General Information of the Compound
| Compound ID |
CP0093066
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| Compound Name |
1-(2,4-dichlorophenyl)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-3-(4-methylphenyl)pyrazole-4-carboxamide
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| Structure |
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| Formula |
C28H26Cl2N4O4S
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| Molecular Weight |
585.513
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| Canonical SMILES |
Cc1ccc(cc1)-c1nn(cc1C(=O)Nc1ccc(C)c(c1)S(=O)(=O)N1CCOCC1)-c1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C28H26Cl2N4O4S/c1-18-3-6-20(7-4-18)27-23(17-34(32-27)25-10-8-21(29)15-24(25)30)28(35)31-22-9-5-19(2)26(16-22)39(36,37)33-11-13-38-14-12-33/h3-10,15-17H,11-14H2,1-2H3,(H,31,35)
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| InChIKey |
WMANSNGQUXOIKU-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