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canSAR163721
FEATURES
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NAMES
    SMILES
    CCc1nc2c(N)ncnc2n1[C@@H]1O[C@H](CN(C)C/C=C\CN)[C@@H](O)[C@H]1O
    InChI
    InChI=1S/C17H27N7O3/c1-3-11-22-12-15(19)20-9-21-16(12)24(11)17-14(26)13(25)10(27-17)8-23(2)7-5-4-6-18/h4-5,9-10,13-14,17,25-26H,3,6-8,18H2,1-2H3,(H2,19,20,21)/b5-4-/t10-,13-,14-,17-/m1/s1
    MOLECULAR FORMULA
    C17H27N7O3
    CROSS REFERENCES
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    canSAR163721

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 377.22
    AlogP -0.96
    HBond donors 6
    HBond acceptors 10
    Atoms 54
    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 canSAR163721.