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 |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
apelin | APJ | Human | Apelin | A | pKd | 9.2 | 9.2 | 9.2 | Guide to Pharmacology |
apelin | APJ | Human | Apelin | A | pKi | 9.15 | 9.15 | 9.15 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
apelin | APJ | Human | Apelin | A | pIC50 | 8.8 | 9.15 | 9.5 | Guide to Pharmacology |
apelin | APJ | Human | Apelin | A | pEC50 | 7.37 | 8.62 | 10.3 | ChEMBL |