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SJ000128611
FEATURES
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NAMES
  • SJ000128611
SMILES
CCOc1ccccc1CN1CCN(Cc2cc(Br)ccc2O)CC1
InChI
InChI=1S/C20H25BrN2O2/c1-2-25-20-6-4-3-5-16(20)14-22-9-11-23(12-10-22)15-17-13-18(21)7-8-19(17)24/h3-8,13,24H,2,9-12,14-15H2,1H3
MOLECULAR FORMULA
C20H25BrN2O2
CROSS REFERENCES
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SJ000128611

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 404.11
AlogP 3.87
HBond donors 1
HBond acceptors 4
Atoms 50
Contains toxicophore No
Contains PAINS Yes
Commercially available Yes
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by SJ000128611.