canSAR823946
FEATURES
Loading...
NAMES
    SMILES
    O=C(CN(c1nc(Cl)nc2c1ncn2C1CCCCO1)C1CC1)N[C@@H](CCC(=O)OCc1ccccc1)C(=O)OCc1ccccc1
    InChI
    InChI=1S/C34H37ClN6O6/c35-34-38-31(30-32(39-34)41(22-36-30)28-13-7-8-18-45-28)40(25-14-15-25)19-27(42)37-26(33(44)47-21-24-11-5-2-6-12-24)16-17-29(43)46-20-23-9-3-1-4-10-23/h1-6,9-12,22,25-26,28H,7-8,13-21H2,(H,37,42)/t26-,28?/m0/s1
    MOLECULAR FORMULA
    C34H37ClN6O6
    CROSS REFERENCES
    Loading...
    canSAR823946
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight660.25
    AlogP4.90
    HBond donors1
    HBond acceptors12
    Atoms84
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR823946.