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canSAR1442475
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NAMES
    SMILES
    C=CCc1c(C)nc(SCc2ccccc2)nc1O
    InChI
    InChI=1S/C15H16N2OS/c1-3-7-13-11(2)16-15(17-14(13)18)19-10-12-8-5-4-6-9-12/h3-6,8-9H,1,7,10H2,2H3,(H,16,17,18)
    MOLECULAR FORMULA
    C15H16N2OS
    CROSS REFERENCES
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    canSAR1442475

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 272.10
    AlogP 3.51
    HBond donors 1
    HBond acceptors 3
    Atoms 35
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1442475.