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canSAR1999654
FEATURES
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NAMES
    SMILES
    CCOc1ccc(NC(=O)CSc2nnc(COc3c(C)cccc3C)o2)cc1
    InChI
    InChI=1S/C21H23N3O4S/c1-4-26-17-10-8-16(9-11-17)22-18(25)13-29-21-24-23-19(28-21)12-27-20-14(2)6-5-7-15(20)3/h5-11H,4,12-13H2,1-3H3,(H,22,25)
    MOLECULAR FORMULA
    C21H23N3O4S
    CROSS REFERENCES
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    canSAR1999654

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 413.14
    AlogP 4.39
    HBond donors 1
    HBond acceptors 7
    Atoms 52
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1999654.