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canSAR1587549
FEATURES
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NAMES
    SMILES
    CCc1nccn1CC(=O)c1ccc(O)c(O)c1.Cl
    InChI
    InChI=1S/C13H14N2O3.ClH/c1-2-13-14-5-6-15(13)8-12(18)9-3-4-10(16)11(17)7-9;/h3-7,16-17H,2,8H2,1H3;1H
    MOLECULAR FORMULA
    C13H15ClN2O3
    CROSS REFERENCES
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    canSAR1587549

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 282.08
    AlogP 2.16
    HBond donors 2
    HBond acceptors 5
    Atoms 34
    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 canSAR1587549.