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7JW

Summary
Name:7-(4-fluorophenyl)quinoxalin-5-ol
Formula:C14 H9 F N2 O
Formal charge:0
Formula weight:240.232 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.67-(4-fluorophenyl)quinoxalin-5-ol

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C14H9FN2O/c15-11-3-1-9(2-4-11)10-7-12-14(13(18)8-10)17-6-5-16-12/h1-8,18H
InChIKeyInChI1.03YJDUBGAXILBNCU-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1cc(cc2nccnc12)c3ccc(F)cc3
SMILESCACTVS3.385Oc1cc(cc2nccnc12)c3ccc(F)cc3
SMILES_CANONICALOpenEye OEToolkits2.0.6c1cc(ccc1c2cc3c(c(c2)O)nccn3)F
SMILESOpenEye OEToolkits2.0.6c1cc(ccc1c2cc3c(c(c2)O)nccn3)F

222415

PDB entries from 2024-07-10

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