EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:758136 - simufilam

Default Structure
ChEBI IDCHEBI:758136
ChEBI Namesimufilam
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC15H21N3O
Net Charge0
Average Mass259.353
Monoisotopic Mass259.16846
SMILESCN1CCC2(CC1)NCC(=O)N2Cc1ccccc1
InChIInChI=1S/C15H21N3O/c1-17-9-7-15(8-10-17)16-11-14(19)18(15)12-13-5-3-2-4-6-13/h2-6,16H,7-12H2,1H3
InChIKeyBSQPTZYKCAULBH-UHFFFAOYSA-N
Roles Classification
Applications:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
anti-inflammatory agent  Any compound that has anti-inflammatory effects.
ChEBI Ontology
Outgoing Relation(s)
simufilam (CHEBI:758136) has role anti-inflammatory agent (CHEBI:67079)
simufilam (CHEBI:758136) has role antineoplastic agent (CHEBI:35610)
simufilam (CHEBI:758136) is a azaspiro compound (CHEBI:35624)
INN  Source
simufilamWHO MedNet
Synonyms  Source
C-0105ChEMBL
C0105ChEMBL
C0105MChEMBL
PTI-125ChEMBL
PTI-910ChEMBL
Brand Name  Source
FiloraChEMBL