QAV680
SMILES | OC(=O)Cc1c(C)n(c2c1cccn2)Cc1ccc(cc1)S(=O)(=O)C |
InChIKey | YOPFAMROKXHVCQ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 358.1 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | Yes |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
DP2 | PD2R2 | Human | Prostanoid | A | pKd | 7.82 | 7.82 | 7.82 | Guide to Pharmacology |
DP2 | PD2R2 | Mouse | Prostanoid | A | pKi | 8.0 | 8.0 | 8.0 | ChEMBL |
DP2 | PD2R2 | Human | Prostanoid | A | pKi | 7.44 | 7.47 | 7.54 | ChEMBL |
DP2 | PD2R2 | Human | Prostanoid | A | pKd | 7.82 | 7.82 | 7.82 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
DP2 | PD2R2 | Mouse | Prostanoid | A | pIC50 | 7.03 | 7.03 | 7.03 | ChEMBL |
DP2 | PD2R2 | Human | Prostanoid | A | pIC50 | 6.99 | 7.82 | 8.52 | ChEMBL |