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canSAR672786
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NAMES
    SMILES
    O=C(Nc1cccc(Cl)c1)Nc1nc(-c2ccccc2)nc2nn(Cc3ccccc3)cc12
    InChI
    InChI=1S/C25H19ClN6O/c26-19-12-7-13-20(14-19)27-25(33)30-23-21-16-32(15-17-8-3-1-4-9-17)31-24(21)29-22(28-23)18-10-5-2-6-11-18/h1-14,16H,15H2,(H2,27,28,29,30,31,33)
    MOLECULAR FORMULA
    C25H19ClN6O
    CROSS REFERENCES
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    canSAR672786

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 454.13
    AlogP 5.84
    HBond donors 2
    HBond acceptors 7
    Atoms 52
    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 canSAR672786.