visnagin
SMILES | COc1c2c(=O)cc(oc2cc2c1cco2)C |
InChIKey | NZVQLVGOZRELTG-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 0 |
Rotatable bonds | 1 |
Molecular weight (Da) | 230.1 |
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 |
A2A | AA2AR | Human | Adenosine | A | pKi | 4.4 | 4.4 | 4.4 | Guide to Pharmacology |
A3 | AA3R | Human | Adenosine | A | pKi | 4.2 | 4.2 | 4.2 | Guide to Pharmacology |
A3 | AA3R | Human | Adenosine | A | pKi | 4.22 | 4.22 | 4.22 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |