General Information of the Compound
| Compound ID |
CP0745024
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| Compound Name |
N-(3,3-difluorocyclobutyl)-5-methyl-1-(4-oxo-3,4-dihydropyrrolo[1,2-f][1,2,4]triazin-2-yl)-1H-pyrazole-4-carboxamide
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| Structure |
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| Formula |
C15H14F2N6O2
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| Molecular Weight |
348.313
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| Canonical SMILES |
Cc1c(C(=O)NC2CC(F)(F)C2)cnn1-c1nn2cccc2c(=O)[nH]1
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| InChI |
InChI=1S/C15H14F2N6O2/c1-8-10(12(24)19-9-5-15(16,17)6-9)7-18-23(8)14-20-13(25)11-3-2-4-22(11)21-14/h2-4,7,9H,5-6H2,1H3,(H,19,24)(H,20,21,25)
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| InChIKey |
QICSWUQHYWQIKL-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