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canSAR1829792
FEATURES
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NAMES
    SMILES
    Cl.O.O=C(O)/C=C/c1ccc(Cn2ccnc2)cc1
    InChI
    InChI=1S/C13H12N2O2.ClH.H2O/c16-13(17)6-5-11-1-3-12(4-2-11)9-15-8-7-14-10-15;;/h1-8,10H,9H2,(H,16,17);1H;1H2/b6-5+;;
    MOLECULAR FORMULA
    C13H15ClN2O3
    CROSS REFERENCES
    1829792 logo

    canSAR1829792

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 282.08
    AlogP 1.63
    HBond donors 3
    HBond acceptors 5
    Atoms 34
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1829792.