canSAR637320
FEATURES
Loading...
NAMES
    SMILES
    NC(=O)CNC(=O)C1CCCN1C(=O)C1CCCCNOC(=O)CC[C@@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)NC(Cc2c[nH]c3ccccc23)C(=O)N1
    InChI
    InChI=1S/C44H50N8O9/c45-38(53)24-47-42(57)37-17-9-21-52(37)43(58)35-16-7-8-20-48-61-39(54)19-18-34(40(55)50-36(41(56)49-35)22-26-23-46-33-15-6-5-10-27(26)33)51-44(59)60-25-32-30-13-3-1-11-28(30)29-12-2-4-14-31(29)32/h1-6,10-15,23,32,34-37,46,48H,7-9,16-22,24-25H2,(H2,45,53)(H,47,57)(H,49,56)(H,50,55)(H,51,59)/t34-,35?,36?,37?/m1/s1
    MOLECULAR FORMULA
    C44H50N8O9
    CROSS REFERENCES
    Loading...
    canSAR637320
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight834.37
    AlogP2.19
    HBond donors8
    HBond acceptors17
    Atoms111
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR637320.