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Structure
|
|
| Relationships |
Total Number of functionally related protein(s) :
2
Total Number of Articles : 2
|
| PubChem |
23649154
|
| Molecular Formula |
C25H14F7N5 |
| SMILES |
C1=CC=C(C(=C1)C2=NC3=CN(C=CC3=N2)CC4=NN=C(C=C4)C5=C(C=C(C=C5)C(F)(F)F)C(F)(F)F)F |
| InChI |
InChI=1S/C25H14F7N5/c26-19-4-2-1-3-17(19)23-33-21-9-10-37(13-22(21)34-23)12-15-6-8-20(36-35-15)16-7-5-14(24(27,28)29)11-18(16)25(30,31)32/h1-11,13H,12H2 |
| synonyms |
- Tegobuvir
- 1000787-75-6
- 5-((6-(2,4-bis(Trifluoromethyl)phenyl)pyridazin-3-yl)methyl)-2-(2-fluorophenyl)-5H-imidazo[4,5-c]pyridine
- GS-9190
- GS-333126
- 5NOK5X389M
- 5-[[6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl]methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine
- 5H-Imidazo[4,5-c]pyridine, 5-[[6-[2,4-bis(trifluoromethyl)phenyl]-3-pyridazinyl]methyl]-2-(2-fluorophenyl)-;5H-Imidazo[4,5-c]pyridine, 5-[[6-[2,4-bis(trifluoromethyl)phenyl]-3-pyridazinyl]methyl]-2-(2-fluorophenyl)-
- Tegobuvir [USAN:INN]
- UNII-5NOK5X389M
- Tegobuvir [INN]
- 5-({6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl}methyl)-2-(2-fluorophenyl)-5h-imidazo[4,5-c]pyridine
- GS 9190
- GS 333126
- Tegobuvir (USAN/INN)
- TEGOBUVIR [USAN]
- TEGOBUVIR [WHO-DD]
- SCHEMBL496778
- CHEMBL1957287
- DTXSID80142917
- XBEQSQDCBSKCHJ-UHFFFAOYSA-N
- BCP28163
- BDBM50461671
- MFCD18251457
- s3395
- AKOS015949531
- CS-0672
- DB11852
- SB16972
- NCGC00378881-01
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| Properties |
| Property |
Value |
| MW |
517.4 g/mol |
| HBD |
0 |
| HBA |
11 |
| Rotatable Bond Count |
4 |
| Exact Mass |
517.11374260 g/mol |
| Monoisotopic Mass |
517.11374260 g/mol |
| Heavy Atom Count |
37 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
765 |
| xlogp |
4.7 |
| Topological Polar Surface Area |
56.5 |
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