CHEMBL484778
SMILES | CC(C)c1nccc2c1c(Sc1ccc(Cl)c(Cl)c1)c1n2CC[C@H]1CC(=O)O |
InChIKey | LUZBJNWFEDHIPR-LBPRGKRZSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 434.1 |
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 |
FP | PF2R | Human | Prostanoid | A | pKi | 4.59 | 4.59 | 4.59 | ChEMBL |
DP1 | PD2R | Human | Prostanoid | A | pKi | 9.19 | 9.19 | 9.19 | ChEMBL |
EP1 | PE2R1 | Human | Prostanoid | A | pKi | 4.54 | 4.54 | 4.54 | ChEMBL |
EP2 | PE2R2 | Human | Prostanoid | A | pKi | 5.13 | 5.13 | 5.13 | ChEMBL |
EP3 | PE2R3 | Human | Prostanoid | A | pKi | 6.15 | 6.15 | 6.15 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pKi | 5.18 | 5.18 | 5.18 | ChEMBL |
DP2 | PD2R2 | Human | Prostanoid | A | pKi | 6.63 | 6.63 | 6.63 | ChEMBL |
TP | TA2R | Human | Prostanoid | A | pKi | 5.3 | 5.3 | 5.3 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
DP1 | PD2R | Human | Prostanoid | A | pIC50 | 8.3 | 8.98 | 9.66 | ChEMBL |