General Information of the Compound
| Compound ID |
CP0492009
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| Compound Name |
N-(6-chloro-1,3-benzothiazol-2-yl)-1,3-diphenylpyrazole-4-carboxamide
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| Structure |
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| Formula |
C23H15ClN4OS
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| Molecular Weight |
430.92
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| Canonical SMILES |
Clc1ccc2nc(NC(=O)c3cn(nc3-c3ccccc3)-c3ccccc3)sc2c1
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| InChI |
InChI=1S/C23H15ClN4OS/c24-16-11-12-19-20(13-16)30-23(25-19)26-22(29)18-14-28(17-9-5-2-6-10-17)27-21(18)15-7-3-1-4-8-15/h1-14H,(H,25,26,29)
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| InChIKey |
PUGCWXBHZFBSAI-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