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canSAR349543
FEATURES
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NAMES
    SMILES
    CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(N)=O
    InChI
    InChI=1S/C30H43N7O7S/c1-18(27(32)41)35-29(43)23(12-13-45-2)37-30(44)24(15-19-6-4-3-5-7-19)36-26(40)17-33-25(39)16-34-28(42)22(31)14-20-8-10-21(38)11-9-20/h3-11,18,22-24,26,36,38,40H,12-17,31H2,1-2H3,(H2,32,41)(H,33,39)(H,34,42)(H,35,43)(H,37,44)/t18-,22-,23-,24-,26?/m0/s1
    MOLECULAR FORMULA
    C30H43N7O7S
    CROSS REFERENCES
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    canSAR349543

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 645.29
    AlogP -1.76
    HBond donors 11
    HBond acceptors 14
    Atoms 88
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR349543.