504035 logo
canSAR504035
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(Nc1ccc(C[C@H](NC(=O)C2(CCN3CCOCC3)CCCC2)C(=O)O)cc1)c1c(Cl)cccc1Cl
    InChI
    InChI=1S/C28H33Cl2N3O5/c29-21-4-3-5-22(30)24(21)25(34)31-20-8-6-19(7-9-20)18-23(26(35)36)32-27(37)28(10-1-2-11-28)12-13-33-14-16-38-17-15-33/h3-9,23H,1-2,10-18H2,(H,31,34)(H,32,37)(H,35,36)/t23-/m0/s1
    MOLECULAR FORMULA
    C28H33Cl2N3O5
    CROSS REFERENCES
    504035 logo

    canSAR504035

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 561.18
    AlogP 4.64
    HBond donors 3
    HBond acceptors 8
    Atoms 71
    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 canSAR504035.