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canSAR1142565
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NAMES
    SMILES
    Nc1nc(OCC2CCCCC2)nc2c1NC(=O)CN2Cc1cccc(CN2CCCC2)c1
    InChI
    InChI=1S/C25H34N6O2/c26-23-22-24(29-25(28-23)33-17-18-7-2-1-3-8-18)31(16-21(32)27-22)15-20-10-6-9-19(13-20)14-30-11-4-5-12-30/h6,9-10,13,18H,1-5,7-8,11-12,14-17H2,(H,27,32)(H2,26,28,29)
    MOLECULAR FORMULA
    C25H34N6O2
    CROSS REFERENCES
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    canSAR1142565

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 450.27
    AlogP 3.57
    HBond donors 3
    HBond acceptors 8
    Atoms 67
    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 canSAR1142565.