canSAR421121
FEATURES
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NAMES
    SMILES
    CC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(OC(F)(C(=O)O)C(=O)O)cc1)C(=O)N[C@@H](CC(C)C)C(N)=O
    InChI
    InChI=1S/C36H48FN7O18/c1-15(2)11-21(28(38)52)42-32(56)22(12-18-5-7-19(8-6-18)62-36(37,34(58)59)35(60)61)44-30(54)20(9-10-25(46)47)41-33(57)24(14-27(50)51)43-29(53)16(3)39-31(55)23(13-26(48)49)40-17(4)45/h5-8,15-16,20-24H,9-14H2,1-4H3,(H2,38,52)(H,39,55)(H,40,45)(H,41,57)(H,42,56)(H,43,53)(H,44,54)(H,46,47)(H,48,49)(H,50,51)(H,58,59)(H,60,61)/t16-,20-,21-,22-,23-,24-/m0/s1
    MOLECULAR FORMULA
    C36H48FN7O18
    CROSS REFERENCES
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    canSAR421121
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight885.30
    AlogP-3.26
    HBond donors13
    HBond acceptors25
    Atoms110
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR421121.