RS79948


SMILES CCS(=O)(=O)N1CCC[C@H]2[C@@H]1C[C@H]3C4=C(CCN3C2)C=C(C=C4)OC
InChIKey UMGBFFAJXFXOIL-MNEFBYGVSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 3
Molecular weight (Da) 364.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Structure pdb 6KUX

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α2A ADA2A Human Adrenoceptors A pKi 8.9 8.9 8.9 Guide to Pharmacology
α2B ADA2B Human Adrenoceptors A pKi 8.6 8.6 8.6 Guide to Pharmacology
α2C ADA2C Human Adrenoceptors A pKi 9.4 9.4 9.4 Guide to Pharmacology
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database