canSAR420037
FEATURES
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NAMES
    SMILES
    CC(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(CCS(C)(=O)=O)C(=O)/C=C/S(=O)(=O)c1ccccc1
    InChI
    InChI=1S/C27H41N3O8S2/c1-18(2)16-23(28-20(5)31)26(33)30-24(17-19(3)4)27(34)29-22(12-14-39(6,35)36)25(32)13-15-40(37,38)21-10-8-7-9-11-21/h7-11,13,15,18-19,22-24H,12,14,16-17H2,1-6H3,(H,28,31)(H,29,34)(H,30,33)/b15-13+
    MOLECULAR FORMULA
    C27H41N3O8S2
    CROSS REFERENCES
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    canSAR420037
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight599.23
    AlogP1.54
    HBond donors3
    HBond acceptors11
    Atoms81
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR420037.