canSAR1746712
FEATURES
Loading...
NAMES
    SMILES
    COc1ccc(N(C(=O)c2cc(-c3cc(Cl)ccc3C(=O)N3Cc4ccccc4C[C@H]3CN3CCOCC3)n3c2CCCC3)c2ccc(O)cc2)cc1C(F)(F)F
    InChI
    InChI=1S/C44H42ClF3N4O5/c1-56-41-16-12-32(24-38(41)44(46,47)48)52(31-10-13-34(53)14-11-31)43(55)37-25-40(50-17-5-4-8-39(37)50)36-23-30(45)9-15-35(36)42(54)51-26-29-7-3-2-6-28(29)22-33(51)27-49-18-20-57-21-19-49/h2-3,6-7,9-16,23-25,33,53H,4-5,8,17-22,26-27H2,1H3/t33-/m0/s1
    MOLECULAR FORMULA
    C44H42ClF3N4O5
    CROSS REFERENCES
    Loading...
    canSAR1746712
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight798.28
    AlogP8.76
    HBond donors1
    HBond acceptors9
    Atoms99
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746712.