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canSAR833126
FEATURES
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NAMES
    SMILES
    OCc1cnn(-c2nc(Nc3ncc4ccccc4n3)c3ncn([C@@H]4O[C@H](CO)[C@@H](O)[C@H]4O)c3n2)c1
    InChI
    InChI=1S/C22H21N9O5/c32-8-11-5-25-31(7-11)22-28-18(27-21-23-6-12-3-1-2-4-13(12)26-21)15-19(29-22)30(10-24-15)20-17(35)16(34)14(9-33)36-20/h1-7,10,14,16-17,20,32-35H,8-9H2,(H,23,26,27,28,29)/t14-,16-,17-,20-/m1/s1
    MOLECULAR FORMULA
    C22H21N9O5
    CROSS REFERENCES
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    canSAR833126

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 491.17
    AlogP -0.20
    HBond donors 5
    HBond acceptors 14
    Atoms 57
    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 canSAR833126.