General Information of the Compound
| Compound ID |
CP0726172
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| Compound Name |
methyl 1-(7-fluoro-4-oxo-3,4-dihydropyrrolo[1,2-f][1,2,4]triazin-2-yl)-5-methyl-1H-pyrazole-4-carboxylate
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| Structure |
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| Formula |
C12H10FN5O3
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| Molecular Weight |
291.242
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| Canonical SMILES |
COC(=O)c1cnn(-c2nn3c(F)ccc3c(=O)[nH]2)c1C
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| InChI |
InChI=1S/C12H10FN5O3/c1-6-7(11(20)21-2)5-14-17(6)12-15-10(19)8-3-4-9(13)18(8)16-12/h3-5H,1-2H3,(H,15,16,19)
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| InChIKey |
UFXLADONDRICSL-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