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canSAR966600
FEATURES
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NAMES
    SMILES
    CNC(=O)[C@@H](Cc1ccccc1)NP(=O)(O)OC[C@H]1O[C@@H](n2cc(C)c(=O)[nH]c2=O)C[C@@H]1N=[N+]=[N-]
    InChI
    InChI=1S/C20H26N7O7P/c1-12-10-27(20(30)23-18(12)28)17-9-14(24-26-21)16(34-17)11-33-35(31,32)25-15(19(29)22-2)8-13-6-4-3-5-7-13/h3-7,10,14-17H,8-9,11H2,1-2H3,(H,22,29)(H,23,28,30)(H2,25,31,32)/t14-,15+,16+,17+/m0/s1
    MOLECULAR FORMULA
    C20H26N7O7P
    CROSS REFERENCES
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    canSAR966600

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 507.16
    AlogP 0.88
    HBond donors 4
    HBond acceptors 14
    Atoms 61
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR966600.