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canSAR465082
FEATURES
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NAMES
    SMILES
    COc1ccc(-c2c[nH]c3c2C2=NCCc4cn(S(=O)(=O)c5ccc(C)cc5)c(c42)C3=O)cc1
    InChI
    InChI=1S/C26H21N3O4S/c1-15-3-9-19(10-4-15)34(31,32)29-14-17-11-12-27-23-21(17)25(29)26(30)24-22(23)20(13-28-24)16-5-7-18(33-2)8-6-16/h3-10,13-14,28H,11-12H2,1-2H3
    MOLECULAR FORMULA
    C26H21N3O4S
    CROSS REFERENCES
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    canSAR465082

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 471.13
    AlogP 3.98
    HBond donors 1
    HBond acceptors 7
    Atoms 55
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR465082.