CHEMBL4746212


SMILES COc1cccc(Nc2c(C(N)=O)ccc3c(C)cc(S(=O)(=O)c4cccc(C(=O)Nc5ccc(C#CCCCNC[C@@H](O)c6ccc(O)c7[nH]c(=O)ccc67)cc5)c4)cc23)c1
InChIKey CESHXWXLOJIPHC-VZUYHUTRSA-N

Chemical properties

Hydrogen bond acceptors 10
Hydrogen bond donors 7
Rotatable bonds 14
Molecular weight (Da) 849.3

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β2 ADRB2 Human Adrenoceptors A pEC50 8.1 8.1 8.1 ChEMBL