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canSAR394521
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NAMES
    SMILES
    Cc1n[nH]c2ccc(-c3cncc(OC[C@@H](N)Cc4cccc(OCC5CCN(C)CC5)c4)c3)cc12
    InChI
    InChI=1S/C29H35N5O2/c1-20-28-15-23(6-7-29(28)33-32-20)24-14-27(17-31-16-24)36-19-25(30)12-22-4-3-5-26(13-22)35-18-21-8-10-34(2)11-9-21/h3-7,13-17,21,25H,8-12,18-19,30H2,1-2H3,(H,32,33)/t25-/m0/s1
    MOLECULAR FORMULA
    C29H35N5O2
    CROSS REFERENCES
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    canSAR394521

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 485.28
    AlogP 4.60
    HBond donors 3
    HBond acceptors 7
    Atoms 71
    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 canSAR394521.