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canSAR397267
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NAMES
    SMILES
    Nc1ncnc2c1ncn2[C@@H]1O[C@H](CSCCc2ccccn2)[C@@H](O)[C@H]1O
    InChI
    InChI=1S/C17H20N6O3S/c18-15-12-16(21-8-20-15)23(9-22-12)17-14(25)13(24)11(26-17)7-27-6-4-10-3-1-2-5-19-10/h1-3,5,8-9,11,13-14,17,24-25H,4,6-7H2,(H2,18,20,21)/t11-,13-,14-,17-/m1/s1
    MOLECULAR FORMULA
    C17H20N6O3S
    CROSS REFERENCES
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    canSAR397267

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 388.13
    AlogP 0.40
    HBond donors 4
    HBond acceptors 9
    Atoms 47
    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 canSAR397267.