AEH

4-(2-aminoethyl)-2-ethylphenol

Created:2008-01-07
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count27
Chiral Atom Count0
Bond Count27
Aromatic Bond Count6
2D diagram of AEH

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Chemical Component Summary

Name4-(2-aminoethyl)-2-ethylphenol
Systematic Name (OpenEye OEToolkits)4-(2-aminoethyl)-2-ethyl-phenol
FormulaC10 H15 N O
Molecular Weight165.232
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04Oc1ccc(cc1CC)CCN
SMILESCACTVS3.341CCc1cc(CCN)ccc1O
SMILESOpenEye OEToolkits1.5.0CCc1cc(ccc1O)CCN
Canonical SMILESCACTVS3.341 CCc1cc(CCN)ccc1O
Canonical SMILESOpenEye OEToolkits1.5.0 CCc1cc(ccc1O)CCN
InChIInChI1.03 InChI=1S/C10H15NO/c1-2-9-7-8(5-6-11)3-4-10(9)12/h3-4,7,12H,2,5-6,11H2,1H3
InChIKeyInChI1.03 LDAFQVRTSOETPE-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
DrugBank IDDB07346 
Name4-(2-aminoethyl)-2-ethylphenol
Groups experimental
Synonyms4-(2-aminoethyl)-2-ethylphenol

Drug Targets

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
NameTarget SequencePharmacological ActionActions
Beta-secretase 1MAQALPWLLLWMGAGVLPAHGTQHGIRLPLRSGLGGAPLGLRLPRETDEE...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 24748050
ChEMBL CHEMBL255750