General Information of the Compound
| Compound ID |
CP0455503
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| Compound Name |
N-(5-chlorothiophen-2-yl)sulfonyl-N',4-diethyl-3,4-dihydropyrazole-2-carboximidamide
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| Structure |
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| Formula |
C12H17ClN4O2S2
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| Molecular Weight |
348.881
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| Canonical SMILES |
CCN=C(NS(=O)(=O)c1ccc(Cl)s1)N1CC(CC)C=N1
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| InChI |
InChI=1S/C12H17ClN4O2S2/c1-3-9-7-15-17(8-9)12(14-4-2)16-21(18,19)11-6-5-10(13)20-11/h5-7,9H,3-4,8H2,1-2H3,(H,14,16)
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| InChIKey |
SBCKDJZRMMRMDJ-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