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canSAR657671
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NAMES
    SMILES
    Cc1cc(Br)ccc1CNC(=O)c1nn(-c2ccc(Cl)cc2Cl)c(-c2ccc(Cl)cc2)c1Cn1cncn1
    InChI
    InChI=1S/C27H20BrCl3N6O/c1-16-10-19(28)5-2-18(16)12-33-27(38)25-22(13-36-15-32-14-34-36)26(17-3-6-20(29)7-4-17)37(35-25)24-9-8-21(30)11-23(24)31/h2-11,14-15H,12-13H2,1H3,(H,33,38)
    MOLECULAR FORMULA
    C27H20BrCl3N6O
    CROSS REFERENCES
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    canSAR657671

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 627.99
    AlogP 7.14
    HBond donors 1
    HBond acceptors 7
    Atoms 58
    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 canSAR657671.