CHEMBL70751


SMILES CSc1ccc(Cl)cc1NCC1=NCCN1
InChIKey ZHDIISZEXUGDAJ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 255.1

Drug properties

Molecular type Small molecule
Endogenous/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 7.16 7.16 7.16 ChEMBL
α2B ADA2B Human Adrenoceptors A pKi 6.17 6.17 6.17 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 6.77 6.77 6.77 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.73 7.73 7.73 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 8.33 8.33 8.33 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 7.38 7.38 7.38 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α1B ADA1B Human Adrenoceptors A pEC50 9.3 9.3 9.3 ChEMBL
α2C ADA2C Human Adrenoceptors A pEC50 8.55 8.55 8.55 ChEMBL
α1A ADA1A Human Adrenoceptors A pEC50 9.36 9.36 9.36 ChEMBL
α1D ADA1D Human Adrenoceptors A pEC50 8.57 8.57 8.57 ChEMBL
α2A ADA2A Human Adrenoceptors A pEC50 8.2 8.2 8.2 ChEMBL