General Information of the Compound
| Compound ID |
CP0519249
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| Compound Name |
2-[benzyl-[4-(difluoromethoxy)phenyl]sulfonylamino]acetic acid
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| Structure |
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| Formula |
C16H15F2NO5S
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| Molecular Weight |
371.361
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| Canonical SMILES |
OC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(OC(F)F)cc1
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| InChI |
InChI=1S/C16H15F2NO5S/c17-16(18)24-13-6-8-14(9-7-13)25(22,23)19(11-15(20)21)10-12-4-2-1-3-5-12/h1-9,16H,10-11H2,(H,20,21)
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| InChIKey |
UTGVREPRODUTCI-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