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canSAR1205096
FEATURES
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NAMES
    SMILES
    Nc1ccn([C@@H]2O[C@H](COP(=O)(O)NC(=O)c3ccccc3)[C@@H](O)C2(F)F)c(=O)n1
    InChI
    InChI=1S/C16H17F2N4O7P/c17-16(18)12(23)10(29-14(16)22-7-6-11(19)20-15(22)25)8-28-30(26,27)21-13(24)9-4-2-1-3-5-9/h1-7,10,12,14,23H,8H2,(H2,19,20,25)(H2,21,24,26,27)/t10-,12-,14-/m1/s1
    MOLECULAR FORMULA
    C16H17F2N4O7P
    CROSS REFERENCES
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    canSAR1205096

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.08
    AlogP 0.27
    HBond donors 5
    HBond acceptors 11
    Atoms 47
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1205096.