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canSAR830270
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NAMES
    SMILES
    CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(=O)c1cccs1)[C@@H](C)OCc1ccccc1)C(C)C
    InChI
    InChI=1S/C35H49N5O7S/c1-20(2)17-27(33(44)38-26(18-25-14-15-36-32(25)43)31(42)28-13-10-16-48-28)39-35(46)30(22(5)47-19-24-11-8-7-9-12-24)40-34(45)29(21(3)4)37-23(6)41/h7-13,16,20-22,25-27,29-30H,14-15,17-19H2,1-6H3,(H,36,43)(H,37,41)(H,38,44)(H,39,46)(H,40,45)/t22-,25+,26+,27+,29+,30+/m1/s1
    MOLECULAR FORMULA
    C35H49N5O7S
    CROSS REFERENCES
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    canSAR830270

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 683.34
    AlogP 2.72
    HBond donors 5
    HBond acceptors 12
    Atoms 97
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR830270.