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canSAR1156177
FEATURES
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NAMES
    SMILES
    O=C(O)CN1C(=O)/C(=C/c2ccc3cc(OCc4ccc(F)cc4)ccc3c2)SC1=S
    InChI
    InChI=1S/C23H16FNO4S2/c24-18-6-2-14(3-7-18)13-29-19-8-5-16-9-15(1-4-17(16)11-19)10-20-22(28)25(12-21(26)27)23(30)31-20/h1-11H,12-13H2,(H,26,27)/b20-10-
    MOLECULAR FORMULA
    C23H16FNO4S2
    CROSS REFERENCES
    1156177 logo

    canSAR1156177

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 453.05
    AlogP 4.84
    HBond donors 1
    HBond acceptors 5
    Atoms 47
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1156177.