canSAR214723
FEATURES
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NAMES
    SMILES
    Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(OCCCN4CCCC4)cc3)nnc2c1
    InChI
    InChI=1S/C29H33N5O/c1-20-8-6-9-21(2)27(20)23-18-22(3)28-26(19-23)32-33-29(31-28)30-24-10-12-25(13-11-24)35-17-7-16-34-14-4-5-15-34/h6,8-13,18-19H,4-5,7,14-17H2,1-3H3,(H,30,31,33)
    MOLECULAR FORMULA
    C29H33N5O
    CROSS REFERENCES
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    canSAR214723
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight467.27
    AlogP6.23
    HBond donors1
    HBond acceptors6
    Atoms68
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR214723.