General Information of the Compound
| Compound ID |
CP0422765
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| Compound Name |
[3-amino-5-(4-fluorophenyl)sulfonylpyridin-2-yl]-[3-hydroxy-3-(trifluoromethyl)azetidin-1-yl]methanone
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| Structure |
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| Formula |
C16H13F4N3O4S
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| Molecular Weight |
419.356
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| Canonical SMILES |
Nc1cc(cnc1C(=O)N1CC(O)(C1)C(F)(F)F)S(=O)(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C16H13F4N3O4S/c17-9-1-3-10(4-2-9)28(26,27)11-5-12(21)13(22-6-11)14(24)23-7-15(25,8-23)16(18,19)20/h1-6,25H,7-8,21H2
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| InChIKey |
ZCHBGZYGDTWRDD-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