canSAR545107
FEATURES
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NAMES
    SMILES
    CNC(=O)c1ccc(/C=C/C(=O)NCC(=O)N(C)c2ccc(Cl)c(COc3cccc4c(OCC(=O)N(C)C)cc(C)nc34)c2Cl)cc1.Cl
    InChI
    InChI=1S/C35H35Cl2N5O6.ClH/c1-21-17-29(48-20-32(45)41(3)4)24-7-6-8-28(34(24)40-21)47-19-25-26(36)14-15-27(33(25)37)42(5)31(44)18-39-30(43)16-11-22-9-12-23(13-10-22)35(46)38-2;/h6-17H,18-20H2,1-5H3,(H,38,46)(H,39,43);1H/b16-11+;
    MOLECULAR FORMULA
    C35H36Cl3N5O6
    CROSS REFERENCES
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    canSAR545107
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight727.17
    AlogP5.47
    HBond donors2
    HBond acceptors11
    Atoms85
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR545107.