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canSAR651662
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NAMES
    SMILES
    Nc1nc(N)c2c(CSc3ccc(-c4ccccc4)cc3)coc2n1
    InChI
    InChI=1S/C19H16N4OS/c20-17-16-14(10-24-18(16)23-19(21)22-17)11-25-15-8-6-13(7-9-15)12-4-2-1-3-5-12/h1-10H,11H2,(H4,20,21,22,23)
    MOLECULAR FORMULA
    C19H16N4OS
    CROSS REFERENCES
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    canSAR651662

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 348.10
    AlogP 4.35
    HBond donors 4
    HBond acceptors 5
    Atoms 41
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR651662.