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CHEBI:231671 - A38

Default Structure
ChEBI IDCHEBI:231671
ChEBI NameA38
Stars
DefinitionA38 is a CNS-penetrant small molecule that inhibits EphB3 kinase activity (Iain C. Clark et al., 2021).
Submitterruixy
DownloadsMolfile
FormulaC19H19ClN4O
Net Charge0
Average Mass354.841
Monoisotopic Mass354.12474
SMILESO=C(Nc1ccccc1Cl)c1cnc2ccc(C3CCNCC3)cn12
InChIInChI=1S/C19H19ClN4O/c20-15-3-1-2-4-16(15)23-19(25)17-11-22-18-6-5-14(12-24(17)18)13-7-9-21-10-8-13/h1-6,11-13,21H,7-10H2,(H,23,25)
InChIKeyDGSMEFWSLXFLQA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
A38 (CHEBI:231671) is a organic molecular entity (CHEBI:50860)