CHEMBL1788222


SMILES COc1ccccc1N1CCN(C[C@H]2CN=C3c4ccccc4NC(=O)N32)CC1
InChIKey FUCGAUZSWYLMRK-MRXNPFEDSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 391.2

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 Rat Adrenoceptors A pKi 9.38 9.38 9.38 ChEMBL
α2B ADA2B Human Adrenoceptors A pKi 6.94 6.94 6.94 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKi 9.64 9.64 9.64 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 6.35 6.35 6.35 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database