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canSAR1634427
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NAMES
    SMILES
    CCc1c(O)n(-c2ccccc2)c(SCC(=O)Nc2nc3ccccc3s2)nc1=O
    InChI
    InChI=1S/C21H18N4O3S2/c1-2-14-18(27)24-21(25(19(14)28)13-8-4-3-5-9-13)29-12-17(26)23-20-22-15-10-6-7-11-16(15)30-20/h3-11,28H,2,12H2,1H3,(H,22,23,26)
    MOLECULAR FORMULA
    C21H18N4O3S2
    CROSS REFERENCES
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    canSAR1634427

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 438.08
    AlogP 3.84
    HBond donors 2
    HBond acceptors 7
    Atoms 48
    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 canSAR1634427.