General Information of the Compound
| Compound ID |
CP0364067
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| Compound Name |
3-[6-[3-(difluoromethoxy)-5-fluorophenyl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-2,3-dihydroindol-2-yl]propanoic acid
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| Structure |
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| Formula |
C25H19F6NO5S
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| Molecular Weight |
559.484
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| Canonical SMILES |
OC(=O)CCC1Cc2ccc(cc2N1S(=O)(=O)c1cccc(c1)C(F)(F)F)-c1cc(F)cc(OC(F)F)c1
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| InChI |
InChI=1S/C25H19F6NO5S/c26-18-8-16(10-20(13-18)37-24(27)28)14-4-5-15-9-19(6-7-23(33)34)32(22(15)11-14)38(35,36)21-3-1-2-17(12-21)25(29,30)31/h1-5,8,10-13,19,24H,6-7,9H2,(H,33,34)
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| InChIKey |
GGRLVKZDTKNZCF-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