canSAR2167105
FEATURES
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NAMES
    SMILES
    N#CCC1(n2cc(-c3ncnc4[nH]ccc34)cn2)CN(C2CCN(C(=O)c3sccc3Cl)CC2)C1
    InChI
    InChI=1S/C24H23ClN8OS/c25-19-4-10-35-21(19)23(34)31-8-2-17(3-9-31)32-13-24(14-32,5-6-26)33-12-16(11-30-33)20-18-1-7-27-22(18)29-15-28-20/h1,4,7,10-12,15,17H,2-3,5,8-9,13-14H2,(H,27,28,29)
    MOLECULAR FORMULA
    C24H23ClN8OS
    CROSS REFERENCES
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    canSAR2167105
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight506.14
    AlogP3.77
    HBond donors1
    HBond acceptors9
    Atoms58
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2167105.