2085860 logo
canSAR2085860
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(C)CN1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CCCC2)C1.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C15H26N2O2.C2HF3O2/c1-11(2)8-16-9-12-7-13(14(10-16)19-12)15(18)17-5-3-4-6-17;3-2(4,5)1(6)7/h11-14H,3-10H2,1-2H3;(H,6,7)/t12-,13+,14-;/m1./s1
    MOLECULAR FORMULA
    C17H27F3N2O4
    CROSS REFERENCES
    2085860 logo

    canSAR2085860

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 380.19
    AlogP 1.99
    HBond donors 1
    HBond acceptors 6
    Atoms 53
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2085860.