CHEMBL314960


SMILES CO/C(O)=C1\C(C)=NC(C)=C(C(=O)NCCCN2CCC(c3ccccc3)(c3ccccc3)CC2)C1c1ccc(Cl)cc1
InChIKey WFSGQIXIGIQILN-LVYIWIAJSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 9
Molecular weight (Da) 597.3

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 6.91 6.91 6.91 ChEMBL
α2B ADA2B Human Adrenoceptors A pKi 5.64 5.64 5.64 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 6.0 6.0 6.0 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 8.75 8.75 8.75 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 6.35 6.35 6.35 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 5.67 5.67 5.67 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database