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canSAR2000614
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NAMES
    SMILES
    CCn1c(C)c(C(C)=O)c(NCc2ccccc2)nc1=S
    InChI
    InChI=1S/C16H19N3OS/c1-4-19-11(2)14(12(3)20)15(18-16(19)21)17-10-13-8-6-5-7-9-13/h5-9H,4,10H2,1-3H3,(H,17,18,21)
    MOLECULAR FORMULA
    C16H19N3OS
    CROSS REFERENCES
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    canSAR2000614

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 301.12
    AlogP 3.76
    HBond donors 1
    HBond acceptors 4
    Atoms 40
    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 canSAR2000614.