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canSAR832928
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NAMES
    SMILES
    NC(=O)c1cn(-c2ccccn2)c2c1CCc1cnc(NC3CCCC3)nc1-2
    InChI
    InChI=1S/C21H22N6O/c22-20(28)16-12-27(17-7-3-4-10-23-17)19-15(16)9-8-13-11-24-21(26-18(13)19)25-14-5-1-2-6-14/h3-4,7,10-12,14H,1-2,5-6,8-9H2,(H2,22,28)(H,24,25,26)
    MOLECULAR FORMULA
    C21H22N6O
    CROSS REFERENCES
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    canSAR832928

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 374.19
    AlogP 2.88
    HBond donors 3
    HBond acceptors 7
    Atoms 50
    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 canSAR832928.