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canSAR78166
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NAMES
    SMILES
    Cc1ccc(NCc2ccc(C(=O)Nc3ccccc3N)cc2)cc1Nc1nccc(-c2cccnc2)n1
    InChI
    InChI=1S/C30H27N7O/c1-20-8-13-24(17-28(20)37-30-33-16-14-26(36-30)23-5-4-15-32-19-23)34-18-21-9-11-22(12-10-21)29(38)35-27-7-3-2-6-25(27)31/h2-17,19,34H,18,31H2,1H3,(H,35,38)(H,33,36,37)
    MOLECULAR FORMULA
    C30H27N7O
    CROSS REFERENCES
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    canSAR78166

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 501.23
    AlogP 6.04
    HBond donors 5
    HBond acceptors 8
    Atoms 65
    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 canSAR78166.