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canSAR1498959
FEATURES
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NAMES
    SMILES
    O=C(Nc1nnc(CCCCc2nnc(NC(=O)C3Oc4ccccc4O3)s2)s1)C1Oc2ccccc2O1
    InChI
    InChI=1S/C24H20N6O6S2/c31-19(21-33-13-7-1-2-8-14(13)34-21)25-23-29-27-17(37-23)11-5-6-12-18-28-30-24(38-18)26-20(32)22-35-15-9-3-4-10-16(15)36-22/h1-4,7-10,21-22H,5-6,11-12H2,(H,25,29,31)(H,26,30,32)
    MOLECULAR FORMULA
    C24H20N6O6S2
    CROSS REFERENCES
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    canSAR1498959

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 552.09
    AlogP 3.43
    HBond donors 2
    HBond acceptors 12
    Atoms 58
    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 canSAR1498959.