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canSAR347736
FEATURES
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NAMES
    SMILES
    CO[C@@]12C(COC(N)=O)C3=C(C(O)=C(C)/C(=N\CCOCCO)C3=O)N1CC1NC12
    InChI
    InChI=1S/C19H26N4O7/c1-9-13(21-3-5-29-6-4-24)16(26)12-10(8-30-18(20)27)19(28-2)17-11(22-17)7-23(19)14(12)15(9)25/h10-11,17,22,24-25H,3-8H2,1-2H3,(H2,20,27)/b21-13+/t10?,11?,17?,19-/m1/s1
    MOLECULAR FORMULA
    C19H26N4O7
    CROSS REFERENCES
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    canSAR347736

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 422.18
    AlogP -1.17
    HBond donors 5
    HBond acceptors 11
    Atoms 56
    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 canSAR347736.