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canSAR50035
FEATURES
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NAMES
    SMILES
    CN1CCN(C(=S)Nc2sc3c(c2C(=O)O)CCCC3)CC1
    InChI
    InChI=1S/C15H21N3O2S2/c1-17-6-8-18(9-7-17)15(21)16-13-12(14(19)20)10-4-2-3-5-11(10)22-13/h2-9H2,1H3,(H,16,21)(H,19,20)
    MOLECULAR FORMULA
    C15H21N3O2S2
    CROSS REFERENCES
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    canSAR50035

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 339.11
    AlogP 2.27
    HBond donors 2
    HBond acceptors 5
    Atoms 43
    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 canSAR50035.