General Information of the Compound
| Compound ID |
CP0163984
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| Compound Name |
2-fluoro-N-[3-[2-hydroxy-6-(3-hydroxyphenyl)naphthalen-1-yl]phenyl]benzenesulfonamide
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| Structure |
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| Formula |
C28H20FNO4S
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| Molecular Weight |
485.536
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| Canonical SMILES |
Oc1cccc(c1)-c1ccc2c(c(O)ccc2c1)-c1cccc(NS(=O)(=O)c2ccccc2F)c1
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| InChI |
InChI=1S/C28H20FNO4S/c29-25-9-1-2-10-27(25)35(33,34)30-22-7-3-6-21(16-22)28-24-13-11-19(15-20(24)12-14-26(28)32)18-5-4-8-23(31)17-18/h1-17,30-32H
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| InChIKey |
CYYYSDGFHQVDLC-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