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canSAR1651884
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NAMES
    SMILES
    O=C(c1ccco1)N1CCN(c2ncnc3scc(-c4ccccc4)c23)CC1
    InChI
    InChI=1S/C21H18N4O2S/c26-21(17-7-4-12-27-17)25-10-8-24(9-11-25)19-18-16(15-5-2-1-3-6-15)13-28-20(18)23-14-22-19/h1-7,12-14H,8-11H2
    MOLECULAR FORMULA
    C21H18N4O2S
    CROSS REFERENCES
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    canSAR1651884

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 390.12
    AlogP 3.91
    HBond donors 0
    HBond acceptors 6
    Atoms 46
    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 canSAR1651884.