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canSAR398756
FEATURES
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NAMES
    SMILES
    CO[C@@]12[C@H](COC(N)=O)C3=C(C(O)=CC(=N)C3=O)N1C[C@H]1[C@@H]2N1C
    InChI
    InChI=1S/C15H18N4O5/c1-18-8-4-19-11-9(20)3-7(16)12(21)10(11)6(5-24-14(17)22)15(19,23-2)13(8)18/h3,6,8,13,16,20H,4-5H2,1-2H3,(H2,17,22)/t6-,8+,13+,15-,18?/m1/s1
    MOLECULAR FORMULA
    C15H18N4O5
    CROSS REFERENCES
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    canSAR398756

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 334.13
    AlogP -0.65
    HBond donors 4
    HBond acceptors 9
    Atoms 42
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR398756.