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canSAR1204041
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NAMES
    SMILES
    C[C@@H](N1CCc2sc(-c3ccccc3)cc2C1)[C@](O)(Cn1cncn1)c1ccc(F)cc1F
    InChI
    InChI=1S/C25H24F2N4OS/c1-17(25(32,14-31-16-28-15-29-31)21-8-7-20(26)12-22(21)27)30-10-9-23-19(13-30)11-24(33-23)18-5-3-2-4-6-18/h2-8,11-12,15-17,32H,9-10,13-14H2,1H3/t17-,25-/m1/s1
    MOLECULAR FORMULA
    C25H24F2N4OS
    CROSS REFERENCES
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    canSAR1204041

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 466.16
    AlogP 4.62
    HBond donors 1
    HBond acceptors 5
    Atoms 57
    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 canSAR1204041.