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canSAR499449
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NAMES
    SMILES
    CSc1nc(-c2ccc(F)cc2)c(-c2ccnc(OC(C)c3ccccc3)c2)[nH]1
    InChI
    InChI=1S/C23H20FN3OS/c1-15(16-6-4-3-5-7-16)28-20-14-18(12-13-25-20)22-21(26-23(27-22)29-2)17-8-10-19(24)11-9-17/h3-15H,1-2H3,(H,26,27)
    MOLECULAR FORMULA
    C23H20FN3OS
    CROSS REFERENCES
    499449 logo

    canSAR499449

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 405.13
    AlogP 6.14
    HBond donors 1
    HBond acceptors 4
    Atoms 49
    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 canSAR499449.