canSAR1831644
FEATURES
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NAMES
    SMILES
    CCCNC(=O)c1sc2c(c1C(=O)Nc1ccccn1)CCCC2
    InChI
    InChI=1S/C18H21N3O2S/c1-2-10-20-18(23)16-15(12-7-3-4-8-13(12)24-16)17(22)21-14-9-5-6-11-19-14/h5-6,9,11H,2-4,7-8,10H2,1H3,(H,20,23)(H,19,21,22)
    MOLECULAR FORMULA
    C18H21N3O2S
    CROSS REFERENCES
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    canSAR1831644
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight343.14
    AlogP3.41
    HBond donors2
    HBond acceptors5
    Atoms45
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1831644.