canSAR2194784
FEATURES
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NAMES
    SMILES
    CC(C)(C)COP1(=O)OC[C@H]2O[C@@H](c3ccc4c(N)ncnn34)[C@](C)(N)[C@@H]2O1
    InChI
    InChI=1S/C17H26N5O5P/c1-16(2,3)8-25-28(23)24-7-12-14(27-28)17(4,19)13(26-12)10-5-6-11-15(18)20-9-21-22(10)11/h5-6,9,12-14H,7-8,19H2,1-4H3,(H2,18,20,21)/t12-,13+,14-,17+,28?/m1/s1
    MOLECULAR FORMULA
    C17H26N5O5P
    CROSS REFERENCES
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    canSAR2194784
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight411.17
    AlogP2.06
    HBond donors4
    HBond acceptors10
    Atoms54
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2194784.