canSAR541591
FEATURES
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NAMES
    SMILES
    COc1cc(C/C(C(=O)c2ccc(OC(F)F)cc2)=C(/C(=O)[O-])c2ccc3nsnc3c2)cc(OC)c1OC
    InChI
    InChI=1S/C27H22F2N2O7S/c1-35-21-11-14(12-22(36-2)25(21)37-3)10-18(24(32)15-4-7-17(8-5-15)38-27(28)29)23(26(33)34)16-6-9-19-20(13-16)31-39-30-19/h4-9,11-13,27H,10H2,1-3H3,(H,33,34)/p-1/b23-18-
    MOLECULAR FORMULA
    C27H21F2N2O7S-
    CROSS REFERENCES
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    canSAR541591
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight555.10
    AlogP3.95
    HBond donors0
    HBond acceptors9
    Atoms60
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR541591.