
EP2 | PE2R2 | Mouse | Prostanoid | A | pKi | 7.36 | 7.36 | 7.36 | ChEMBL |
IP | PI2R | Human | Prostanoid | A | pKi | 5.8 | 5.8 | 5.8 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
DP1 | PD2R | Mouse | Prostanoid | A | pIC50 | 8.37 | 8.37 | 8.37 | ChEMBL |