Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LMH29D
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| Ligand Name |
SARS-CoV MPro-IN-1
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| Synonyms |
SARS-CoV MPro-IN-1; 2413716-71-7; N-[(2S)-3-(3-fluorophenyl)-1-oxo-1-[[(2S)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]amino]propan-2-yl]-1H-indole-2-carboxamide; N-[(1S)-1-[(3-fluorophenyl)methyl]-2-[[(1S)-1-formyl-2-[(3S)-2-oxo-3-pyrrolidinyl]ethyl]amino]-2-oxoethyl]-1H-indole-2-carboxamide; peptidomimetic aldehydes 11b; CHEMBL4764751; SCHEMBL24766412; CHEBI:152561; BDBM420297; HY-136606; CS-0132246; 3-fluoro-Nalpha-(1H-indol-2-ylcarbonyl)-N-{(2S)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-L-phenylalaninamide
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| Structure |
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Download2D MOL |
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| Formula |
C25H25FN4O4
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| Canonical SMILES |
C1CNC(=O)C1CC(C=O)NC(=O)C(CC2=CC(=CC=C2)F)NC(=O)C3=CC4=CC=CC=C4N3
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| InChI |
1S/C25H25FN4O4/c26-18-6-3-4-15(10-18)11-21(24(33)28-19(14-31)12-17-8-9-27-23(17)32)30-25(34)22-13-16-5-1-2-7-20(16)29-22/h1-7,10,13-14,17,19,21,29H,8-9,11-12H2,(H,27,32)(H,28,33)(H,30,34)/t17-,19-,21-/m0/s1
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| InChIKey |
HCRBVFBQANEDDM-CUWPLCDZSA-N
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| PubChem Compound ID | ||||
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