canSAR2096306
FEATURES
Loading...
NAMES
    SMILES
    CC(COC(=O)c1ccc(Oc2nc(Oc3ccc(C(=O)OCC(C)N(C)C)cc3)nc(Oc3ccc(C(=O)OCC(C)N(C)C)cc3)n2)cc1)N(C)C
    InChI
    InChI=1S/C39H48N6O9/c1-25(43(4)5)22-49-34(46)28-10-16-31(17-11-28)52-37-40-38(53-32-18-12-29(13-19-32)35(47)50-23-26(2)44(6)7)42-39(41-37)54-33-20-14-30(15-21-33)36(48)51-24-27(3)45(8)9/h10-21,25-27H,22-24H2,1-9H3
    MOLECULAR FORMULA
    C39H48N6O9
    CROSS REFERENCES
    Loading...
    canSAR2096306
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight744.35
    AlogP5.57
    HBond donors0
    HBond acceptors15
    Atoms102
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2096306.