canSAR856957
FEATURES
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NAMES
    SMILES
    CN(Cc1ccccc1)C[C@H](O[C@@H]1O[C@H](CN)[C@@H](O)[C@H]1O)[C@@H]1C[C@@H](O)[C@H](n2ccc(=O)[nH]c2=O)O1.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C23H32N4O8.C2HF3O2/c1-26(11-13-5-3-2-4-6-13)12-17(35-22-20(31)19(30)16(10-24)34-22)15-9-14(28)21(33-15)27-8-7-18(29)25-23(27)32;3-2(4,5)1(6)7/h2-8,14-17,19-22,28,30-31H,9-12,24H2,1H3,(H,25,29,32);(H,6,7)/t14-,15+,16-,17+,19-,20-,21-,22+;/m1./s1
    MOLECULAR FORMULA
    C25H33F3N4O10
    CROSS REFERENCES
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    canSAR856957
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight606.21
    AlogP-1.26
    HBond donors7
    HBond acceptors14
    Atoms75
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR856957.