General Information of the Compound
| Compound ID |
CP0534652
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| Compound Name |
2-[[(1R)-1-[4-(2,4-dichlorophenyl)phenyl]ethyl]-[4-(difluoromethoxy)phenyl]sulfonylamino]acetic acid
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| Structure |
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| Formula |
C23H19Cl2F2NO5S
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| Molecular Weight |
530.376
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| Canonical SMILES |
C[C@@H](N(CC(O)=O)S(=O)(=O)c1ccc(OC(F)F)cc1)c1ccc(cc1)-c1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C23H19Cl2F2NO5S/c1-14(15-2-4-16(5-3-15)20-11-6-17(24)12-21(20)25)28(13-22(29)30)34(31,32)19-9-7-18(8-10-19)33-23(26)27/h2-12,14,23H,13H2,1H3,(H,29,30)/t14-/m1/s1
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| InChIKey |
QJWNOQBDIXMTTK-CQSZACIVSA-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