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canSAR1861622
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NAMES
    SMILES
    CSc1ccc(-c2sc(Nc3cccc4ccccc34)n[n+]2-c2ccccc2)cc1.[Cl-]
    InChI
    InChI=1S/C25H20N3S2.ClH/c1-29-21-16-14-19(15-17-21)24-28(20-10-3-2-4-11-20)27-25(30-24)26-23-13-7-9-18-8-5-6-12-22(18)23;/h2-17H,1H3,(H,26,27);1H/q+1;/p-1
    MOLECULAR FORMULA
    C25H20ClN3S2
    CROSS REFERENCES
    1861622 logo

    canSAR1861622

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 461.08
    AlogP 3.71
    HBond donors 1
    HBond acceptors 3
    Atoms 51
    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 canSAR1861622.