canSAR2065610
FEATURES
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NAMES
    SMILES
    CN1CCN(C)C(c2ccc(Nc3nc(-c4cccc(NC(=O)c5cc6c(s5)CCCC6)c4Cl)cn(C)c3=O)cc2)C1=O
    InChI
    InChI=1S/C32H33ClN6O3S/c1-37-15-16-38(2)31(41)28(37)19-11-13-21(14-12-19)34-29-32(42)39(3)18-24(35-29)22-8-6-9-23(27(22)33)36-30(40)26-17-20-7-4-5-10-25(20)43-26/h6,8-9,11-14,17-18,28H,4-5,7,10,15-16H2,1-3H3,(H,34,35)(H,36,40)
    MOLECULAR FORMULA
    C32H33ClN6O3S
    CROSS REFERENCES
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    canSAR2065610
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight616.20
    AlogP5.48
    HBond donors2
    HBond acceptors9
    Atoms76
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2065610.