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canSAR657939
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NAMES
    SMILES
    O=C(NCc1ccccc1)c1nn(-c2ccc(Cl)cc2Cl)c(-c2ccc(Br)cc2)c1Cn1cncn1
    InChI
    InChI=1S/C26H19BrCl2N6O/c27-19-8-6-18(7-9-19)25-21(14-34-16-30-15-32-34)24(26(36)31-13-17-4-2-1-3-5-17)33-35(25)23-11-10-20(28)12-22(23)29/h1-12,15-16H,13-14H2,(H,31,36)
    MOLECULAR FORMULA
    C26H19BrCl2N6O
    CROSS REFERENCES
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    canSAR657939

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 580.02
    AlogP 6.18
    HBond donors 1
    HBond acceptors 7
    Atoms 55
    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 canSAR657939.