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canSAR1769253
FEATURES
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NAMES
    SMILES
    COCCN=C(S)N1CCC(C(=O)c2ccc3c(c2)OCCO3)CC1
    InChI
    InChI=1S/C18H24N2O4S/c1-22-9-6-19-18(25)20-7-4-13(5-8-20)17(21)14-2-3-15-16(12-14)24-11-10-23-15/h2-3,12-13H,4-11H2,1H3,(H,19,25)
    MOLECULAR FORMULA
    C18H24N2O4S
    CROSS REFERENCES
    1769253 logo

    canSAR1769253

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 364.15
    AlogP 2.28
    HBond donors 0
    HBond acceptors 6
    Atoms 49
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1769253.