General Information of the Compound
| Compound ID |
CP0472731
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| Compound Name |
3-chloro-2-hydroxy-N-[3-nitro-5-(trifluoromethyl)phenyl]benzamide
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| Structure |
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| Formula |
C14H8ClF3N2O4
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| Molecular Weight |
360.675
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| Canonical SMILES |
Oc1c(Cl)cccc1C(=O)Nc1cc(cc(c1)C(F)(F)F)[N+]([O-])=O
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| InChI |
InChI=1S/C14H8ClF3N2O4/c15-11-3-1-2-10(12(11)21)13(22)19-8-4-7(14(16,17)18)5-9(6-8)20(23)24/h1-6,21H,(H,19,22)
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| InChIKey |
HMKZRNKCPCWCRL-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