General Information of the Compound
| Compound ID |
CP0356743
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| Compound Name |
5-chloro-N-(3-methoxy-1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thiophene-2-sulfonamide
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| Structure |
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| Formula |
C11H10ClN5O3S2
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| Molecular Weight |
359.82
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| Canonical SMILES |
COc1nn(C)c2ncnc(NS(=O)(=O)c3ccc(Cl)s3)c12
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| InChI |
InChI=1S/C11H10ClN5O3S2/c1-17-10-8(11(15-17)20-2)9(13-5-14-10)16-22(18,19)7-4-3-6(12)21-7/h3-5H,1-2H3,(H,13,14,16)
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| InChIKey |
AWKFPMCWSXXRCE-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