CHEMBL313700
SMILES | O=C(NS(=O)(=O)CCc1ccccc1-c1ccc(CSCCc2ccccc2)cc1)c1cccs1 |
InChIKey | YHFDLIAMXJUKHP-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 11 |
Molecular weight (Da) | 521.1 |
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 | Human | Prostanoid | A | pKi | 5.55 | 5.55 | 5.55 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pKi | 6.16 | 6.16 | 6.16 | ChEMBL |
EP2 | PE2R2 | Human | Prostanoid | A | pKi | 5.6 | 5.6 | 5.6 | ChEMBL |
EP3 | PE2R3 | Human | Prostanoid | A | pKi | 6.32 | 6.32 | 6.32 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |