General Information of the Compound
| Compound ID |
CP0538704
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| Compound Name |
N-(benzenesulfonyl)-3-[2-methyl-5-(2-phenylmethoxyphenyl)pyrrol-1-yl]benzamide
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| Structure |
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| Formula |
C31H26N2O4S
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| Molecular Weight |
522.626
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| Canonical SMILES |
Cc1ccc(-c2ccccc2OCc2ccccc2)n1-c1cccc(c1)C(=O)NS(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C31H26N2O4S/c1-23-19-20-29(28-17-8-9-18-30(28)37-22-24-11-4-2-5-12-24)33(23)26-14-10-13-25(21-26)31(34)32-38(35,36)27-15-6-3-7-16-27/h2-21H,22H2,1H3,(H,32,34)
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| InChIKey |
VAOGIXWURJDBHV-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