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canSAR551814
FEATURES
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NAMES
    SMILES
    Cc1cc(C(c2ccc(F)c(C)c2)c2cc(Cl)cc(Cl)c2OCC(O)C[C@@H](O)CC(=O)[O-])ccc1F
    InChI
    InChI=1S/C27H26Cl2F2O5/c1-14-7-16(3-5-23(14)30)26(17-4-6-24(31)15(2)8-17)21-9-18(28)10-22(29)27(21)36-13-20(33)11-19(32)12-25(34)35/h3-10,19-20,26,32-33H,11-13H2,1-2H3,(H,34,35)/p-1/t19-,20?/m1/s1
    MOLECULAR FORMULA
    C27H25Cl2F2O5-
    CROSS REFERENCES
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    canSAR551814

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 537.11
    AlogP 4.70
    HBond donors 2
    HBond acceptors 5
    Atoms 61
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR551814.