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canSAR1267064
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NAMES
    SMILES
    CCc1nc(NCCc2nc(C)c(C)s2)c2cnn(C)c2n1
    InChI
    InChI=1S/C15H20N6S/c1-5-12-19-14(11-8-17-21(4)15(11)20-12)16-7-6-13-18-9(2)10(3)22-13/h8H,5-7H2,1-4H3,(H,16,19,20)
    MOLECULAR FORMULA
    C15H20N6S
    CROSS REFERENCES
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    canSAR1267064

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 316.15
    AlogP 2.65
    HBond donors 1
    HBond acceptors 6
    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 canSAR1267064.