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canSAR1144714
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NAMES
    SMILES
    NC1CCC(Nc2nc(NCc3ccc(-n4cccn4)cc3)c3ncn(C4CCCC4)c3n2)CC1
    InChI
    InChI=1S/C26H33N9/c27-19-8-10-20(11-9-19)31-26-32-24(23-25(33-26)34(17-29-23)21-4-1-2-5-21)28-16-18-6-12-22(13-7-18)35-15-3-14-30-35/h3,6-7,12-15,17,19-21H,1-2,4-5,8-11,16,27H2,(H2,28,31,32,33)
    MOLECULAR FORMULA
    C26H33N9
    CROSS REFERENCES
    1144714 logo

    canSAR1144714

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 471.29
    AlogP 4.42
    HBond donors 4
    HBond acceptors 9
    Atoms 68
    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 canSAR1144714.