General Information of the Compound
| Compound ID |
CP0860249
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| Compound Name |
1,3-Diphenyl-N-(p-tolylcarbamothioyl)-1H-pyrazole-4-carboxamide
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| Structure |
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| Formula |
C24H20N4OS
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| Molecular Weight |
412.518
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| Canonical SMILES |
Cc1ccc(NC(=S)NC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)cc1
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| InChI |
InChI=1S/C24H20N4OS/c1-17-12-14-19(15-13-17)25-24(30)26-23(29)21-16-28(20-10-6-3-7-11-20)27-22(21)18-8-4-2-5-9-18/h2-16H,1H3,(H2,25,26,29,30)
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| InChIKey |
LMTSMIQNBKUPBR-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