1593683 logo
canSAR1593683
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(C)(C)n1cc(-c2cc(CO)c3c(c2)C(O)(C(F)(F)F)c2ccccc2-3)cn1
    InChI
    InChI=1S/C22H21F3N2O2/c1-20(2,3)27-11-15(10-26-27)13-8-14(12-28)19-16-6-4-5-7-17(16)21(29,18(19)9-13)22(23,24)25/h4-11,28-29H,12H2,1-3H3
    MOLECULAR FORMULA
    C22H21F3N2O2
    CROSS REFERENCES
    1593683 logo

    canSAR1593683

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 402.16
    AlogP 4.58
    HBond donors 2
    HBond acceptors 4
    Atoms 50
    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 canSAR1593683.