CHEMBL4125846


SMILES COc1cc2nc(N3CCN(C(=O)Cc4ccc5ccccc5c4)[C@H]4CCCC[C@H]43)nc(N)c2cc1OC
InChIKey CMYABLZXUMAVKE-LOSJGSFVSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 511.3

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
α1D ADA1D Rat Adrenoceptors A pKd 6.87 6.87 6.87 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 8.93 8.93 8.93 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.77 7.77 7.77 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 8.65 8.65 8.65 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database