canSAR1846343
FEATURES
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NAMES
    SMILES
    C=Cn1cc(CNC[C@H]2O[C@@H](n3cnc4c(O)nc(N)nc43)[C@H](O)[C@@H]2O)c(C)n1
    InChI
    InChI=1S/C17H22N8O4/c1-3-24-6-9(8(2)23-24)4-19-5-10-12(26)13(27)16(29-10)25-7-20-11-14(25)21-17(18)22-15(11)28/h3,6-7,10,12-13,16,19,26-27H,1,4-5H2,2H3,(H3,18,21,22,28)/t10-,12-,13-,16-/m1/s1
    MOLECULAR FORMULA
    C17H22N8O4
    CROSS REFERENCES
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    canSAR1846343
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight402.18
    AlogP-0.87
    HBond donors6
    HBond acceptors12
    Atoms51
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1846343.