General Information of the Compound
| Compound ID |
CP0915925
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| Compound Name |
N-[2-(4-hydroxy-3-methylsulfamoyl-phenyl)-ethyl]-2-[(toluene-4-sulfonyl)-o-tolyl-amino]-acetamide
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| Structure |
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| Formula |
C25H29N3O6S2
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| Molecular Weight |
531.656
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| Canonical SMILES |
CNS(=O)(=O)c1cc(CCNC(=O)CN(c2ccccc2C)S(=O)(=O)c2ccc(C)cc2)ccc1O
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| InChI |
InChI=1S/C25H29N3O6S2/c1-18-8-11-21(12-9-18)36(33,34)28(22-7-5-4-6-19(22)2)17-25(30)27-15-14-20-10-13-23(29)24(16-20)35(31,32)26-3/h4-13,16,26,29H,14-15,17H2,1-3H3,(H,27,30)
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| InChIKey |
CZBMKTXTIXIBLG-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