RS-100329


SMILES O=c1[nH]cc(c(=O)n1CCCN1CCN(CC1)c1ccccc1OCC(F)(F)F)C
InChIKey RCOBWVAGWYRNHZ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 426.2

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
α1A ADA1A Human Adrenoceptors A pKi 9.6 9.6 9.6 Guide to Pharmacology
α1D ADA1D Human Adrenoceptors A pKi 7.6 7.75 7.9 Guide to Pharmacology
α1B ADA1B Human Adrenoceptors A pKi 7.5 7.5 7.5 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.9 7.9 7.9 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 9.6 9.6 9.6 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database