CHEMBL72147


SMILES Cc1cnc2c(Br)c(NC3=NCCN3)ccc2n1
InChIKey ICROYPJYNVAMQF-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 1
Molecular weight (Da) 305.0

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
α1D ADA1D Human Adrenoceptors A pKi 5.3 5.3 5.3 ChEMBL
α2B ADA2B Human Adrenoceptors A pKi 6.49 6.49 6.49 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 6.19 6.19 6.19 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 7.13 7.13 7.13 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α2C ADA2C Human Adrenoceptors A pEC50 6.08 6.08 6.08 ChEMBL
α2A ADA2A Human Adrenoceptors A pEC50 6.07 6.07 6.07 ChEMBL