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canSAR2049772
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NAMES
    SMILES
    CN(C)CCN1CCN(c2nc(-c3ccccn3)nc3c2CN(CC2CCCCC2)CC3)CC1
    InChI
    InChI=1S/C27H41N7/c1-31(2)14-15-32-16-18-34(19-17-32)27-23-21-33(20-22-8-4-3-5-9-22)13-11-24(23)29-26(30-27)25-10-6-7-12-28-25/h6-7,10,12,22H,3-5,8-9,11,13-21H2,1-2H3
    MOLECULAR FORMULA
    C27H41N7
    CROSS REFERENCES
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    canSAR2049772

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 463.34
    AlogP 3.16
    HBond donors 0
    HBond acceptors 7
    Atoms 75
    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 canSAR2049772.