canSAR1846832
FEATURES
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NAMES
    SMILES
    CCOCCCn1c(=S)[nH]c2cc(C(=O)NCCc3ccccc3)ccc2c1=O
    InChI
    InChI=1S/C22H25N3O3S/c1-2-28-14-6-13-25-21(27)18-10-9-17(15-19(18)24-22(25)29)20(26)23-12-11-16-7-4-3-5-8-16/h3-5,7-10,15H,2,6,11-14H2,1H3,(H,23,26)(H,24,29)
    MOLECULAR FORMULA
    C22H25N3O3S
    CROSS REFERENCES
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    canSAR1846832
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight411.16
    AlogP3.46
    HBond donors2
    HBond acceptors6
    Atoms54
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1846832.