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canSAR1991283
FEATURES
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NAMES
    SMILES
    COc1ccc(CCNC(=O)c2ccc(NC3=NC4CS(=O)(=O)CC4S3)cc2)cc1OC
    InChI
    InChI=1S/C22H25N3O5S2/c1-29-18-8-3-14(11-19(18)30-2)9-10-23-21(26)15-4-6-16(7-5-15)24-22-25-17-12-32(27,28)13-20(17)31-22/h3-8,11,17,20H,9-10,12-13H2,1-2H3,(H,23,26)(H,24,25)
    MOLECULAR FORMULA
    C22H25N3O5S2
    CROSS REFERENCES
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    canSAR1991283

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 475.12
    AlogP 2.36
    HBond donors 2
    HBond acceptors 8
    Atoms 57
    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 canSAR1991283.