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canSAR646394
FEATURES
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NAMES
    SMILES
    O=[N+]([O-])c1cc(C2(N3CCCCC3)CCCCC2)sc1Br
    InChI
    InChI=1S/C15H21BrN2O2S/c16-14-12(18(19)20)11-13(21-14)15(7-3-1-4-8-15)17-9-5-2-6-10-17/h11H,1-10H2
    MOLECULAR FORMULA
    C15H21BrN2O2S
    CROSS REFERENCES
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    canSAR646394

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 372.05
    AlogP 5.06
    HBond donors 0
    HBond acceptors 4
    Atoms 42
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR646394.