canSAR2079825
FEATURES
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NAMES
    SMILES
    COc1cccc(NC(=O)c2nnc(COc3ccc(CCC(=O)O)cc3)s2)c1
    InChI
    InChI=1S/C20H19N3O5S/c1-27-16-4-2-3-14(11-16)21-19(26)20-23-22-17(29-20)12-28-15-8-5-13(6-9-15)7-10-18(24)25/h2-6,8-9,11H,7,10,12H2,1H3,(H,21,26)(H,24,25)
    MOLECULAR FORMULA
    C20H19N3O5S
    CROSS REFERENCES
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    canSAR2079825
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight413.10
    AlogP3.40
    HBond donors2
    HBond acceptors8
    Atoms48
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2079825.