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canSAR2276217
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NAMES
    SMILES
    COc1ccc(-n2c(SCc3c(F)cccc3Cl)nc3c2C(c2ccc(Cl)c(OC)c2)CCC3)cc1
    InChI
    InChI=1S/C28H25Cl2FN2O2S/c1-34-19-12-10-18(11-13-19)33-27-20(17-9-14-23(30)26(15-17)35-2)5-3-8-25(27)32-28(33)36-16-21-22(29)6-4-7-24(21)31/h4,6-7,9-15,20H,3,5,8,16H2,1-2H3
    MOLECULAR FORMULA
    C28H25Cl2FN2O2S
    CROSS REFERENCES
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    canSAR2276217

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 542.10
    AlogP 8.10
    HBond donors 0
    HBond acceptors 4
    Atoms 61
    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 canSAR2276217.