Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LKWI09
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| Ligand Name |
2-{3-[3-chloro-5-(cyclopropylmethoxy)phenyl]-2-oxo[2H-[1,3'-bipyridine]]-5-yl}benzonitrile
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| Synonyms |
2-{3-[3-chloro-5-(cyclopropylmethoxy)phenyl]-2-oxo[2H-[1,3'-bipyridine]]-5-yl}benzonitrile; CHEMBL4854767; BDBM476978; Inhibitor 3 of SARS-CoV-2 Mpro; XFD
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| Structure |
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Download2D MOL |
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| Formula |
C27H20ClN3O2
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| Canonical SMILES |
C1CC1COC2=CC(=CC(=C2)C3=CC(=CN(C3=O)C4=CN=CC=C4)C5=CC=CC=C5C#N)Cl
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| InChI |
1S/C27H20ClN3O2/c28-22-10-20(11-24(13-22)33-17-18-7-8-18)26-12-21(25-6-2-1-4-19(25)14-29)16-31(27(26)32)23-5-3-9-30-15-23/h1-6,9-13,15-16,18H,7-8,17H2
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| InChIKey |
UIXRRGFIAVPQEF-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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