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canSAR842062
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NAMES
    SMILES
    Cc1csc(C[C@H]2[C@@H]3CNC[C@@]32c2ccc(Cl)c(Cl)c2)n1
    InChI
    InChI=1S/C16H16Cl2N2S/c1-9-7-21-15(20-9)5-11-12-6-19-8-16(11,12)10-2-3-13(17)14(18)4-10/h2-4,7,11-12,19H,5-6,8H2,1H3/t11-,12-,16-/m0/s1
    MOLECULAR FORMULA
    C16H16Cl2N2S
    CROSS REFERENCES
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    canSAR842062

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 338.04
    AlogP 4.09
    HBond donors 1
    HBond acceptors 2
    Atoms 37
    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 canSAR842062.