General Information of the Compound
| Compound ID |
CP0561101
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| Compound Name |
[3-(3,4-dichlorophenyl)imidazo[4,5-b]pyridin-2-yl]-[3-(trifluoromethyl)azetidin-1-yl]methanone
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| Formula |
C17H11Cl2F3N4O
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| Molecular Weight |
415.202
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| Canonical SMILES |
FC(F)(F)C1CN(C1)C(=O)c1nc2cccnc2n1-c1ccc(Cl)c(Cl)c1
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| InChI |
InChI=1S/C17H11Cl2F3N4O/c18-11-4-3-10(6-12(11)19)26-14-13(2-1-5-23-14)24-15(26)16(27)25-7-9(8-25)17(20,21)22/h1-6,9H,7-8H2
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| InChIKey |
OLHYEXXRIJQQIO-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
Protein ID: PT01305, 3',5'-cyclic-AMP phosphodiesterase 4B
Protein ID: PT01538, 3',5'-cyclic-AMP phosphodiesterase 4D