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canSAR1112506
FEATURES
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NAMES
    SMILES
    CCOC(=O)c1c(-c2cc3cc4c(cc3oc2=O)OC(C)(C)CC4)nn(-c2ccccc2)c1C(=O)OCC
    InChI
    InChI=1S/C29H28N2O7/c1-5-35-27(33)23-24(30-31(19-10-8-7-9-11-19)25(23)28(34)36-6-2)20-15-18-14-17-12-13-29(3,4)38-22(17)16-21(18)37-26(20)32/h7-11,14-16H,5-6,12-13H2,1-4H3
    MOLECULAR FORMULA
    C29H28N2O7
    CROSS REFERENCES
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    canSAR1112506

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 516.19
    AlogP 5.10
    HBond donors 0
    HBond acceptors 9
    Atoms 66
    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 canSAR1112506.