olodanrigan


SMILES COc1ccc2c(c1OCc1ccccc1)C[C@H](N(C2)C(=O)C(c1ccccc1)c1ccccc1)C(=O)O
InChIKey GHBCIXGRCZIPNQ-MHZLTWQESA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight (Da) 507.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug Yes

Database connections

Structure pdb 7JNI

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
AT2 AGTR2 Human Angiotensin A pKd 7.4 7.4 7.4 Guide to Pharmacology
AT2 AGTR2 Human Angiotensin A pKi 7.4 7.4 7.4 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
AT2 AGTR2 Human Angiotensin A pIC50 8.5 8.9 9.3 Guide to Pharmacology
AT2 AGTR2 Rat Angiotensin A pIC50 7.53 7.53 7.53 Guide to Pharmacology
AT2 AGTR2 Rat Angiotensin A pIC50 7.12 7.12 7.12 ChEMBL
AT2 AGTR2 Human Angiotensin A pIC50 8.62 9.08 9.24 ChEMBL
AT1 AGTR1 Human Angiotensin A pIC50 5.96 6.69 7.41 ChEMBL