CHEMBL341665


SMILES COc1cc2nc(N(C)CCCCCCN(C)C(=O)c3cccc(CN(C)C)c3)nc(N)c2cc1OC
InChIKey JSMDVVKGKQQXSH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 13
Molecular weight (Da) 508.3

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 Rat Adrenoceptors A pKd 7.43 7.43 7.43 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 9.78 9.78 9.78 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKd 7.26 7.26 7.26 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 9.49 9.49 9.49 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 9.61 9.61 9.61 ChEMBL
D2 DRD2 Rat Dopamine A pKi 5.71 5.71 5.71 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 6.13 6.13 6.13 ChEMBL
α1D ADA1D Rat Adrenoceptors A pKd 8.26 8.26 8.26 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database