canSAR1746851
FEATURES
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NAMES
    SMILES
    CCCC(=O)Nc1ccc(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])cc1
    InChI
    InChI=1S/C18H18N4O4S/c1-2-5-16(23)19-12-8-10-13(11-9-12)20-18(27)21-17(24)14-6-3-4-7-15(14)22(25)26/h3-4,6-11H,2,5H2,1H3,(H,19,23)(H2,20,21,24,27)
    MOLECULAR FORMULA
    C18H18N4O4S
    CROSS REFERENCES
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    canSAR1746851
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight386.10
    AlogP3.46
    HBond donors3
    HBond acceptors8
    Atoms45
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746851.