General Information of the Compound
| Compound ID |
CP0475431
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| Compound Name |
3-(2,5-Dimethylphenylsulfonyl)thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-amine
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| Structure |
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| Formula |
C15H13N5O2S2
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| Molecular Weight |
359.436
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| Canonical SMILES |
Cc1ccc(C)c(c1)S(=O)(=O)c1nnn2c3ccsc3c(N)nc12
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| InChI |
InChI=1S/C15H13N5O2S2/c1-8-3-4-9(2)11(7-8)24(21,22)15-14-17-13(16)12-10(5-6-23-12)20(14)19-18-15/h3-7H,1-2H3,(H2,16,17)
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| InChIKey |
ISFANHDDAVDSEB-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