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canSAR2089285
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NAMES
    SMILES
    COc1cccc([C@H](C)Nc2cc(-c3ccc4c(c3)OCO4)nc(C)n2)c1
    InChI
    InChI=1S/C21H21N3O3/c1-13(15-5-4-6-17(9-15)25-3)22-21-11-18(23-14(2)24-21)16-7-8-19-20(10-16)27-12-26-19/h4-11,13H,12H2,1-3H3,(H,22,23,24)/t13-/m0/s1
    MOLECULAR FORMULA
    C21H21N3O3
    CROSS REFERENCES
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    canSAR2089285

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 363.16
    AlogP 4.36
    HBond donors 1
    HBond acceptors 6
    Atoms 48
    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 canSAR2089285.