canSAR1601630
FEATURES
Loading...
NAMES
    SMILES
    CN(C)c1ccc(S(=O)(=O)N[C@H]2CCN(C(Cc3cc4ccnc(N)c4cc3O)C(=O)O)C2=O)cn1
    InChI
    InChI=1S/C23H26N6O6S/c1-28(2)20-4-3-15(12-26-20)36(34,35)27-17-6-8-29(22(17)31)18(23(32)33)10-14-9-13-5-7-25-21(24)16(13)11-19(14)30/h3-5,7,9,11-12,17-18,27,30H,6,8,10H2,1-2H3,(H2,24,25)(H,32,33)/t17-,18?/m0/s1
    MOLECULAR FORMULA
    C23H26N6O6S
    CROSS REFERENCES
    Loading...
    canSAR1601630
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight514.16
    AlogP0.56
    HBond donors5
    HBond acceptors12
    Atoms62
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1601630.