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canSAR1768860
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NAMES
    SMILES
    SC1=NC2=C(CCCC2)C2(CCCCC2)N1
    InChI
    InChI=1S/C13H20N2S/c16-12-14-11-7-3-2-6-10(11)13(15-12)8-4-1-5-9-13/h1-9H2,(H2,14,15,16)
    MOLECULAR FORMULA
    C13H20N2S
    CROSS REFERENCES
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    canSAR1768860

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 236.13
    AlogP 3.41
    HBond donors 1
    HBond acceptors 2
    Atoms 36
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1768860.