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canSAR1588196
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NAMES
    SMILES
    CCC(c1nnnn1-c1ccc(OC)cc1)N1CCC(n2c(O)nc3ccccc32)CC1
    InChI
    InChI=1S/C23H27N7O2/c1-3-20(22-25-26-27-30(22)17-8-10-18(32-2)11-9-17)28-14-12-16(13-15-28)29-21-7-5-4-6-19(21)24-23(29)31/h4-11,16,20H,3,12-15H2,1-2H3,(H,24,31)
    MOLECULAR FORMULA
    C23H27N7O2
    CROSS REFERENCES
    1588196 logo

    canSAR1588196

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 433.22
    AlogP 3.51
    HBond donors 1
    HBond acceptors 9
    Atoms 59
    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 canSAR1588196.