General Information of the Compound
| Compound ID |
CP0275206
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| Compound Name |
6-[2-(2-methylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]-4H-1,4-benzoxazin-3-one
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| Structure |
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| Formula |
C19H14F3N3O2
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| Molecular Weight |
373.334
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| Canonical SMILES |
Cc1ccccc1-n1nc(cc1-c1ccc2OCC(=O)Nc2c1)C(F)(F)F
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| InChI |
InChI=1S/C19H14F3N3O2/c1-11-4-2-3-5-14(11)25-15(9-17(24-25)19(20,21)22)12-6-7-16-13(8-12)23-18(26)10-27-16/h2-9H,10H2,1H3,(H,23,26)
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| InChIKey |
CMFFEQLOOLNLFE-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