General Information of the Compound
| Compound ID |
CP0962651
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| Compound Name |
(3-((2-chloro-4-(trifluoromethyl)phenoxy)methyl)phenyl)(3-hydroxyazetidin-1-yl)methanone
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| Structure |
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| Formula |
C18H15ClF3NO3
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| Molecular Weight |
385.769
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| Canonical SMILES |
O=C(c1cccc(COc2ccc(C(F)(F)F)cc2Cl)c1)N1CC(O)C1
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| InChI |
InChI=1S/C18H15ClF3NO3/c19-15-7-13(18(20,21)22)4-5-16(15)26-10-11-2-1-3-12(6-11)17(25)23-8-14(24)9-23/h1-7,14,24H,8-10H2
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| InChIKey |
UDCORKOYHJFWQN-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