General Information of the Compound
| Compound ID |
CP0928815
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| Compound Name |
N-(4-(N-(3-(1H-1,2,4-triazol-5-ylthio)-4-hydroxynaphthalen-1-yl)sulfamoyl)phenyl)acetamide
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| Structure |
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| Formula |
C20H17N5O4S2
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| Molecular Weight |
455.521
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| Canonical SMILES |
CC(=O)Nc1ccc(S(=O)(=O)Nc2cc(Sc3ncn[nH]3)c(O)c3ccccc23)cc1
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| InChI |
InChI=1S/C20H17N5O4S2/c1-12(26)23-13-6-8-14(9-7-13)31(28,29)25-17-10-18(30-20-21-11-22-24-20)19(27)16-5-3-2-4-15(16)17/h2-11,25,27H,1H3,(H,23,26)(H,21,22,24)
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| InChIKey |
CRSCYOMRZYZFET-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