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canSAR1722889
FEATURES
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NAMES
    SMILES
    COc1ccc(C(CNC(=O)c2ccc(OCC3CCCO3)cc2)N2CCOCC2)cc1
    InChI
    InChI=1S/C25H32N2O5/c1-29-21-8-4-19(5-9-21)24(27-12-15-30-16-13-27)17-26-25(28)20-6-10-22(11-7-20)32-18-23-3-2-14-31-23/h4-11,23-24H,2-3,12-18H2,1H3,(H,26,28)
    MOLECULAR FORMULA
    C25H32N2O5
    CROSS REFERENCES
    1722889 logo

    canSAR1722889

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 440.23
    AlogP 3.06
    HBond donors 1
    HBond acceptors 7
    Atoms 64
    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 canSAR1722889.