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canSAR220468
FEATURES
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NAMES
    SMILES
    CCCCCNC(=O)C(Cc1ccc(OCC(N)=O)c(C(=O)O)c1)NC(=O)CCC(=O)O
    InChI
    InChI=1S/C21H29N3O8/c1-2-3-4-9-23-20(29)15(24-18(26)7-8-19(27)28)11-13-5-6-16(32-12-17(22)25)14(10-13)21(30)31/h5-6,10,15H,2-4,7-9,11-12H2,1H3,(H2,22,25)(H,23,29)(H,24,26)(H,27,28)(H,30,31)
    MOLECULAR FORMULA
    C21H29N3O8
    CROSS REFERENCES
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    canSAR220468

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 451.20
    AlogP 0.45
    HBond donors 6
    HBond acceptors 11
    Atoms 61
    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 canSAR220468.