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canSAR2020578
FEATURES
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NAMES
    SMILES
    COc1ccccc1/N=C1/SCCCN1C.I
    InChI
    InChI=1S/C12H16N2OS.HI/c1-14-8-5-9-16-12(14)13-10-6-3-4-7-11(10)15-2;/h3-4,6-7H,5,8-9H2,1-2H3;1H/b13-12+;
    MOLECULAR FORMULA
    C12H17IN2OS
    CROSS REFERENCES
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    canSAR2020578

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 364.01
    AlogP 3.37
    HBond donors 0
    HBond acceptors 3
    Atoms 34
    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 canSAR2020578.