General Information of the Compound
| Compound ID |
CP0158100
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| Compound Name |
N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide
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| Structure |
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| Formula |
C22H21F3N4O4S
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| Molecular Weight |
494.495
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| Canonical SMILES |
Cc1ccc(NC(=O)c2cnn(c2C(F)(F)F)-c2ccccc2)cc1S(=O)(=O)N1CCOCC1
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| InChI |
InChI=1S/C22H21F3N4O4S/c1-15-7-8-16(13-19(15)34(31,32)28-9-11-33-12-10-28)27-21(30)18-14-26-29(20(18)22(23,24)25)17-5-3-2-4-6-17/h2-8,13-14H,9-12H2,1H3,(H,27,30)
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| InChIKey |
CLRZEHBDUJTPBU-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