General Information of the Compound
| Compound ID |
CP0438295
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| Compound Name |
4-Amino-N-(4,5-dimethyl-4H-1lambda*4*-isothiazol-3-yl)-benzenesulfonamide
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| Structure |
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| Formula |
C11H13N3O2S2
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| Molecular Weight |
283.378
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| Canonical SMILES |
Cc1snc(NS(=O)(=O)c2ccc(N)cc2)c1C
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| InChI |
InChI=1S/C11H13N3O2S2/c1-7-8(2)17-13-11(7)14-18(15,16)10-5-3-9(12)4-6-10/h3-6H,12H2,1-2H3,(H,13,14)
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| InChIKey |
JNFNMQCQKKMQFB-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