(R)-PIA
SMILES | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N[C@@H](Cc1ccccc1)C |
InChIKey | RIRGCFBBHQEQQH-SSFGXONLSA-N |
Chemical properties
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 4 |
Rotatable bonds | 6 |
Molecular weight (Da) | 385.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Ligand site mutations | A2A |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
AT1 | AGTR1 | Human | Angiotensin | A | pKi | 8.8 | 8.8 | 8.8 | Guide to Pharmacology |
AT2 | AGTR2 | Human | Angiotensin | A | pKi | 8.64 | 8.64 | 8.64 | Guide to Pharmacology |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
AT1 | AGTR1 | Human | Angiotensin | A | pEC50 | 8.17 | 8.17 | 8.17 | Guide to Pharmacology |
AT2 | AGTR2 | Human | Angiotensin | A | pIC50 | 9.92 | 9.92 | 9.92 | Guide to Pharmacology |
AT1 | AGTRB | Rat | Angiotensin | A | pIC50 | 9.54 | 9.54 | 9.54 | Guide to Pharmacology |