EMD-386088
SMILES | Clc1ccc2c(c1)c(C1=CCNCC1)c([nH]2)C |
InChIKey | BPPGPYJBCVXILI-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 1 |
Hydrogen bond donors | 2 |
Rotatable bonds | 1 |
Molecular weight (Da) | 246.1 |
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 |
EP4 | PE2R4 | Mouse | Prostanoid | A | pKi | 6.77 | 6.77 | 6.77 | ChEMBL |
EP3 | PE2R3 | Mouse | Prostanoid | A | pKi | 9.43 | 9.43 | 9.43 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP3 | PE2R3 | Mouse | Prostanoid | A | pIC50 | 8.18 | 8.18 | 8.18 | ChEMBL |