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canSAR559775
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NAMES
    SMILES
    CC[C@H](C)CNC(=O)c1cncc(-c2cccc(CNCCCc3ccccc3)c2)c1
    InChI
    InChI=1S/C27H33N3O/c1-3-21(2)17-30-27(31)26-16-25(19-29-20-26)24-13-7-11-23(15-24)18-28-14-8-12-22-9-5-4-6-10-22/h4-7,9-11,13,15-16,19-21,28H,3,8,12,14,17-18H2,1-2H3,(H,30,31)/t21-/m0/s1
    MOLECULAR FORMULA
    C27H33N3O
    CROSS REFERENCES
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    canSAR559775

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 415.26
    AlogP 5.25
    HBond donors 2
    HBond acceptors 4
    Atoms 64
    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 canSAR559775.