CHEMBL3597523
SMILES | O=C(O)CCCc1cn(CC(=O)O)c2c(/C=C/c3ccc(OCCCCc4ccccc4)cc3)cccc12 |
InChIKey | JITXEOCUBFNDSU-OBGWFSINSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 14 |
Molecular weight (Da) | 511.2 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
CysLT2 | CLTR2 | Human | Leukotriene | A | pIC50 | 7.6 | 7.6 | 7.6 | ChEMBL |
CysLT1 | CLTR1 | Human | Leukotriene | A | pIC50 | 8.47 | 8.47 | 8.47 | ChEMBL |