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canSAR2089809
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NAMES
    SMILES
    NCC(=O)N1CC[C@@H](n2nc(-c3ccc(Oc4ccccc4)cc3)c3c(N)ncnc32)C1
    InChI
    InChI=1S/C23H23N7O2/c24-12-19(31)29-11-10-16(13-29)30-23-20(22(25)26-14-27-23)21(28-30)15-6-8-18(9-7-15)32-17-4-2-1-3-5-17/h1-9,14,16H,10-13,24H2,(H2,25,26,27)/t16-/m1/s1
    MOLECULAR FORMULA
    C23H23N7O2
    CROSS REFERENCES
    2089809 logo

    canSAR2089809

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 429.19
    AlogP 2.60
    HBond donors 4
    HBond acceptors 9
    Atoms 55
    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 canSAR2089809.