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canSAR1635888
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NAMES
    SMILES
    O=C(c1ccc2c(c1)CCCC2)N1CCN(c2nc3c(F)cccc3s2)CC1
    InChI
    InChI=1S/C22H22FN3OS/c23-18-6-3-7-19-20(18)24-22(28-19)26-12-10-25(11-13-26)21(27)17-9-8-15-4-1-2-5-16(15)14-17/h3,6-9,14H,1-2,4-5,10-13H2
    MOLECULAR FORMULA
    C22H22FN3OS
    CROSS REFERENCES
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    canSAR1635888

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 395.15
    AlogP 4.28
    HBond donors 0
    HBond acceptors 4
    Atoms 50
    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 canSAR1635888.