CHEMBL3908484
SMILES | CC(C)(C)c1ccc(N2C(=O)CC[C@@H]2COCc2ccc(C(=O)O)s2)cc1 |
InChIKey | BKVIUNNZVOCFGC-MRXNPFEDSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 6 |
Molecular weight (Da) | 387.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP2 | PE2R2 | Human | Prostanoid | A | pKi | 6.3 | 6.72 | 7.57 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
DP1 | PD2R | Human | Prostanoid | A | pEC50 | 5.63 | 5.63 | 5.63 | ChEMBL |
EP2 | PE2R2 | Human | Prostanoid | A | pEC50 | 5.87 | 6.78 | 7.57 | ChEMBL |
EP3 | PE2R3 | Human | Prostanoid | A | pEC50 | 4.72 | 4.72 | 4.72 | ChEMBL |