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canSAR1126818
FEATURES
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NAMES
    SMILES
    Cc1ncnc(Nc2ccc(OCc3cccc(F)c3)c(Cl)c2)c1C#Cc1ccc(CNCCS(C)(=O)=O)o1
    InChI
    InChI=1S/C28H26ClFN4O4S/c1-19-25(10-9-23-7-8-24(38-23)16-31-12-13-39(2,35)36)28(33-18-32-19)34-22-6-11-27(26(29)15-22)37-17-20-4-3-5-21(30)14-20/h3-8,11,14-15,18,31H,12-13,16-17H2,1-2H3,(H,32,33,34)
    MOLECULAR FORMULA
    C28H26ClFN4O4S
    CROSS REFERENCES
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    canSAR1126818

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 568.13
    AlogP 5.03
    HBond donors 2
    HBond acceptors 8
    Atoms 65
    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 canSAR1126818.