canSAR54536
FEATURES
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NAMES
    SMILES
    CNC(=O)NC(=N)NCCC[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)C[C@@H](C(=O)O)NC(=O)C[C@@H](C(=O)O)NC(=O)[C@H](Cc2ccccc2)N(C)C1=O
    InChI
    InChI=1S/C35H45N9O10/c1-37-35(54)43-34(36)38-15-9-14-22-31(49)44(2)26(17-21-12-7-4-8-13-21)30(48)42-25(33(52)53)19-28(46)40-24(32(50)51)18-27(45)39-23(29(47)41-22)16-20-10-5-3-6-11-20/h3-8,10-13,22-26H,9,14-19H2,1-2H3,(H,39,45)(H,40,46)(H,41,47)(H,42,48)(H,50,51)(H,52,53)(H4,36,37,38,43,54)/t22-,23+,24-,25-,26-/m0/s1
    MOLECULAR FORMULA
    C35H45N9O10
    CROSS REFERENCES
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    canSAR54536
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight751.33
    AlogP-1.57
    HBond donors10
    HBond acceptors19
    Atoms99
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR54536.