canSAR538700
FEATURES
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NAMES
    SMILES
    CSCC[C@H](NC(=O)c1ccc(COCc2ccc(-c3ccc(F)cc3)o2)cc1-c1ccccc1C)C(=O)[O-]
    InChI
    InChI=1S/C31H30FNO5S/c1-20-5-3-4-6-25(20)27-17-21(7-13-26(27)30(34)33-28(31(35)36)15-16-39-2)18-37-19-24-12-14-29(38-24)22-8-10-23(32)11-9-22/h3-14,17,28H,15-16,18-19H2,1-2H3,(H,33,34)(H,35,36)/p-1/t28-/m0/s1
    MOLECULAR FORMULA
    C31H29FNO5S-
    CROSS REFERENCES
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    canSAR538700
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight546.18
    AlogP5.38
    HBond donors1
    HBond acceptors6
    Atoms68
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR538700.