canSAR2099345
FEATURES
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NAMES
    SMILES
    O=c1nc(OCC2COc3ncccc3O2)cc2n1CCc1cc(CN3CCCC3)ccc1-2
    InChI
    InChI=1S/C25H26N4O4/c30-25-27-23(31-15-19-16-32-24-22(33-19)4-3-8-26-24)13-21-20-6-5-17(14-28-9-1-2-10-28)12-18(20)7-11-29(21)25/h3-6,8,12-13,19H,1-2,7,9-11,14-16H2
    MOLECULAR FORMULA
    C25H26N4O4
    CROSS REFERENCES
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    canSAR2099345
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight446.20
    AlogP2.68
    HBond donors0
    HBond acceptors8
    Atoms59
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2099345.