CHEMBL305928


SMILES C1CCCC(NC2=NCCO2)CC1
InChIKey DAIRUBYTBODIKT-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 1
Molecular weight (Da) 182.1

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 8.01 8.01 8.01 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 5.42 5.56 5.7 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 8.27 8.27 8.27 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 7.48 7.48 7.48 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α2B ADA2B Human Adrenoceptors A pEC50 6.67 6.67 6.67 ChEMBL
α2A ADA2A Human Adrenoceptors A pEC50 7.42 7.42 7.42 ChEMBL
α2C ADA2C Human Adrenoceptors A pEC50 7.11 7.11 7.11 ChEMBL