CHEMBL122757


SMILES Oc1cc2c(cc1O)C(Cc1cc(I)cc(I)c1)NCC2
InChIKey PDQNCKWPRIQWGX-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 3
Rotatable bonds 2
Molecular weight (Da) 506.9

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
TP TA2R Human Prostanoid A pKi 6.75 6.75 6.75 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 9.52 9.52 9.52 ChEMBL
β1 ADRB1 Human Adrenoceptors A pKi 6.74 6.74 6.74 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database