650229 logo
canSAR650229
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(C)(C)CCC(CCC(F)(F)F)N1CCC(F)(F)[C@H](CC(=O)O)[C@H]1c1ccc(C(F)(F)F)cc1
    InChI
    InChI=1S/C24H31F8NO2/c1-21(2,3)10-8-17(9-11-23(27,28)29)33-13-12-22(25,26)18(14-19(34)35)20(33)15-4-6-16(7-5-15)24(30,31)32/h4-7,17-18,20H,8-14H2,1-3H3,(H,34,35)/t17?,18-,20-/m1/s1
    MOLECULAR FORMULA
    C24H31F8NO2
    CROSS REFERENCES
    650229 logo

    canSAR650229

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 517.22
    AlogP 7.72
    HBond donors 1
    HBond acceptors 3
    Atoms 66
    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 canSAR650229.