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canSAR1130089
FEATURES
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NAMES
    SMILES
    O=C(O[C@H]1C(=O)C=CN(C(=O)Oc2ccccc2)[C@@H]1c1ccc2c(c1)OCO2)c1ccc(F)cc1C(F)(F)F
    InChI
    InChI=1S/C27H17F4NO7/c28-16-7-8-18(19(13-16)27(29,30)31)25(34)39-24-20(33)10-11-32(26(35)38-17-4-2-1-3-5-17)23(24)15-6-9-21-22(12-15)37-14-36-21/h1-13,23-24H,14H2/t23-,24+/m1/s1
    MOLECULAR FORMULA
    C27H17F4NO7
    CROSS REFERENCES
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    canSAR1130089

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 543.09
    AlogP 5.44
    HBond donors 0
    HBond acceptors 8
    Atoms 56
    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 canSAR1130089.