canSAR825697
FEATURES
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NAMES
    SMILES
    CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)N[C@@H](CCSC)C(=O)O)ccc1N(C(=O)C(=O)O)c1cc(Cl)ccc1C(=O)O
    InChI
    InChI=1S/C32H39ClN4O10S/c1-4-20-15-19(8-11-25(20)37(29(41)32(46)47)26-17-21(33)9-10-22(26)30(42)43)16-24(35-18(2)38)28(40)34-13-6-5-7-27(39)36-23(31(44)45)12-14-48-3/h8-11,15,17,23-24H,4-7,12-14,16H2,1-3H3,(H,34,40)(H,35,38)(H,36,39)(H,42,43)(H,44,45)(H,46,47)/t23-,24?/m0/s1
    MOLECULAR FORMULA
    C32H39ClN4O10S
    CROSS REFERENCES
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    canSAR825697
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight706.21
    AlogP3.01
    HBond donors6
    HBond acceptors14
    Atoms87
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR825697.