General Information of the Compound
| Compound ID |
CP0392620
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| Compound Name |
2-[[4-(difluoromethoxy)phenyl]sulfonyl-[1-[4-[2-(trifluoromethoxy)phenyl]phenyl]cyclopropyl]amino]acetic acid
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| Structure |
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| Formula |
C25H20F5NO6S
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| Molecular Weight |
557.493
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| Canonical SMILES |
OC(=O)CN(C1(CC1)c1ccc(cc1)-c1ccccc1OC(F)(F)F)S(=O)(=O)c1ccc(OC(F)F)cc1
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| InChI |
InChI=1S/C25H20F5NO6S/c26-23(27)36-18-9-11-19(12-10-18)38(34,35)31(15-22(32)33)24(13-14-24)17-7-5-16(6-8-17)20-3-1-2-4-21(20)37-25(28,29)30/h1-12,23H,13-15H2,(H,32,33)
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| InChIKey |
RMWSZICCCCJSSV-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