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canSAR1591460
FEATURES
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NAMES
    SMILES
    COc1cccc(CNC(=O)CCC2CCCN(C(=O)c3cc4ccccc4o3)C2)c1
    InChI
    InChI=1S/C25H28N2O4/c1-30-21-9-4-6-19(14-21)16-26-24(28)12-11-18-7-5-13-27(17-18)25(29)23-15-20-8-2-3-10-22(20)31-23/h2-4,6,8-10,14-15,18H,5,7,11-13,16-17H2,1H3,(H,26,28)
    MOLECULAR FORMULA
    C25H28N2O4
    CROSS REFERENCES
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    canSAR1591460

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 420.20
    AlogP 4.39
    HBond donors 1
    HBond acceptors 6
    Atoms 59
    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 canSAR1591460.