canSAR2176663
FEATURES
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NAMES
    SMILES
    C[C@@H](Nc1ncnc2[nH]c(-c3ccc(CNCC(=O)NO)cc3)cc12)c1ccccc1
    InChI
    InChI=1S/C23H24N6O2/c1-15(17-5-3-2-4-6-17)27-22-19-11-20(28-23(19)26-14-25-22)18-9-7-16(8-10-18)12-24-13-21(30)29-31/h2-11,14-15,24,31H,12-13H2,1H3,(H,29,30)(H2,25,26,27,28)/t15-/m1/s1
    MOLECULAR FORMULA
    C23H24N6O2
    CROSS REFERENCES
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    canSAR2176663
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight416.20
    AlogP3.39
    HBond donors5
    HBond acceptors8
    Atoms55
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2176663.