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canSAR2018122
FEATURES
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NAMES
    SMILES
    CCn1c(CSc2nc3ccccc3s2)nnc1SCC(=O)c1ccc2c(c1)OCCO2
    InChI
    InChI=1S/C22H20N4O3S3/c1-2-26-20(13-31-22-23-15-5-3-4-6-19(15)32-22)24-25-21(26)30-12-16(27)14-7-8-17-18(11-14)29-10-9-28-17/h3-8,11H,2,9-10,12-13H2,1H3
    MOLECULAR FORMULA
    C22H20N4O3S3
    CROSS REFERENCES
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    canSAR2018122

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 484.07
    AlogP 4.95
    HBond donors 0
    HBond acceptors 7
    Atoms 52
    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 canSAR2018122.