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canSAR1769390
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NAMES
    SMILES
    Br.O=C(CN1CCSC1=NCc1ccccc1)c1ccc(Cl)cc1
    InChI
    InChI=1S/C18H17ClN2OS.BrH/c19-16-8-6-15(7-9-16)17(22)13-21-10-11-23-18(21)20-12-14-4-2-1-3-5-14;/h1-9H,10-13H2;1H
    MOLECULAR FORMULA
    C18H18BrClN2OS
    CROSS REFERENCES
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    canSAR1769390

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 424.00
    AlogP 4.71
    HBond donors 0
    HBond acceptors 3
    Atoms 42
    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 canSAR1769390.