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canSAR730310
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NAMES
    SMILES
    Cc1ccc(-c2cc(Nc3cc(CN4CCCC4)c(O)c(CN4CCCC4)c3)c3ccccc3n2)cc1
    InChI
    InChI=1S/C32H36N4O/c1-23-10-12-24(13-11-23)30-20-31(28-8-2-3-9-29(28)34-30)33-27-18-25(21-35-14-4-5-15-35)32(37)26(19-27)22-36-16-6-7-17-36/h2-3,8-13,18-20,37H,4-7,14-17,21-22H2,1H3,(H,33,34)
    MOLECULAR FORMULA
    C32H36N4O
    CROSS REFERENCES
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    canSAR730310

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 492.29
    AlogP 6.85
    HBond donors 2
    HBond acceptors 5
    Atoms 73
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR730310.