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canSAR2086156
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NAMES
    SMILES
    Nc1ncc(-c2cc(N3C[C@@H]4C[C@H]3CO4)nc(N3C[C@@H]4C[C@H]3CO4)n2)cn1
    InChI
    InChI=1S/C18H21N7O2/c19-17-20-4-10(5-21-17)15-3-16(24-6-13-1-11(24)8-26-13)23-18(22-15)25-7-14-2-12(25)9-27-14/h3-5,11-14H,1-2,6-9H2,(H2,19,20,21)/t11-,12-,13-,14-/m0/s1
    MOLECULAR FORMULA
    C18H21N7O2
    CROSS REFERENCES
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    canSAR2086156

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 367.18
    AlogP 0.47
    HBond donors 2
    HBond acceptors 9
    Atoms 48
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2086156.