General Information of the Compound
| Compound ID |
CP0492095
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| Compound Name |
2-(3-bromo-4-fluorophenyl)imino-2-(hydroxyamino)-N-[3-(methanesulfonamido)propyl]acetamide
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| Formula |
C12H16BrFN4O4S
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| Molecular Weight |
411.253
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| Canonical SMILES |
CS(=O)(=O)NCCCNC(=O)C(\Nc1ccc(F)c(Br)c1)=N\O
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| InChI |
InChI=1S/C12H16BrFN4O4S/c1-23(21,22)16-6-2-5-15-12(19)11(18-20)17-8-3-4-10(14)9(13)7-8/h3-4,7,16,20H,2,5-6H2,1H3,(H,15,19)(H,17,18)
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| InChIKey |
ULFPINBDYNFTEP-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