canSAR1810408
FEATURES
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NAMES
    SMILES
    C[C@@H]1CC[C@@H](Oc2nccc(C(C)(C)O)c2F)CN1C(=O)c1ccccc1-n1ncnn1
    InChI
    InChI=1S/C22H25FN6O3/c1-14-8-9-15(32-20-19(23)17(10-11-24-20)22(2,3)31)12-28(14)21(30)16-6-4-5-7-18(16)29-26-13-25-27-29/h4-7,10-11,13-15,31H,8-9,12H2,1-3H3/t14-,15-/m1/s1
    MOLECULAR FORMULA
    C22H25FN6O3
    CROSS REFERENCES
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    canSAR1810408
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight440.20
    AlogP2.50
    HBond donors1
    HBond acceptors9
    Atoms57
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1810408.