General Information of the Compound
| Compound ID |
CP0899462
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| Compound Name |
N,3-bis(4-(methylsulfinyl)phenyl)imidazo[1,2-b]pyridazin-6-amine
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| Structure |
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| Formula |
C20H18N4O2S2
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| Molecular Weight |
410.524
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| Canonical SMILES |
C[S+]([O-])c1ccc(Nc2ccc3ncc(-c4ccc([S+](C)[O-])cc4)n3n2)cc1
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| InChI |
InChI=1S/C20H18N4O2S2/c1-27(25)16-7-3-14(4-8-16)18-13-21-20-12-11-19(23-24(18)20)22-15-5-9-17(10-6-15)28(2)26/h3-13H,1-2H3,(H,22,23)
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| InChIKey |
DIJKZNBNQKPKPU-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound