General Information of the Compound
| Compound ID |
CP0550884
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| Compound Name |
5-(3,3-difluoroazetidin-1-yl)-2-phenylmethoxy-N-pyridazin-4-ylbenzamide
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| Structure |
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| Formula |
C21H18F2N4O2
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| Molecular Weight |
396.397
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| Canonical SMILES |
FC1(F)CN(C1)c1ccc(OCc2ccccc2)c(c1)C(=O)Nc1ccnnc1
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| InChI |
InChI=1S/C21H18F2N4O2/c22-21(23)13-27(14-21)17-6-7-19(29-12-15-4-2-1-3-5-15)18(10-17)20(28)26-16-8-9-24-25-11-16/h1-11H,12-14H2,(H,24,26,28)
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| InChIKey |
WPTCQBXOXHZPDY-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