General Information of the Compound
| Compound ID |
CP0060331
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| Compound Name |
O-[[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethyl]hydroxylamine;hydrochloride
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| Structure |
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| Formula |
C14H12ClF4NO
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| Molecular Weight |
321.701
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| Canonical SMILES |
Cl.NOC(c1ccccc1)c1cccc(c1F)C(F)(F)F
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| InChI |
InChI=1S/C14H11F4NO.ClH/c15-12-10(7-4-8-11(12)14(16,17)18)13(20-19)9-5-2-1-3-6-9;/h1-8,13H,19H2;1H
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| InChIKey |
ZWOOJRQFYXEPBG-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