CHEMBL2036320
SMILES | Cc1ccc(-c2cccc(C[C@H](O)/C=C/[C@H]3CCC(=O)N3CCSc3nc(C(=O)O)cs3)c2)c(C)c1 |
InChIKey | OAAKRDFPYNRCLP-DKARNCPTSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 2 |
Rotatable bonds | 10 |
Molecular weight (Da) | 522.2 |
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 |
EP1 | PE2R1 | Mouse | Prostanoid | A | pKi | 5.62 | 5.62 | 5.62 | ChEMBL |
EP2 | PE2R2 | Mouse | Prostanoid | A | pKi | 7.64 | 7.64 | 7.64 | ChEMBL |
EP4 | PE2R4 | Mouse | Prostanoid | A | pKi | 8.46 | 8.46 | 8.46 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP4 | PE2R4 | Rat | Prostanoid | A | pEC50 | 6.8 | 6.8 | 6.8 | ChEMBL |