CHEMBL362954


SMILES COc1cccc(N(NC2=NCCN2)c2ccc(C)cc2)c1
InChIKey NEQHKSNFFVEGHN-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 296.2

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
α1B ADA1B Human Adrenoceptors A pKi 6.99 6.99 6.99 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.76 7.76 7.76 ChEMBL
α2B ADA2B Human Adrenoceptors A pKi 8.14 8.14 8.14 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.7 7.7 7.7 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 8.2 8.2 8.2 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 8.42 8.42 8.42 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database