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CHEBI:747459 - Compound-21

Default Structure
ChEBI IDCHEBI:747459
ChEBI NameCompound-21
Stars
DefinitionDREADD agonist 21 dihydrochloride is a potent human muscarinic acetylcholine M3 receptors (hM3Dq) agonist (EC50=1.7 nM).
Last Modified19 March 2026
Submittercyan
DownloadsMolfile
FormulaHCl.HCl.C17H18N4
Net Charge0
Average Mass351.281
Monoisotopic Mass350.10650
SMILES[H]Cl.[H]Cl.c1ccc2c(c1)N=C(N1CCNCC1)c1ccccc1N2
InChIInChI=1S/C17H18N4.2ClH/c1-2-6-14-13(5-1)17(21-11-9-18-10-12-21)20-16-8-4-3-7-15(16)19-14;;/h1-8,18-19H,9-12H2;2*1H
InChIKeySETCOPAXYQJWKI-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Compound-21 (CHEBI:747459) is a organic molecular entity (CHEBI:50860)
Registry NumbersSources
CAS:2250025-92-2CAS