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canSAR344316
FEATURES
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NAMES
    SMILES
    CCCC[C@H]1OC(O)=C2C1=NC1=C(C(=O)COC1)[C@H]2c1ccc(F)c(Br)c1
    InChI
    InChI=1S/C20H19BrFNO4/c1-2-3-4-15-19-18(20(25)27-15)16(10-5-6-12(22)11(21)7-10)17-13(23-19)8-26-9-14(17)24/h5-7,15-16,25H,2-4,8-9H2,1H3/t15-,16-/m1/s1
    MOLECULAR FORMULA
    C20H19BrFNO4
    CROSS REFERENCES
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    canSAR344316

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.05
    AlogP 4.34
    HBond donors 1
    HBond acceptors 5
    Atoms 46
    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 canSAR344316.