CHEMBL428407


SMILES COc1cc2c(cc1OC)CN(Cc1ccc(OC)c3oc(C(=O)NCCN(C)C)cc13)CC2
InChIKey IWHCCXKZMXALTR-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 467.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α2B ADA2B Human Adrenoceptors A pKi 5.68 5.68 5.68 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 8.03 8.03 8.03 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 6.34 6.34 6.34 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 6.34 6.34 6.34 PDSP Ki database
α2B ADA2B Human Adrenoceptors A pKi 5.68 5.68 5.68 PDSP Ki database
α2C ADA2C Human Adrenoceptors A pKi 8.03 8.03 8.03 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database