EMDT
SMILES | CCc1[nH]c2c(c1CCN(C)C)cc(cc2)OC |
InChIKey | ZEYRDXUWJDGTLD-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 246.2 |
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 |
GPR31 | GPR31 | Mouse | A orphans | A | pKd | 8.31 | 8.31 | 8.31 | Guide to Pharmacology |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
BLT2 | LT4R2 | Human | Leukotriene | A | pEC50 | 7.52 | 7.52 | 7.52 | Guide to Pharmacology |
GPR31 | GPR31 | Mouse | A orphans | A | pEC50 | 9.55 | 9.55 | 9.55 | Guide to Pharmacology |
OXE | OXER1 | Human | Leukotriene | A | pIC50 | 6.3 | 6.3 | 6.3 | ChEMBL |