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canSAR785740
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NAMES
    SMILES
    C=CCSc1nnc2c(n1)O[C@@H](c1ccc(OC(C)=O)c(OCC)c1)N(C(C)=O)c1ccccc1-2
    InChI
    InChI=1S/C25H24N4O5S/c1-5-13-35-25-26-23-22(27-28-25)18-9-7-8-10-19(18)29(15(3)30)24(34-23)17-11-12-20(33-16(4)31)21(14-17)32-6-2/h5,7-12,14,24H,1,6,13H2,2-4H3/t24-/m0/s1
    MOLECULAR FORMULA
    C25H24N4O5S
    CROSS REFERENCES
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    canSAR785740

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 492.15
    AlogP 4.58
    HBond donors 0
    HBond acceptors 9
    Atoms 59
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR785740.