canSAR1386743
FEATURES
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NAMES
    SMILES
    CC(C)n1c(/C=C/[C@@H](O)C(F)(F)[C@@H](O)CC(=O)[O-])c(-c2ccc(F)cc2)c2ccccc21.[Na+]
    InChI
    InChI=1S/C24H24F3NO4.Na/c1-14(2)28-18-6-4-3-5-17(18)23(15-7-9-16(25)10-8-15)19(28)11-12-20(29)24(26,27)21(30)13-22(31)32;/h3-12,14,20-21,29-30H,13H2,1-2H3,(H,31,32);/q;+1/p-1/b12-11+;/t20-,21+;/m1./s1
    MOLECULAR FORMULA
    C24H23F3NNaO4
    CROSS REFERENCES
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    canSAR1386743
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight469.15
    AlogP0.54
    HBond donors2
    HBond acceptors5
    Atoms56
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1386743.