RX18


SMILES CN(C(CCCC(=O)NC=1C=CC2=C(C1)C=3NC(N(C(C3S2)=O)CCN4CCN(CC4)C5=C(C=CC=C5)OC)=O)=O)CC6=CC=CC=C6
InChIKey RUSICYIVUADRSX-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 2
Rotatable bonds 12
Molecular weight (Da) 668.3

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
α1D ADA1D Human Adrenoceptors A pKi 10.25 10.25 10.25 Guide to Pharmacology
α1A ADA1A Human Adrenoceptors A pKi 9.03 9.03 9.03 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 8.72 8.72 8.72 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 10.25 10.25 10.25 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α1D G3V8W0 Rat Adrenoceptors A pEC50 9.15 9.15 9.15 Guide to Pharmacology