Tetrahydroalstonine


SMILES CC1C2CN3CCC4=C(C3CC2C(=CO1)C(=O)OC)NC5=CC=CC=C45
InChIKey GRTOGORTSDXSFK-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 1
Molecular weight (Da) 352.2

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
α2A ADA2A Human Adrenoceptors A pKi 6.89 7.95 9.18 PDSP Ki database
α2C ADA2C Human Adrenoceptors A pKi 7.92 8.69 9.52 PDSP Ki database
α2B ADA2B Human Adrenoceptors A pKi 7.84 7.84 7.84 PDSP Ki database
α2B ADA2B Rat Adrenoceptors A pKi 6.68 7.59 8.82 PDSP Ki database
α2A ADA2A Pig Adrenoceptors A pKi 6.85 7.42 8.0 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database