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canSAR1442098
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NAMES
    SMILES
    O=C(CSc1ncnc2c1nnn2Cc1ccccc1F)N1CCN(c2ccccc2)CC1
    InChI
    InChI=1S/C23H22FN7OS/c24-19-9-5-4-6-17(19)14-31-22-21(27-28-31)23(26-16-25-22)33-15-20(32)30-12-10-29(11-13-30)18-7-2-1-3-8-18/h1-9,16H,10-15H2
    MOLECULAR FORMULA
    C23H22FN7OS
    CROSS REFERENCES
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    canSAR1442098

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 463.16
    AlogP 2.85
    HBond donors 0
    HBond acceptors 8
    Atoms 55
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1442098.