MILVETEROL


SMILES O=CNc1cc([C@@H](O)CNCCc2ccc(NC[C@H](O)c3ccccc3)cc2)ccc1O
InChIKey BMKINZUHKYLSKI-DQEYMECFSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 6
Rotatable bonds 12
Molecular weight (Da) 435.2

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
β1 ADRB1 Human Adrenoceptors A pKi 5.0 5.0 5.0 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 8.5 8.5 8.5 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β2 ADRB2 Guinea pig Adrenoceptors A pEC50 10.3 10.3 10.3 ChEMBL
β1 ADRB1 Human Adrenoceptors A pEC50 7.6 7.6 7.6 ChEMBL
β3 ADRB3 Human Adrenoceptors A pEC50 7.4 7.4 7.4 ChEMBL
β2 ADRB2 Human Adrenoceptors A pEC50 9.3 9.84 10.2 ChEMBL