canSAR2222461
FEATURES
Loading...
NAMES
    SMILES
    NC(=O)C12CC3CC(C1)C(OC(=O)N1CC[C@@H](n4c(=O)[nH]c5cccc(Cl)c54)C1)C(C3)C2
    InChI
    InChI=1S/C23H27ClN4O4/c24-16-2-1-3-17-18(16)28(21(30)26-17)15-4-5-27(11-15)22(31)32-19-13-6-12-7-14(19)10-23(8-12,9-13)20(25)29/h1-3,12-15,19H,4-11H2,(H2,25,29)(H,26,30)/t12?,13?,14?,15-,19-,23-/m1/s1
    MOLECULAR FORMULA
    C23H27ClN4O4
    CROSS REFERENCES
    Loading...
    canSAR2222461
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight458.17
    AlogP3.05
    HBond donors3
    HBond acceptors8
    Atoms59
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2222461.