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canSAR2021085
FEATURES
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NAMES
    SMILES
    COc1ccc(NC(=O)CSc2ccc3nnc(CCNC(=O)c4ccccc4)n3n2)cc1OC
    InChI
    InChI=1S/C24H24N6O4S/c1-33-18-9-8-17(14-19(18)34-2)26-22(31)15-35-23-11-10-20-27-28-21(30(20)29-23)12-13-25-24(32)16-6-4-3-5-7-16/h3-11,14H,12-13,15H2,1-2H3,(H,25,32)(H,26,31)
    MOLECULAR FORMULA
    C24H24N6O4S
    CROSS REFERENCES
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    canSAR2021085

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 492.16
    AlogP 2.84
    HBond donors 2
    HBond acceptors 10
    Atoms 59
    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 canSAR2021085.