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canSAR1862457
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NAMES
    SMILES
    O=C1N=C(S)SC1=Cc1cc(-c2coc3ccccc23)ccc1OCc1ccccc1
    InChI
    InChI=1S/C25H17NO3S2/c27-24-23(31-25(30)26-24)13-18-12-17(20-15-29-22-9-5-4-8-19(20)22)10-11-21(18)28-14-16-6-2-1-3-7-16/h1-13,15H,14H2,(H,26,27,30)
    MOLECULAR FORMULA
    C25H17NO3S2
    CROSS REFERENCES
    1862457 logo

    canSAR1862457

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 443.06
    AlogP 6.58
    HBond donors 0
    HBond acceptors 4
    Atoms 48
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1862457.