168907 logo
canSAR168907
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COC(=O)C[C@H](O)C[C@H](O)CCn1c(C(C)C)cc(-c2ccc(F)cc2)c1-c1ccc(F)cc1
    InChI
    InChI=1S/C27H31F2NO4/c1-17(2)25-16-24(18-4-8-20(28)9-5-18)27(19-6-10-21(29)11-7-19)30(25)13-12-22(31)14-23(32)15-26(33)34-3/h4-11,16-17,22-23,31-32H,12-15H2,1-3H3/t22-,23-/m1/s1
    MOLECULAR FORMULA
    C27H31F2NO4
    CROSS REFERENCES
    168907 logo

    canSAR168907

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 471.22
    AlogP 5.29
    HBond donors 2
    HBond acceptors 5
    Atoms 65
    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 canSAR168907.