General Information of the Compound
| Compound ID |
CP0479137
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| Compound Name |
N-[3-(N-(6-fluoro-1,1-dioxo-1,2-benzothiazol-3-yl)anilino)-2,2-dimethylpropyl]acetamide
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| Structure |
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| Formula |
C20H22FN3O3S
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| Molecular Weight |
403.479
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| Canonical SMILES |
CC(=O)NCC(C)(C)CN(C1=NS(=O)(=O)c2cc(F)ccc12)c1ccccc1
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| InChI |
InChI=1S/C20H22FN3O3S/c1-14(25)22-12-20(2,3)13-24(16-7-5-4-6-8-16)19-17-10-9-15(21)11-18(17)28(26,27)23-19/h4-11H,12-13H2,1-3H3,(H,22,25)
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| InChIKey |
QTMFRCRPLSELGE-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