canSAR541890
FEATURES
Loading...
NAMES
    SMILES
    CC(C)(CN1C(=O)c2cccc3ccc([N+](=O)[O-])c(c23)C1=O)C[N+](C)(C)CCCCCC[N+](C)(C)CCCN1C(=O)c2ccccc2C1=O.[Br-].[Br-]
    InChI
    InChI=1S/C38H49N5O6.2BrH/c1-38(2,25-40-36(46)30-18-13-15-27-19-20-31(41(48)49)33(32(27)30)37(40)47)26-43(5,6)23-12-8-7-11-22-42(3,4)24-14-21-39-34(44)28-16-9-10-17-29(28)35(39)45;;/h9-10,13,15-20H,7-8,11-12,14,21-26H2,1-6H3;2*1H/q+2;;/p-2
    MOLECULAR FORMULA
    C38H49Br2N5O6
    CROSS REFERENCES
    Loading...
    canSAR541890
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight829.20
    AlogP-0.22
    HBond donors0
    HBond acceptors11
    Atoms100
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR541890.