General Information of the Compound
| Compound ID |
CP0499066
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| Compound Name |
N-(3-chlorophenyl)sulfonyl-4-ethyl-N'-methyl-3,4-dihydropyrazole-2-carboximidamide
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| Structure |
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| Formula |
C13H17ClN4O2S
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| Molecular Weight |
328.825
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| Canonical SMILES |
CCC1CN(N=C1)C(NS(=O)(=O)c1cccc(Cl)c1)=NC
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| InChI |
InChI=1S/C13H17ClN4O2S/c1-3-10-8-16-18(9-10)13(15-2)17-21(19,20)12-6-4-5-11(14)7-12/h4-8,10H,3,9H2,1-2H3,(H,15,17)
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| InChIKey |
SNHKXOAXJXJUQK-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