(+)-ADTN


SMILES NC1CCc2c(C1)cc(c(c2)O)O
InChIKey ASXGAOFCKGHGMF-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 3
Rotatable bonds 0
Molecular weight (Da) 179.1

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Ligand site mutations D2 D5

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β3 ADRB3 Human Adrenoceptors A pKi 5.2 5.2 5.2 Guide to Pharmacology
β3 ADRB3 Mouse Adrenoceptors A pKi 5.9 5.9 5.9 Guide to Pharmacology
β3 ADRB3 Human Adrenoceptors A pKi 4.7 4.7 4.7 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 4.1 4.1 4.1 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β3 ADRB3 Mouse Adrenoceptors A pEC50 8.7 9.25 9.8 Guide to Pharmacology
β3 ADRB3 Rat Adrenoceptors A pEC50 7.6 8.06 8.52 ChEMBL
β1 ADRB1 Rat Adrenoceptors A pIC50 4.52 4.52 4.52 ChEMBL
β3 ADRB3 Human Adrenoceptors A pEC50 5.94 6.3 6.66 ChEMBL
β2 ADRB2 Rat Adrenoceptors A pIC50 5.01 5.01 5.01 ChEMBL