CHEMBL2037289
SMILES | Cc1ccc2nc(-c3cccc(C[C@H](O)/C=C/[C@H]4CCC(=O)N4CCSc4nc(C(=O)O)cs4)c3)oc2c1 |
InChIKey | JUFYXGLEONTECM-KSFASEQNSA-N |
Chemical properties
Hydrogen bond acceptors | 8 |
Hydrogen bond donors | 2 |
Rotatable bonds | 10 |
Molecular weight (Da) | 549.1 |
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 |
EP1 | PE2R1 | Mouse | Prostanoid | A | pKi | 6.7 | 6.7 | 6.7 | ChEMBL |
EP2 | PE2R2 | Mouse | Prostanoid | A | pKi | 7.25 | 7.25 | 7.25 | ChEMBL |
EP4 | PE2R4 | Mouse | Prostanoid | A | pKi | 9.8 | 9.8 | 9.8 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP2 | PE2R2 | Rat | Prostanoid | A | pEC50 | 5.5 | 5.5 | 5.5 | ChEMBL |
EP4 | PE2R4 | Rat | Prostanoid | A | pEC50 | 8.8 | 8.8 | 8.8 | ChEMBL |