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canSAR989671
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NAMES
    SMILES
    COc1ccc2nc(-c3ccc(OCC(O)CNC(C)C)cc3)n(C)c(=O)c2c1
    InChI
    InChI=1S/C22H27N3O4/c1-14(2)23-12-16(26)13-29-17-7-5-15(6-8-17)21-24-20-10-9-18(28-4)11-19(20)22(27)25(21)3/h5-11,14,16,23,26H,12-13H2,1-4H3
    MOLECULAR FORMULA
    C22H27N3O4
    CROSS REFERENCES
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    canSAR989671

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 397.20
    AlogP 2.35
    HBond donors 2
    HBond acceptors 7
    Atoms 56
    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 canSAR989671.