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canSAR1861769
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NAMES
    SMILES
    CCc1ncnc(-c2ccc(C(=O)N3CCN(C(C)(C)C)CC3)c(OC)c2)c1C#Cc1ccc(N)nc1
    InChI
    InChI=1S/C29H34N6O2/c1-6-24-22(10-7-20-8-12-26(30)31-18-20)27(33-19-32-24)21-9-11-23(25(17-21)37-5)28(36)34-13-15-35(16-14-34)29(2,3)4/h8-9,11-12,17-19H,6,13-16H2,1-5H3,(H2,30,31)
    MOLECULAR FORMULA
    C29H34N6O2
    CROSS REFERENCES
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    canSAR1861769

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 498.27
    AlogP 3.65
    HBond donors 2
    HBond acceptors 8
    Atoms 71
    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 canSAR1861769.