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canSAR1446834
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NAMES
    SMILES
    CCc1n[nH]c(SCC(=O)Nc2ccc(N(C)C)cc2)n1
    InChI
    InChI=1S/C14H19N5OS/c1-4-12-16-14(18-17-12)21-9-13(20)15-10-5-7-11(8-6-10)19(2)3/h5-8H,4,9H2,1-3H3,(H,15,20)(H,16,17,18)
    MOLECULAR FORMULA
    C14H19N5OS
    CROSS REFERENCES
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    canSAR1446834

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 305.13
    AlogP 2.16
    HBond donors 2
    HBond acceptors 6
    Atoms 40
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1446834.