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canSAR1130674
FEATURES
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NAMES
    SMILES
    CC(F)(F)F.Cc1cc(=O)oc2cc(OC3(C(=O)O)C[C@H](O)[C@@H](NC(=O)CO)[C@H]([C@H](O)[C@H](O)CO)O3)ccc12
    InChI
    InChI=1S/C21H25NO12.C2H3F3/c1-9-4-16(28)32-14-5-10(2-3-11(9)14)33-21(20(30)31)6-12(25)17(22-15(27)8-24)19(34-21)18(29)13(26)7-23;1-2(3,4)5/h2-5,12-13,17-19,23-26,29H,6-8H2,1H3,(H,22,27)(H,30,31);1H3/t12-,13+,17+,18+,19+,21?;/m0./s1
    MOLECULAR FORMULA
    C23H28F3NO12
    CROSS REFERENCES
    1130674 logo

    canSAR1130674

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 567.16
    AlogP -0.83
    HBond donors 7
    HBond acceptors 13
    Atoms 67
    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 canSAR1130674.