General Information of the Compound
| Compound ID |
CP0905292
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| Compound Name |
2-(7-{5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl}imidazo[1,2-a]pyrimidin-2-yl)-1,3-thiazole
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| Structure |
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| Formula |
C16H12N8S
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| Molecular Weight |
348.395
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| Canonical SMILES |
Cc1ncc(C)n2nc(-c3ccn4cc(-c5nccs5)nc4n3)nc12
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| InChI |
InChI=1S/C16H12N8S/c1-9-7-18-10(2)14-21-13(22-24(9)14)11-3-5-23-8-12(20-16(23)19-11)15-17-4-6-25-15/h3-8H,1-2H3
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| InChIKey |
MRYFITSVZIKRKK-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: PT01875, cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A
Protein ID: PT02038, Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C
Protein ID: PT03075, High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A