Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LJL75O
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| Ligand Name |
(2~{R},4~{R})-4-[[(2~{S},4~{S})-4-fluoranylpyrrolidin-2-yl]carbonylamino]-1-(2-methylpropanoyl)-~{N}-[[4-(2-phenylethynyl)phenyl]methyl]pyrrolidine-2-carboxamide
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| Synonyms |
(2~{R},4~{R})-4-[[(2~{S},4~{S})-4-fluoranylpyrrolidin-2-yl]carbonylamino]-1-(2-methylpropanoyl)-~{N}-[[4-(2-phenylethynyl)phenyl]methyl]pyrrolidine-2-carboxamide; 7PX
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| Structure |
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Download2D MOL |
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| Formula |
C29H33FN4O3
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| Canonical SMILES |
CC(C)C(=O)N1CC(CC1C(=O)NCC2=CC=C(C=C2)C#CC3=CC=CC=C3)NC(=O)C4CC(CN4)F
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| InChI |
1S/C29H33FN4O3/c1-19(2)29(37)34-18-24(33-27(35)25-14-23(30)17-31-25)15-26(34)28(36)32-16-22-12-10-21(11-13-22)9-8-20-6-4-3-5-7-20/h3-7,10-13,19,23-26,31H,14-18H2,1-2H3,(H,32,36)(H,33,35)/t23-,24+,25-,26+/m0/s1
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| InChIKey |
VUQQJEHSKZCJDR-ROXDYWFKSA-N
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| PubChem Compound ID | ||||
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