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canSAR2002118
FEATURES
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NAMES
    SMILES
    CCC(C)(C)NCc1cnc(Oc2ccc3c(c2)CCC(c2ccccc2)O3)s1
    InChI
    InChI=1S/C24H28N2O2S/c1-4-24(2,3)26-16-20-15-25-23(29-20)27-19-11-13-22-18(14-19)10-12-21(28-22)17-8-6-5-7-9-17/h5-9,11,13-15,21,26H,4,10,12,16H2,1-3H3
    MOLECULAR FORMULA
    C24H28N2O2S
    CROSS REFERENCES
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    canSAR2002118

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 408.19
    AlogP 6.28
    HBond donors 1
    HBond acceptors 4
    Atoms 57
    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 canSAR2002118.