canSAR2152996
FEATURES
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NAMES
    SMILES
    Cn1nc(-c2ccc(F)cc2)c(-c2ccc3nc(NC(=O)c4ccnc(N5CCOCC5)c4)cn3n2)c1-c1ccncc1
    InChI
    InChI=1S/C31H26FN9O2/c1-39-30(21-8-11-33-12-9-21)28(29(38-39)20-2-4-23(32)5-3-20)24-6-7-26-35-25(19-41(26)37-24)36-31(42)22-10-13-34-27(18-22)40-14-16-43-17-15-40/h2-13,18-19H,14-17H2,1H3,(H,36,42)
    MOLECULAR FORMULA
    C31H26FN9O2
    CROSS REFERENCES
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    canSAR2152996
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight575.22
    AlogP4.48
    HBond donors1
    HBond acceptors11
    Atoms69
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2152996.