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canSAR550738
FEATURES
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NAMES
    SMILES
    CC(CCc1ccccc1)Nc1c(F)c(Oc2cccc(C(=N)N)c2)nc(Oc2ccc(OC(C)C)cc2C(=O)O)c1F
    InChI
    InChI=1S/C32H32F2N4O5/c1-18(2)41-23-14-15-25(24(17-23)32(39)40)43-31-27(34)28(37-19(3)12-13-20-8-5-4-6-9-20)26(33)30(38-31)42-22-11-7-10-21(16-22)29(35)36/h4-11,14-19H,12-13H2,1-3H3,(H3,35,36)(H,37,38)(H,39,40)
    MOLECULAR FORMULA
    C32H32F2N4O5
    CROSS REFERENCES
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    canSAR550738

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 590.23
    AlogP 7.15
    HBond donors 5
    HBond acceptors 9
    Atoms 75
    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 canSAR550738.