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canSAR1129750
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NAMES
    SMILES
    O=C(O)c1ccc(NC(=O)c2cc3c4c(c2)CCCC4CCC3)cc1
    InChI
    InChI=1S/C21H21NO3/c23-20(22-18-9-7-14(8-10-18)21(24)25)17-11-15-5-1-3-13-4-2-6-16(12-17)19(13)15/h7-13H,1-6H2,(H,22,23)(H,24,25)
    MOLECULAR FORMULA
    C21H21NO3
    CROSS REFERENCES
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    canSAR1129750

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 335.15
    AlogP 4.39
    HBond donors 2
    HBond acceptors 4
    Atoms 46
    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 canSAR1129750.