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Dimethisoquin
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NAMES
  • Dimethisoquin
  • Quinisocaine
SMILES
CCCCc1cc2ccccc2c(OCCN(C)C)n1
InChI
InChI=1S/C17H24N2O/c1-4-5-9-15-13-14-8-6-7-10-16(14)17(18-15)20-12-11-19(2)3/h6-8,10,13H,4-5,9,11-12H2,1-3H3
MOLECULAR FORMULA
C17H24N2O
CROSS REFERENCES
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Dimethisoquin

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 272.19
AlogP 3.52
HBond donors 0
HBond acceptors 3
Atoms 44
Contains toxicophore No
Contains PAINS No
Commercially available Yes
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Dimethisoquin.