General Information of the Compound
| Compound ID |
CP0552092
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| Compound Name |
[4-[1-(3-fluorophenyl)triazol-4-yl]phenyl] sulfamate
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| Structure |
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| Formula |
C14H11FN4O3S
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| Molecular Weight |
334.332
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| Canonical SMILES |
NS(=O)(=O)Oc1ccc(cc1)-c1cn(nn1)-c1cccc(F)c1
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| InChI |
InChI=1S/C14H11FN4O3S/c15-11-2-1-3-12(8-11)19-9-14(17-18-19)10-4-6-13(7-5-10)22-23(16,20)21/h1-9H,(H2,16,20,21)
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| InChIKey |
KWXRUDODIQKRIV-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