FLM

3-FLUORO-2-METHYL-ANILINE

Created: 2003-03-27
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count17
Chiral Atom Count0
Bond Count17
Aromatic Bond Count6
2D diagram of FLM

Chemical Component Summary

Name3-FLUORO-2-METHYL-ANILINE
Systematic Name (OpenEye OEToolkits)3-fluoro-2-methyl-aniline
FormulaC7 H8 F N
Molecular Weight125.144
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04Fc1cccc(N)c1C
SMILESCACTVS3.341Cc1c(N)cccc1F
SMILESOpenEye OEToolkits1.5.0Cc1c(cccc1F)N
Canonical SMILESCACTVS3.341 Cc1c(N)cccc1F
Canonical SMILESOpenEye OEToolkits1.5.0 Cc1c(cccc1F)N
InChIInChI1.03 InChI=1S/C7H8FN/c1-5-6(8)3-2-4-7(5)9/h2-4H,9H2,1H3
InChIKeyInChI1.03 SLDLVGFPFFLYBM-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank IDDB01986 
Name3-Fluoro-2-Methyl-Aniline
Groups experimental
Synonyms3-Fluoro-2-Methyl-Aniline

Drug Targets

NameTarget SequencePharmacological ActionActions
EndolysinMNIFEMLRIDERLRLKIYKDTEGYYTIGIGHLLTKSPSLNAAKSELDKAI...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 285553