canSAR823846
FEATURES
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NAMES
    SMILES
    CCOP(=O)(OCC)C(NC(=S)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1F)c1ccccc1
    InChI
    InChI=1S/C28H33FN3O4PS/c1-3-35-37(34,36-4-2)27(22-15-9-6-10-16-22)32-28(38)31-25(19-21-13-7-5-8-14-21)26(33)30-20-23-17-11-12-18-24(23)29/h5-18,25,27H,3-4,19-20H2,1-2H3,(H,30,33)(H2,31,32,38)/t25-,27?/m1/s1
    MOLECULAR FORMULA
    C28H33FN3O4PS
    CROSS REFERENCES
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    canSAR823846
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight557.19
    AlogP5.48
    HBond donors3
    HBond acceptors7
    Atoms71
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR823846.