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canSAR2092024
FEATURES
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NAMES
    SMILES
    OC[C@H]1O[C@@]2(CC(c3c[nH]c4ccccc34)=NO2)[C@H](O)[C@@H](O)[C@@H]1O
    InChI
    InChI=1S/C16H18N2O6/c19-7-12-13(20)14(21)15(22)16(23-12)5-11(18-24-16)9-6-17-10-4-2-1-3-8(9)10/h1-4,6,12-15,17,19-22H,5,7H2/t12-,13-,14+,15-,16-/m1/s1
    MOLECULAR FORMULA
    C16H18N2O6
    CROSS REFERENCES
    2092024 logo

    canSAR2092024

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 334.12
    AlogP -0.54
    HBond donors 5
    HBond acceptors 8
    Atoms 42
    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 canSAR2092024.