CHEMBL3298691


SMILES NCCOCCOc1ccc(Nc2ccc(CCNC[C@H](O)c3ccc(O)c4[nH]c(=O)ccc34)cc2)cc1
InChIKey ZVWLZBKDMMRTNF-MHZLTWQESA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 6
Rotatable bonds 14
Molecular weight (Da) 518.3

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
β2 ADRB2 Human Adrenoceptors A pKi 8.2 8.2 8.2 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β1 ADRB1 Human Adrenoceptors A pEC50 8.1 8.1 8.1 ChEMBL
β3 ADRB3 Human Adrenoceptors A pEC50 7.4 7.4 7.4 ChEMBL
β2 ADRB2 Human Adrenoceptors A pEC50 9.2 9.5 9.8 ChEMBL