CHEMBL392771


SMILES COc1cc2c(cc1OC)CN(Cc1ccc(OC)c3oc(-c4cccc(C(=O)NCCN(C)C)c4)cc13)CC2
InChIKey MGJOAQODMQCCGV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 10
Molecular weight (Da) 543.3

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 6.23 6.23 6.23 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 8.03 8.03 8.03 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 6.67 6.67 6.67 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 6.67 6.67 6.67 PDSP Ki database
α2B ADA2B Human Adrenoceptors A pKi 6.23 6.23 6.23 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