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canSAR463276
FEATURES
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NAMES
    SMILES
    CCC1C(=O)N(S(C)(=O)=O)[C@H]2CCN(C(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(C)=O)C(C)C)C(C)C)[C@H]12
    InChI
    InChI=1S/C30H48N6O12S/c1-8-17-25-20(36(29(17)45)49(7,47)48)11-12-35(25)30(46)24(15(4)5)34-28(44)23(14(2)3)33-27(43)19(13-22(40)41)32-26(42)18(31-16(6)37)9-10-21(38)39/h14-15,17-20,23-25H,8-13H2,1-7H3,(H,31,37)(H,32,42)(H,33,43)(H,34,44)(H,38,39)(H,40,41)/t17?,18-,19-,20-,23-,24+,25+/m0/s1
    MOLECULAR FORMULA
    C30H48N6O12S
    CROSS REFERENCES
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    canSAR463276

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 716.31
    AlogP -1.61
    HBond donors 6
    HBond acceptors 18
    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 canSAR463276.