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canSAR985570
FEATURES
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NAMES
    SMILES
    N=C1NC(=O)/C(=C/c2ccc(NCc3cccc(C(=O)N[C@H](CCC(=O)O)C(=O)O)c3)cc2)S1
    InChI
    InChI=1S/C23H22N4O6S/c24-23-27-21(31)18(34-23)11-13-4-6-16(7-5-13)25-12-14-2-1-3-15(10-14)20(30)26-17(22(32)33)8-9-19(28)29/h1-7,10-11,17,25H,8-9,12H2,(H,26,30)(H,28,29)(H,32,33)(H2,24,27,31)/b18-11-/t17-/m1/s1
    MOLECULAR FORMULA
    C23H22N4O6S
    CROSS REFERENCES
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    canSAR985570

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 482.13
    AlogP 2.49
    HBond donors 6
    HBond acceptors 10
    Atoms 56
    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 canSAR985570.