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canSAR1721356
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NAMES
    SMILES
    CN1C(=O)c2ccccc2[S+]([O-])c2ccc(C(=O)NCCc3cccs3)cc21
    InChI
    InChI=1S/C21H18N2O3S2/c1-23-17-13-14(20(24)22-11-10-15-5-4-12-27-15)8-9-19(17)28(26)18-7-3-2-6-16(18)21(23)25/h2-9,12-13H,10-11H2,1H3,(H,22,24)
    MOLECULAR FORMULA
    C21H18N2O3S2
    CROSS REFERENCES
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    canSAR1721356

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 410.08
    AlogP 3.48
    HBond donors 1
    HBond acceptors 5
    Atoms 46
    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 canSAR1721356.