canSAR2102092
FEATURES
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NAMES
    SMILES
    Cc1cc(C(=O)N2Cc3cc4c(cc3C[C@H]2C(=O)N[C@@H](Cc2ccc(-c3ccnc(C)c3C)cc2)C(=O)O)OC[C@H](c2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)O4)n(C)n1
    InChI
    InChI=1S/C47H43Cl2N5O7/c1-26-17-41(53(4)52-26)46(56)54-23-34-22-43-42(60-25-44(61-43)32-10-12-35(13-11-32)59-24-30-7-14-37(48)38(49)18-30)21-33(34)20-40(54)45(55)51-39(47(57)58)19-29-5-8-31(9-6-29)36-15-16-50-28(3)27(36)2/h5-18,21-22,39-40,44H,19-20,23-25H2,1-4H3,(H,51,55)(H,57,58)/t39-,40-,44+/m0/s1
    MOLECULAR FORMULA
    C47H43Cl2N5O7
    CROSS REFERENCES
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    canSAR2102092
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight859.25
    AlogP8.18
    HBond donors2
    HBond acceptors12
    Atoms104
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2102092.