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canSAR1017809
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NAMES
    SMILES
    COc1cc(C(=O)NC(=S)Nc2cccc(NC(=O)c3ccccc3)c2C)cc(OC)c1OC
    InChI
    InChI=1S/C25H25N3O5S/c1-15-18(26-23(29)16-9-6-5-7-10-16)11-8-12-19(15)27-25(34)28-24(30)17-13-20(31-2)22(33-4)21(14-17)32-3/h5-14H,1-4H3,(H,26,29)(H2,27,28,30,34)
    MOLECULAR FORMULA
    C25H25N3O5S
    CROSS REFERENCES
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    canSAR1017809

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 479.15
    AlogP 4.40
    HBond donors 3
    HBond acceptors 8
    Atoms 59
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1017809.