CHEMBL382197
SMILES | O=C(O)c1ccc(CCCN2C(=O)CC[C@@H]2CCC(O)Cc2cccc(-c3ccccc3)c2)s1 |
InChIKey | BCBYBNIDJGIOQL-UXMRNZNESA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 11 |
Molecular weight (Da) | 477.2 |
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 |
EP2 | PE2R2 | Rat | Prostanoid | A | pIC50 | 6.87 | 6.87 | 6.87 | ChEMBL |
EP4 | PE2R4 | Rat | Prostanoid | A | pIC50 | 7.3 | 7.3 | 7.3 | ChEMBL |
EP4 | PE2R4 | Rat | Prostanoid | A | pEC50 | 6.69 | 6.69 | 6.69 | ChEMBL |
EP1 | PE2R1 | Human | Prostanoid | A | pIC50 | 4.73 | 4.73 | 4.73 | ChEMBL |
EP3 | PE2R3 | Human | Prostanoid | A | pIC50 | 4.7 | 4.7 | 4.7 | ChEMBL |