General Information of the Compound
| Compound ID |
CP0400308
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| Compound Name |
4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-(2-morpholin-4-ylethyl)sulfamoyl]benzoic acid
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| Structure |
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| Formula |
C19H19ClF3N3O5S
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| Molecular Weight |
493.891
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| Canonical SMILES |
OC(=O)c1ccc(cc1)S(=O)(=O)N(CCN1CCOCC1)c1ncc(cc1Cl)C(F)(F)F
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| InChI |
InChI=1S/C19H19ClF3N3O5S/c20-16-11-14(19(21,22)23)12-24-17(16)26(6-5-25-7-9-31-10-8-25)32(29,30)15-3-1-13(2-4-15)18(27)28/h1-4,11-12H,5-10H2,(H,27,28)
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| InChIKey |
VRFDOBLZCIFLEM-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