847396 logo
canSAR847396
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    C[C@@H]1CCC[C@@H]2C[C@@H](NC(=O)c3cc(C(F)(F)F)ccc3O)CCN12
    InChI
    InChI=1S/C18H23F3N2O2/c1-11-3-2-4-14-10-13(7-8-23(11)14)22-17(25)15-9-12(18(19,20)21)5-6-16(15)24/h5-6,9,11,13-14,24H,2-4,7-8,10H2,1H3,(H,22,25)/t11-,13+,14-/m1/s1
    MOLECULAR FORMULA
    C18H23F3N2O2
    CROSS REFERENCES
    847396 logo

    canSAR847396

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 356.17
    AlogP 3.55
    HBond donors 2
    HBond acceptors 4
    Atoms 48
    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 canSAR847396.