CHEMBL3343984


SMILES COc1cccc2c(NCCCCCCCNc3ccnc4c(OC)cccc34)ccnc12
InChIKey XGRRECSBDVKHCC-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 12
Molecular weight (Da) 444.3

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α1B ADA1B Human Adrenoceptors A pKi 6.81 6.81 6.81 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 6.12 6.12 6.12 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.13 7.13 7.13 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 6.22 6.22 6.22 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database