omidenepag
SMILES | OC(=O)CNc1cccc(n1)CN(S(=O)(=O)c1cccnc1)Cc1ccc(cc1)n1cccn1 |
InChIKey | YHGSTSNEOJUIRN-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 8 |
Hydrogen bond donors | 2 |
Rotatable bonds | 10 |
Molecular weight (Da) | 478.1 |
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 |
EP2 | PE2R2 | Human | Prostanoid | A | pKi | 8.44 | 8.44 | 8.44 | Guide to Pharmacology |
EP2 | PE2R2 | Human | Prostanoid | A | pKi | 8.44 | 8.44 | 8.44 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP2 | PE2R2 | Human | Prostanoid | A | pEC50 | 8.96 | 8.96 | 8.96 | ChEMBL |
EP2 | PE2R2 | Human | Prostanoid | A | pIC50 | 8.0 | 8.0 | 8.0 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pIC50 | 5.26 | 5.26 | 5.26 | ChEMBL |