General Information of the Compound
| Compound ID |
CP0425975
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| Compound Name |
N'-(3-chlorophenyl)sulfonyl-4-ethyl-3,4-dihydropyrazole-2-carboximidamide
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| Structure |
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| Formula |
C12H15ClN4O2S
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| Molecular Weight |
314.798
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| Canonical SMILES |
CCC1CN(N=C1)C(=N)NS(=O)(=O)c1cccc(Cl)c1
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| InChI |
InChI=1S/C12H15ClN4O2S/c1-2-9-7-15-17(8-9)12(14)16-20(18,19)11-5-3-4-10(13)6-11/h3-7,9H,2,8H2,1H3,(H2,14,16)
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| InChIKey |
OGKGWMDDDUMDAJ-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