canSAR1220216
FEATURES
Loading...
NAMES
    SMILES
    CCCCCCCCCCCCCCCCNC(=O)[C@@H](NCCCNC(=O)[C@@H](N)CCCNC(=N)N)[C@H](O[C@@H]1O[C@H](CN)[C@@H](O)[C@H]1O)[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1O
    InChI
    InChI=1S/C41H76N10O11/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-48-37(58)29(46-22-17-23-47-36(57)26(43)18-16-21-49-40(44)45)34(62-39-33(56)30(53)27(25-42)60-39)35-31(54)32(55)38(61-35)51-24-19-28(52)50-41(51)59/h19,24,26-27,29-35,38-39,46,53-56H,2-18,20-23,25,42-43H2,1H3,(H,47,57)(H,48,58)(H4,44,45,49)(H,50,52,59)/t26-,27+,29-,30+,31-,32+,33+,34-,35-,38+,39-/m0/s1
    MOLECULAR FORMULA
    C41H76N10O11
    CROSS REFERENCES
    Loading...
    canSAR1220216
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight884.57
    AlogP-1.40
    HBond donors16
    HBond acceptors21
    Atoms138
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1220216.