canSAR738966
FEATURES
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NAMES
    SMILES
    NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)c1ccccc1N)C(=O)N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(N)=O
    InChI
    InChI=1S/C34H39N13O10/c35-21-4-2-1-3-20(21)31(52)45-24(10-19-13-39-16-42-19)33(54)46-23(9-18-12-38-15-41-18)32(53)40-14-29(50)43-25(11-28(36)49)34(55)44-22(30(37)51)7-17-5-6-27(48)26(8-17)47(56)57/h1-6,8,12-13,15-16,22-25,48H,7,9-11,14,35H2,(H2,36,49)(H2,37,51)(H,38,41)(H,39,42)(H,40,53)(H,43,50)(H,44,55)(H,45,52)(H,46,54)/t22-,23-,24-,25-/m0/s1
    MOLECULAR FORMULA
    C34H39N13O10
    CROSS REFERENCES
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    canSAR738966
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight789.29
    AlogP-2.91
    HBond donors14
    HBond acceptors23
    Atoms96
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR738966.