General Information of the Compound
| Compound ID |
CP0444232
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| Compound Name |
(3-fluoroazetidin-1-yl)-[1-(2-fluoropyridin-4-yl)pyrrolo[2,3-b]pyridin-2-yl]methanone
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| Structure |
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| Formula |
C16H12F2N4O
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| Molecular Weight |
314.295
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| Canonical SMILES |
FC1CN(C1)C(=O)c1cc2cccnc2n1-c1ccnc(F)c1
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| InChI |
InChI=1S/C16H12F2N4O/c17-11-8-21(9-11)16(23)13-6-10-2-1-4-20-15(10)22(13)12-3-5-19-14(18)7-12/h1-7,11H,8-9H2
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| InChIKey |
DGVDBEGSUSZBRM-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