Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LK32DX
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| Ligand Name |
(4S)-N-((3R,5R)-1-(cyclopropanecarbonyl)-5-((5-(phenylethynyl)thiophene-2-carboxamido)methyl)pyrrolidin-3-yl)-4-fluoropyrrolidine-2-carboxamide
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| Synonyms |
(4S)-N-((3R,5R)-1-(cyclopropanecarbonyl)-5-((5-(phenylethynyl)thiophene-2-carboxamido)methyl)pyrrolidin-3-yl)-4-fluoropyrrolidine-2-carboxamide; 9A1
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| Structure |
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Download2D MOL |
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| Formula |
C27H29FN4O3S
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| Canonical SMILES |
C1CC1C(=O)N2CC(CC2CNC(=O)C3=CC=C(S3)C#CC4=CC=CC=C4)NC(=O)C5CC(CN5)F
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| InChI |
1S/C27H29FN4O3S/c28-19-12-23(29-14-19)25(33)31-20-13-21(32(16-20)27(35)18-7-8-18)15-30-26(34)24-11-10-22(36-24)9-6-17-4-2-1-3-5-17/h1-5,10-11,18-21,23,29H,7-8,12-16H2,(H,30,34)(H,31,33)/t19-,20+,21+,23-/m0/s1
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| InChIKey |
ZFFWZIADZMCJNF-GNXKAVGDSA-N
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| PubChem Compound ID | ||||
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