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canSAR1970187
FEATURES
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NAMES
    SMILES
    [NH3+][C@@H](Cc1ccccc1)C(=O)C[C@@H](COC(=O)c1ccccc1)C(=O)N[C@H](C(=O)O)C1CCCCC1
    InChI
    InChI=1S/C28H34N2O6/c29-23(16-19-10-4-1-5-11-19)24(31)17-22(18-36-28(35)21-14-8-3-9-15-21)26(32)30-25(27(33)34)20-12-6-2-7-13-20/h1,3-5,8-11,14-15,20,22-23,25H,2,6-7,12-13,16-18,29H2,(H,30,32)(H,33,34)/p+1/t22-,23-,25-/m0/s1
    MOLECULAR FORMULA
    C28H35N2O6+
    CROSS REFERENCES
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    canSAR1970187

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 495.25
    AlogP 2.42
    HBond donors 5
    HBond acceptors 8
    Atoms 71
    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 canSAR1970187.