CHEMBL404199
SMILES | COc1cccc(OC)c1C1(C(=O)NS(=O)(=O)Cc2ccc(N3Cc4c(c(OCC(F)(F)F)c5cccnc5c4OCC(F)(F)F)C3=O)c(C)c2)CC1 |
InChIKey | FJMQKJOWJVMHPQ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 1 |
Rotatable bonds | 12 |
Molecular weight (Da) | 767.2 |
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 | 6.47 | 6.47 | 6.47 | ChEMBL |
IP | PI2R | Human | Prostanoid | A | pKi | 5.7 | 5.7 | 5.7 | ChEMBL |
DP1 | PD2R | Human | Prostanoid | A | pKi | 7.28 | 7.28 | 7.28 | ChEMBL |
EP2 | PE2R2 | Human | Prostanoid | A | pKi | 6.52 | 6.52 | 6.52 | ChEMBL |
EP3 | PE2R3 | Human | Prostanoid | A | pKi | 5.57 | 5.57 | 5.57 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pKi | 8.8 | 8.95 | 9.1 | ChEMBL |
TP | TA2R | Human | Prostanoid | A | pKi | 7.41 | 7.41 | 7.41 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |