Compound - Results

Bupropion

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Information Structure
Name Bupropion
Synonyms
( -)-2-(tert-Butylamino)-3-chloropropiophenone
( -)-2-(tert-Butylamino)-3-chlorpropiophenon
(+-)-1-(3-Chlorophenyl)-2-((1,1-dimethylethyl)amino)-1-propanone
(+-)-Bupropion
alpha-(tert-Butylamino)-m-chloropropiophenone
Amfebutamona
Amfebutamone
Amfebutamonum
BRN 2101062
Bupropion
ATC N07BA02
N06AX12
CID 444
CAS 034911552
Drugbank ID DB01156
TTD Drug ID DAP000052
SMILES C[C@H](NC(C)(C)C)C(=O)C1=CC(Cl)=CC=C1
Formula C13H18ClNO
Molweight 239.741
Atoms 16
LogP 3.6902
Rotatable Bonds 4
H-Bond Donors 0
H-Bond Acceptors 2
CYP interactions
NameRelationsReferences
1A2Substrate umm
2A6Substrate umm
2B6Substrate Inhibitor 15652242
medicine.iupui.edu/flockhart
14570767
14534519
14977870
11454731
15626586
15769884
10997936
2C8Substrate umm
2C9Substrate umm
2D6Substrate Inhibitor umm
15692832
15876900
10997936
15876900
2E1Substrate umm
10997944
3A4Substrate umm
Transporter
AC-No.NameReferences
A2RUN4Solute carrier family 6 (Neurotransmitter transporter, dopamine), member 3 isoform CRA_b 15787205
P23975Sodium-dependent noradrenaline transporter 17009913
P78381UDP-galactose translocator20939765
Q01959Sodium-dependent dopamine transporter 10773037
Q9UNQ0Breast cancer resistance protein20599802
Extrarenal fraction 0.99
Elimination half-life 20.0h