General Information of the Compound
| Compound ID |
CP0396149
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| Compound Name |
2-[3-fluoro-5-(2-methylphenoxy)phenyl]-3H-1,2-benzothiazole 1,1-dioxide
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| Structure |
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| Formula |
C20H16FNO3S
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| Molecular Weight |
369.417
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| Canonical SMILES |
Cc1ccccc1Oc1cc(F)cc(c1)N1Cc2ccccc2S1(=O)=O
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| InChI |
InChI=1S/C20H16FNO3S/c1-14-6-2-4-8-19(14)25-18-11-16(21)10-17(12-18)22-13-15-7-3-5-9-20(15)26(22,23)24/h2-12H,13H2,1H3
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| InChIKey |
XKGJKRRDGPTDQE-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
Protein ID: PT02793, Free fatty acid receptor 1
Protein ID: PT04427, Free fatty acid receptor 4