aspirin triggered lipoxin A4
SMILES | CCCCC[C@H](/C=C/C=C\C=C\C=C\[C@H]([C@H](CCCC(=O)O)O)O)O |
InChIKey | IXAQOQZEOGMIQS-JEWNPAEBSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 4 |
Rotatable bonds | 14 |
Molecular weight (Da) | 352.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Endogenous |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
A2B | AA2BR | Human | Adenosine | A | pKd | 7.5 | 7.5 | 7.5 | ChEMBL |
A2B | AA2BR | Human | Adenosine | A | pKi | 7.2 | 7.2 | 7.2 | ChEMBL |
A3 | AA3R | Human | Adenosine | A | pKi | 6.0 | 6.0 | 6.0 | ChEMBL |
A3 | AA3R | Human | Adenosine | A | pKd | 5.8 | 5.8 | 5.8 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 8.89 | 8.94 | 9.1 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKd | 9.2 | 9.2 | 9.2 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKd | 7.0 | 7.0 | 7.0 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 7.17 | 7.17 | 7.17 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 7.17 | 7.17 | 7.17 | Guide to Pharmacology |
A2A | AA2AR | Human | Adenosine | A | pKi | 8.89 | 8.89 | 8.89 | Guide to Pharmacology |
A2B | AA2BR | Human | Adenosine | A | pKi | 7.2 | 7.2 | 7.2 | Guide to Pharmacology |
A3 | AA3R | Human | Adenosine | A | pKi | 6.0 | 6.0 | 6.0 | Guide to Pharmacology |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |