General Information of the Compound
| Compound ID |
CP0542962
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| Compound Name |
4-cyano-N-(4-phenylmethoxyphenyl)benzenesulfonamide
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| Structure |
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| Formula |
C20H16N2O3S
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| Molecular Weight |
364.426
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| Canonical SMILES |
O=S(=O)(Nc1ccc(OCc2ccccc2)cc1)c1ccc(cc1)C#N
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| InChI |
InChI=1S/C20H16N2O3S/c21-14-16-6-12-20(13-7-16)26(23,24)22-18-8-10-19(11-9-18)25-15-17-4-2-1-3-5-17/h1-13,22H,15H2
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| InChIKey |
XVAYHRPRKMCMBM-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