General Information of the Compound
| Compound ID |
CP0306460
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| Compound Name |
2-hydroxy-5-[(E)-2-[4-(pyridin-2-ylsulfamoyl)phenyl]ethenyl]benzoic acid
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| Structure |
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| Formula |
C20H16N2O5S
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| Molecular Weight |
396.424
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| Canonical SMILES |
OC(=O)c1cc(\C=C\c2ccc(cc2)S(=O)(=O)Nc2ccccn2)ccc1O
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| InChI |
InChI=1S/C20H16N2O5S/c23-18-11-8-15(13-17(18)20(24)25)5-4-14-6-9-16(10-7-14)28(26,27)22-19-3-1-2-12-21-19/h1-13,23H,(H,21,22)(H,24,25)/b5-4+
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| InChIKey |
UAHMKJJFOGZIDP-SNAWJCMRSA-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