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canSAR2052979
FEATURES
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NAMES
    SMILES
    CCn1nnc([C@H]2O[C@@H](n3cnc4c(N)nc(NC(C)Cc5ccc(F)cc5)nc43)[C@H](O)[C@@H]2O)n1
    InChI
    InChI=1S/C21H25FN10O3/c1-3-32-29-18(28-30-32)16-14(33)15(34)20(35-16)31-9-24-13-17(23)26-21(27-19(13)31)25-10(2)8-11-4-6-12(22)7-5-11/h4-7,9-10,14-16,20,33-34H,3,8H2,1-2H3,(H3,23,25,26,27)/t10?,14-,15+,16-,20+/m0/s1
    MOLECULAR FORMULA
    C21H25FN10O3
    CROSS REFERENCES
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    canSAR2052979

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 484.21
    AlogP 0.59
    HBond donors 5
    HBond acceptors 13
    Atoms 60
    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 canSAR2052979.