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canSAR1146336
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NAMES
    SMILES
    Clc1ccc(CNc2ncnc3c2cnn3CC(Cl)c2ccc(Br)cc2)cc1Cl
    InChI
    InChI=1S/C20H15BrCl3N5/c21-14-4-2-13(3-5-14)18(24)10-29-20-15(9-28-29)19(26-11-27-20)25-8-12-1-6-16(22)17(23)7-12/h1-7,9,11,18H,8,10H2,(H,25,26,27)
    MOLECULAR FORMULA
    C20H15BrCl3N5
    CROSS REFERENCES
    1146336 logo

    canSAR1146336

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 508.96
    AlogP 6.49
    HBond donors 1
    HBond acceptors 5
    Atoms 44
    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 canSAR1146336.