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canSAR1717389
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NAMES
    SMILES
    CCn1c(NC(=O)c2ccc3cc4n(c3n2)[C@H](C)CNC4=O)nc2ccccc21
    InChI
    InChI=1S/C21H20N6O2/c1-3-26-16-7-5-4-6-14(16)24-21(26)25-19(28)15-9-8-13-10-17-20(29)22-11-12(2)27(17)18(13)23-15/h4-10,12H,3,11H2,1-2H3,(H,22,29)(H,24,25,28)/t12-/m1/s1
    MOLECULAR FORMULA
    C21H20N6O2
    CROSS REFERENCES
    1717389 logo

    canSAR1717389

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 388.16
    AlogP 2.96
    HBond donors 2
    HBond acceptors 8
    Atoms 49
    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 canSAR1717389.