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canSAR2003829
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NAMES
    SMILES
    COCCNC(=O)c1c(NC(=O)c2nc(SC)ncc2Cl)sc2c1CCCC2
    InChI
    InChI=1S/C18H21ClN4O3S2/c1-26-8-7-20-15(24)13-10-5-3-4-6-12(10)28-17(13)23-16(25)14-11(19)9-21-18(22-14)27-2/h9H,3-8H2,1-2H3,(H,20,24)(H,23,25)
    MOLECULAR FORMULA
    C18H21ClN4O3S2
    CROSS REFERENCES
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    canSAR2003829

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 440.07
    AlogP 3.42
    HBond donors 2
    HBond acceptors 7
    Atoms 49
    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 canSAR2003829.