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canSAR2000372
FEATURES
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NAMES
    SMILES
    CCOC(=O)c1c(N)sc2c1CCN(CCc1ccccc1)C2
    InChI
    InChI=1S/C18H22N2O2S/c1-2-22-18(21)16-14-9-11-20(12-15(14)23-17(16)19)10-8-13-6-4-3-5-7-13/h3-7H,2,8-12,19H2,1H3
    MOLECULAR FORMULA
    C18H22N2O2S
    CROSS REFERENCES
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    canSAR2000372

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 330.14
    AlogP 3.11
    HBond donors 2
    HBond acceptors 4
    Atoms 45
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2000372.