canSAR1529495
FEATURES
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NAMES
    SMILES
    COC(=O)C1CCN(Cc2cc(=O)oc3cc(C)c(Cl)cc23)CC1
    InChI
    InChI=1S/C18H20ClNO4/c1-11-7-16-14(9-15(11)19)13(8-17(21)24-16)10-20-5-3-12(4-6-20)18(22)23-2/h7-9,12H,3-6,10H2,1-2H3
    MOLECULAR FORMULA
    C18H20ClNO4
    CROSS REFERENCES
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    canSAR1529495
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight349.11
    AlogP3.14
    HBond donors0
    HBond acceptors5
    Atoms44
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1529495.