CHEMBL1819612
SMILES | Cc1cc(CC(=O)O)cc(NC(=O)c2ccc(OC[C@@H]3CN(C)c4ccccc4O3)cc2C)c1 |
InChIKey | LYNRZWODOXOKCD-QFIPXVFZSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 2 |
Rotatable bonds | 7 |
Molecular weight (Da) | 460.2 |
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 |
DP1 | PD2R | Mouse | Prostanoid | A | pKi | 8.08 | 8.08 | 8.08 | ChEMBL |
EP2 | PE2R2 | Mouse | Prostanoid | A | pKi | 7.21 | 7.21 | 7.21 | ChEMBL |
EP4 | PE2R4 | Mouse | Prostanoid | A | pKi | 6.17 | 6.17 | 6.17 | ChEMBL |
IP | PI2R | Human | Prostanoid | A | pKi | 5.46 | 5.46 | 5.46 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
DP1 | PD2R | Mouse | Prostanoid | A | pIC50 | 8.47 | 8.47 | 8.47 | ChEMBL |