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canSAR1062093
FEATURES
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NAMES
    SMILES
    Cc1cc(=O)c(C(=O)NC23CC4CC(CC(C4)C2)C3)cn1CC1OCCO1
    InChI
    InChI=1S/C21H28N2O4/c1-13-4-18(24)17(11-23(13)12-19-26-2-3-27-19)20(25)22-21-8-14-5-15(9-21)7-16(6-14)10-21/h4,11,14-16,19H,2-3,5-10,12H2,1H3,(H,22,25)
    MOLECULAR FORMULA
    C21H28N2O4
    CROSS REFERENCES
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    canSAR1062093

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 372.20
    AlogP 2.23
    HBond donors 1
    HBond acceptors 6
    Atoms 55
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1062093.