canSAR2161701
FEATURES
Loading...
NAMES
    SMILES
    Cn1nc(-c2ccc(F)cc2)c(-c2ccc3nc(NC(=O)c4ccnc(N5CCOCC5)c4)cn3n2)c1N1CCN(C(=O)c2ccon2)CC1
    InChI
    InChI=1S/C34H32FN11O4/c1-42-33(44-11-13-45(14-12-44)34(48)26-9-17-50-41-26)30(31(40-42)22-2-4-24(35)5-3-22)25-6-7-28-37-27(21-46(28)39-25)38-32(47)23-8-10-36-29(20-23)43-15-18-49-19-16-43/h2-10,17,20-21H,11-16,18-19H2,1H3,(H,38,47)
    MOLECULAR FORMULA
    C34H32FN11O4
    CROSS REFERENCES
    Loading...
    canSAR2161701
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight677.26
    AlogP3.37
    HBond donors1
    HBond acceptors15
    Atoms82
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2161701.