canSAR1632118
FEATURES
Loading...
NAMES
    SMILES
    COc1ccc2c3c1O[C@H]1C[C@@H](O)C=C[C@@]31CCN(C(=O)CCc1cccc(Nc3c(Cl)cccc3Cl)c1)C2
    InChI
    InChI=1S/C31H30Cl2N2O4/c1-38-25-10-9-20-18-35(15-14-31-13-12-22(36)17-26(31)39-30(25)28(20)31)27(37)11-8-19-4-2-5-21(16-19)34-29-23(32)6-3-7-24(29)33/h2-7,9-10,12-13,16,22,26,34,36H,8,11,14-15,17-18H2,1H3/t22-,26-,31-/m0/s1
    MOLECULAR FORMULA
    C31H30Cl2N2O4
    CROSS REFERENCES
    Loading...
    canSAR1632118
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight564.16
    AlogP6.43
    HBond donors2
    HBond acceptors6
    Atoms69
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1632118.