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canSAR1716164
FEATURES
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NAMES
    SMILES
    COc1ccc(C(=O)C2CCCN(C(=O)/C=C/c3c[nH]cn3)C2)c(C)c1
    InChI
    InChI=1S/C20H23N3O3/c1-14-10-17(26-2)6-7-18(14)20(25)15-4-3-9-23(12-15)19(24)8-5-16-11-21-13-22-16/h5-8,10-11,13,15H,3-4,9,12H2,1-2H3,(H,21,22)/b8-5+
    MOLECULAR FORMULA
    C20H23N3O3
    CROSS REFERENCES
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    canSAR1716164

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 353.17
    AlogP 2.86
    HBond donors 1
    HBond acceptors 6
    Atoms 49
    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 canSAR1716164.