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canSAR2021762
FEATURES
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NAMES
    SMILES
    COc1ccc(CCNC(=O)c2cc(-c3ccccc3O)[nH]n2)cc1OC
    InChI
    InChI=1S/C20H21N3O4/c1-26-18-8-7-13(11-19(18)27-2)9-10-21-20(25)16-12-15(22-23-16)14-5-3-4-6-17(14)24/h3-8,11-12,24H,9-10H2,1-2H3,(H,21,25)(H,22,23)
    MOLECULAR FORMULA
    C20H21N3O4
    CROSS REFERENCES
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    canSAR2021762

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 367.15
    AlogP 2.77
    HBond donors 3
    HBond acceptors 7
    Atoms 48
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2021762.