General Information of the Compound
| Compound ID |
CP0945317
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| Compound Name |
5-[5-(4-Chloro-2-fluorophenyl)-1-methyl-1H-pyrazol-4-yl]-4-(3-fluoroazetidin-1-yl)-7-methylimidazo[5,1-f][1,2,4]triazine
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| Structure |
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| Formula |
C19H16ClF2N7
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| Molecular Weight |
415.835
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| Canonical SMILES |
Cc1nc(-c2cnn(C)c2-c2ccc(Cl)cc2F)c2c(N3CC(F)C3)ncnn12
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| InChI |
InChI=1S/C19H16ClF2N7/c1-10-26-16(18-19(23-9-25-29(10)18)28-7-12(21)8-28)14-6-24-27(2)17(14)13-4-3-11(20)5-15(13)22/h3-6,9,12H,7-8H2,1-2H3
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| InChIKey |
VCXMTDDYFFTSOD-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