CHEMBL256853


SMILES COc1ccc(NC(=O)NC2CCC(N3CCN(c4ccccc4OC(C)C)CC3)CC2)c(OC)c1
InChIKey HZACYYQCKLSFDB-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 8
Molecular weight (Da) 496.3

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 6.32 6.5 6.67 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 6.96 7.04 7.13 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.04 7.37 7.7 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.05 6.29 6.54 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 6.32 6.5 6.67 PDSP Ki database
α1D ADA1D Human Adrenoceptors A pKi 6.96 7.21 7.7 PDSP Ki database
D2 DRD2 Human Dopamine A pKi 6.05 6.29 6.54 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database