canSAR824226
FEATURES
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NAMES
    SMILES
    CC1(O)NC(=O)[C@@]2(C(=O)CCCCCCCCCCCNC(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@H]34)O[C@@H]12
    InChI
    InChI=1S/C27H44N4O6S/c1-26(36)23-27(37-23,24(34)31-26)20(32)14-9-7-5-3-2-4-6-8-12-16-28-21(33)15-11-10-13-19-22-18(17-38-19)29-25(35)30-22/h18-19,22-23,36H,2-17H2,1H3,(H,28,33)(H,31,34)(H2,29,30,35)/t18-,19-,22-,23-,26?,27-/m0/s1
    MOLECULAR FORMULA
    C27H44N4O6S
    CROSS REFERENCES
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    canSAR824226
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight552.30
    AlogP2.27
    HBond donors5
    HBond acceptors10
    Atoms82
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR824226.