Ro-70-0004


SMILES Fc1ccc(c(c1)OCC(F)(F)F)N1CCN(CC1)CCCn1c(=O)[nH]cc(c1=O)C
InChIKey WEZFJPKJUIGDPS-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 444.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α1A ADA1A Human Adrenoceptors A pKi 8.9 8.9 8.9 Guide to Pharmacology
α1B ADA1B Human Adrenoceptors A pKi 7.1 7.1 7.1 Guide to Pharmacology
α1D ADA1D Human Adrenoceptors A pKi 7.2 7.2 7.2 Guide to Pharmacology
α1B ADA1B Human Adrenoceptors A pKi 7.1 7.1 7.1 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.0 7.1 7.2 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 8.89 8.93 9.0 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database