General Information of the Compound
| Compound ID |
CP0479725
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| Compound Name |
1-[4-[1-(dimethylsulfamoylamino)propan-2-yl]phenyl]-2-fluorobenzene
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| Structure |
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| Formula |
C17H21FN2O2S
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| Molecular Weight |
336.432
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| Canonical SMILES |
CC(CNS(=O)(=O)N(C)C)c1ccc(cc1)-c1ccccc1F
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| InChI |
InChI=1S/C17H21FN2O2S/c1-13(12-19-23(21,22)20(2)3)14-8-10-15(11-9-14)16-6-4-5-7-17(16)18/h4-11,13,19H,12H2,1-3H3
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| InChIKey |
GHHSSUNFBLGVJP-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