General Information of the Compound
Compound ID |
CP0568622
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Compound Name |
2-[[1-[4-(2,4-dichlorophenyl)phenyl]cyclopropyl]-[4-(difluoromethoxy)phenyl]sulfonylamino]acetic acid
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Structure |
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Formula |
C24H19Cl2F2NO5S
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Molecular Weight |
542.387
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Canonical SMILES |
OC(=O)CN(C1(CC1)c1ccc(cc1)-c1ccc(Cl)cc1Cl)S(=O)(=O)c1ccc(OC(F)F)cc1
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InChI |
InChI=1S/C24H19Cl2F2NO5S/c25-17-5-10-20(21(26)13-17)15-1-3-16(4-2-15)24(11-12-24)29(14-22(30)31)35(32,33)19-8-6-18(7-9-19)34-23(27)28/h1-10,13,23H,11-12,14H2,(H,30,31)
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InChIKey |
UKYHIDBVOSCOLH-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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