CHEMBL306792


SMILES CSc1cc(F)ccc1NCC1=NCCN1
InChIKey XBBHVMXFPPVGMX-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 239.1

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
α1B ADA1B Human Adrenoceptors A pKi 7.82 7.82 7.82 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 8.3 8.3 8.3 ChEMBL
α2B ADA2B Human Adrenoceptors A pKi 6.07 6.07 6.07 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 6.66 6.66 6.66 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.68 7.68 7.68 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 7.23 7.23 7.23 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α1B ADA1B Human Adrenoceptors A pEC50 8.22 8.22 8.22 ChEMBL
α1D ADA1D Human Adrenoceptors A pEC50 8.04 8.04 8.04 ChEMBL
α2C ADA2C Human Adrenoceptors A pEC50 7.0 7.0 7.0 ChEMBL
α1A ADA1A Human Adrenoceptors A pEC50 8.11 8.11 8.11 ChEMBL
α2A ADA2A Human Adrenoceptors A pEC50 6.5 6.5 6.5 ChEMBL