General Information of the Compound
| Compound ID |
CP0438657
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| Compound Name |
N-(3-fluorophenyl)-2-[3-(6-methylpyridin-2-yl)-4-thieno[3,2-c]pyridin-2-ylpyrazol-1-yl]acetamide
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| Structure |
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| Formula |
C24H18FN5OS
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| Molecular Weight |
443.507
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| Canonical SMILES |
Cc1cccc(n1)-c1nn(CC(=O)Nc2cccc(F)c2)cc1-c1cc2cnccc2s1
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| InChI |
InChI=1S/C24H18FN5OS/c1-15-4-2-7-20(27-15)24-19(22-10-16-12-26-9-8-21(16)32-22)13-30(29-24)14-23(31)28-18-6-3-5-17(25)11-18/h2-13H,14H2,1H3,(H,28,31)
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| InChIKey |
FHNPGFGSELVLOZ-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