canSAR2080324
FEATURES
Loading...
NAMES
    SMILES
    Cc1cnc(Cl)nc1-c1ccc(N(Cc2ccc(CN3CC[C@@H](O)C3)cc2)C(=O)c2ccc(O)cc2O)cc1
    InChI
    InChI=1S/C30H29ClN4O4/c1-19-15-32-30(31)33-28(19)22-6-8-23(9-7-22)35(29(39)26-11-10-24(36)14-27(26)38)17-21-4-2-20(3-5-21)16-34-13-12-25(37)18-34/h2-11,14-15,25,36-38H,12-13,16-18H2,1H3/t25-/m1/s1
    MOLECULAR FORMULA
    C30H29ClN4O4
    CROSS REFERENCES
    Loading...
    canSAR2080324
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight544.19
    AlogP4.93
    HBond donors3
    HBond acceptors8
    Atoms68
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080324.