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canSAR987000
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NAMES
    SMILES
    N#Cc1ccc(Cn2cncc2CNC2CCN(c3cccc4ncccc34)C2=O)cc1
    InChI
    InChI=1S/C25H22N6O/c26-13-18-6-8-19(9-7-18)16-30-17-27-14-20(30)15-29-23-10-12-31(25(23)32)24-5-1-4-22-21(24)3-2-11-28-22/h1-9,11,14,17,23,29H,10,12,15-16H2
    MOLECULAR FORMULA
    C25H22N6O
    CROSS REFERENCES
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    canSAR987000

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 422.19
    AlogP 3.25
    HBond donors 1
    HBond acceptors 7
    Atoms 54
    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 canSAR987000.