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canSAR2048956
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NAMES
    SMILES
    Cn1cnc(-c2ccc3[nH]nc(Cc4ccc(-c5cnn(C)c5)cc4)c3c2)c1
    InChI
    InChI=1S/C22H20N6/c1-27-13-22(23-14-27)17-7-8-20-19(10-17)21(26-25-20)9-15-3-5-16(6-4-15)18-11-24-28(2)12-18/h3-8,10-14H,9H2,1-2H3,(H,25,26)
    MOLECULAR FORMULA
    C22H20N6
    CROSS REFERENCES
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    canSAR2048956

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 368.17
    AlogP 3.95
    HBond donors 1
    HBond acceptors 6
    Atoms 48
    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 canSAR2048956.