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canSAR2050189
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NAMES
    SMILES
    COc1cc(OCc2csc(N(C)CCC#N)n2)c2cc(-c3cn4nc(C)ccc4n3)oc2c1
    InChI
    InChI=1S/C24H22N6O3S/c1-15-5-6-23-27-19(12-30(23)28-15)22-11-18-20(9-17(31-3)10-21(18)33-22)32-13-16-14-34-24(26-16)29(2)8-4-7-25/h5-6,9-12,14H,4,8,13H2,1-3H3
    MOLECULAR FORMULA
    C24H22N6O3S
    CROSS REFERENCES
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    canSAR2050189

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 474.15
    AlogP 4.84
    HBond donors 0
    HBond acceptors 9
    Atoms 56
    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 canSAR2050189.