General Information of the Compound
| Compound ID |
CP0575925
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| Compound Name |
3-[4-[3-pyridin-4-yl-5-(trifluoromethyl)-1H-pyrazol-4-yl]phenyl]benzenesulfonamide
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| Structure |
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| Formula |
C21H15F3N4O2S
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| Molecular Weight |
444.438
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| Canonical SMILES |
NS(=O)(=O)c1cccc(c1)-c1ccc(cc1)-c1c(n[nH]c1C(F)(F)F)-c1ccncc1
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| InChI |
InChI=1S/C21H15F3N4O2S/c22-21(23,24)20-18(19(27-28-20)15-8-10-26-11-9-15)14-6-4-13(5-7-14)16-2-1-3-17(12-16)31(25,29)30/h1-12H,(H,27,28)(H2,25,29,30)
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| InChIKey |
HIJLHWROJXCIDE-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