672527 logo
canSAR672527
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1cc(OC)c(C(=O)c2cccc(F)c2)c(O)c1CN1CCCC1
    InChI
    InChI=1S/C20H22FNO4/c1-25-16-11-17(26-2)18(19(23)13-6-5-7-14(21)10-13)20(24)15(16)12-22-8-3-4-9-22/h5-7,10-11,24H,3-4,8-9,12H2,1-2H3
    MOLECULAR FORMULA
    C20H22FNO4
    CROSS REFERENCES
    672527 logo

    canSAR672527

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 359.15
    AlogP 3.38
    HBond donors 1
    HBond acceptors 5
    Atoms 48
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR672527.