General Information of the Compound
| Compound ID |
CP0962038
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| Compound Name |
4-amino-6-(2,2',6'-trifluorobiphenyl-4-yl)-7,8-dihydropyrimido[5,4-f][1,4]oxazepin-5(6H)-one
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| Structure |
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| Formula |
C19H13F3N4O2
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| Molecular Weight |
386.333
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| Canonical SMILES |
Nc1ncnc2c1C(=O)N(c1ccc(-c3c(F)cccc3F)c(F)c1)CCO2
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| InChI |
InChI=1S/C19H13F3N4O2/c20-12-2-1-3-13(21)15(12)11-5-4-10(8-14(11)22)26-6-7-28-18-16(19(26)27)17(23)24-9-25-18/h1-5,8-9H,6-7H2,(H2,23,24,25)
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| InChIKey |
LCRUINFYUIHFMU-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