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canSAR732494
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NAMES
    SMILES
    S=C(Nc1ccc2ncnc(Nc3cccc(Cl)c3)c2c1)Nc1cccc2ccccc12
    InChI
    InChI=1S/C25H18ClN5S/c26-17-7-4-8-18(13-17)29-24-21-14-19(11-12-22(21)27-15-28-24)30-25(32)31-23-10-3-6-16-5-1-2-9-20(16)23/h1-15H,(H,27,28,29)(H2,30,31,32)
    MOLECULAR FORMULA
    C25H18ClN5S
    CROSS REFERENCES
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    canSAR732494

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 455.10
    AlogP 6.99
    HBond donors 3
    HBond acceptors 5
    Atoms 50
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR732494.