General Information of the Compound
| Compound ID |
CP0566848
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| Compound Name |
2-[benzenesulfonyl-[1-[3-(3,5-dichlorophenyl)phenyl]cyclobutyl]amino]acetic acid
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| Structure |
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| Formula |
C24H21Cl2NO4S
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| Molecular Weight |
490.408
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| Canonical SMILES |
OC(=O)CN(C1(CCC1)c1cccc(c1)-c1cc(Cl)cc(Cl)c1)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C24H21Cl2NO4S/c25-20-13-18(14-21(26)15-20)17-6-4-7-19(12-17)24(10-5-11-24)27(16-23(28)29)32(30,31)22-8-2-1-3-9-22/h1-4,6-9,12-15H,5,10-11,16H2,(H,28,29)
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| InChIKey |
VUCGWEGPHBNVFX-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