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canSAR562887
FEATURES
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NAMES
    SMILES
    CCNc1cc(C(=O)N[C@@H](Cc2ccccc2)[C@H](O)CNC(C)(C)Cc2ccccc2)cc(N2CCCC2=O)c1
    InChI
    InChI=1S/C33H42N4O3/c1-4-34-27-19-26(20-28(21-27)37-17-11-16-31(37)39)32(40)36-29(18-24-12-7-5-8-13-24)30(38)23-35-33(2,3)22-25-14-9-6-10-15-25/h5-10,12-15,19-21,29-30,34-35,38H,4,11,16-18,22-23H2,1-3H3,(H,36,40)
    MOLECULAR FORMULA
    C33H42N4O3
    CROSS REFERENCES
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    canSAR562887

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 542.33
    AlogP 4.56
    HBond donors 4
    HBond acceptors 7
    Atoms 82
    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 canSAR562887.