1146798 logo
canSAR1146798
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(C)(C)OC(=O)NCC[C@@H]1NC(=O)c2coc(n2)-c2coc(n2)-c2cccc(c2)-c2cccc(c2)-c2nc(co2)-c2nc(co2)CNC1=O
    InChI
    InChI=1S/C35H31N7O8/c1-35(2,3)50-34(45)36-11-10-24-28(43)37-14-23-15-46-32(38-23)26-17-47-30(41-26)21-8-4-6-19(12-21)20-7-5-9-22(13-20)31-42-27(18-48-31)33-40-25(16-49-33)29(44)39-24/h4-9,12-13,15-18,24H,10-11,14H2,1-3H3,(H,36,45)(H,37,43)(H,39,44)/t24-/m0/s1
    MOLECULAR FORMULA
    C35H31N7O8
    CROSS REFERENCES
    1146798 logo

    canSAR1146798

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 677.22
    AlogP 5.62
    HBond donors 3
    HBond acceptors 15
    Atoms 81
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1146798.