General Information of the Compound
| Compound ID |
CP0517708
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| Compound Name |
3-[(4-chlorophenyl)methyl]-5-fluoro-1,3-benzoxazol-2-one
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| Structure |
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| Formula |
C14H9ClFNO2
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| Molecular Weight |
277.682
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| Canonical SMILES |
Fc1ccc2oc(=O)n(Cc3ccc(Cl)cc3)c2c1
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| InChI |
InChI=1S/C14H9ClFNO2/c15-10-3-1-9(2-4-10)8-17-12-7-11(16)5-6-13(12)19-14(17)18/h1-7H,8H2
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| InChIKey |
UZMFTYQOMSWPRE-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