canSAR818646
FEATURES
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NAMES
    SMILES
    COCc1cc2cc(c1)C(=O)N[C@H]([C@H](O)CNC(COC)c1cccc(C(C)(C)C)c1)Cc1cccc(c1)OCCCCN2
    InChI
    InChI=1S/C36H49N3O5/c1-36(2,3)29-12-9-11-27(20-29)33(24-43-5)38-22-34(40)32-19-25-10-8-13-31(18-25)44-15-7-6-14-37-30-17-26(23-42-4)16-28(21-30)35(41)39-32/h8-13,16-18,20-21,32-34,37-38,40H,6-7,14-15,19,22-24H2,1-5H3,(H,39,41)/t32-,33?,34+/m0/s1
    MOLECULAR FORMULA
    C36H49N3O5
    CROSS REFERENCES
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    canSAR818646
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight603.37
    AlogP5.39
    HBond donors4
    HBond acceptors8
    Atoms93
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR818646.