CHEMBL246228


SMILES COc1cc2c(cc1OC)CN(Cc1cnc(N)n3nc(-c4ccco4)nc13)CC2
InChIKey HXHKXXRIQOWOHI-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 406.2

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
α2B ADA2B Human Adrenoceptors A pKi 6.43 6.43 6.43 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 7.72 7.72 7.72 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 6.4 6.4 6.4 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 6.4 6.4 6.4 PDSP Ki database
α2B ADA2B Human Adrenoceptors A pKi 6.43 6.43 6.43 PDSP Ki database
α2C ADA2C Human Adrenoceptors A pKi 7.72 7.72 7.72 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database