Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L8M6ET
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| Ligand Name |
N'-[(1s,2s)-2-[(2s)-4-Benzyl-3-Oxopiperazin-2-Yl]-1-(3,5-Difluorobenzyl)-2-Hydroxyethyl]-5-Methyl-N,N-Dipropylbenzene-1,3-Dicarboxamide
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| Synonyms |
CHEMBL509210; N'-[(1s,2s)-2-[(2s)-4-Benzyl-3-Oxopiperazin-2-Yl]-1-(3,5-Difluorobenzyl)-2-Hydroxyethyl]-5-Methyl-N,N-Dipropylbenzene-1,3-Dicarboxamide; SCHEMBL12854796; BDBM50271626; Q27453460; N''-[(1S,2S)-2-[(2S)-4-benzyl-3-oxopiperazin-2-yl]-1-(3,5-difluorobenzyl)-2-hydroxyethyl]-5-methyl-N,N-dipropylbenzene-1,3-dicarboxamide; N1-((1S,2S)-1-((S)-4-benzyl-3-oxopiperazin-2-yl)-3-(3,5-difluorophenyl)-1-hydroxypropan-2-yl)-5-methyl-N3,N3-dipropylisophthalamide
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| Structure |
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Download2D MOL |
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| Formula |
C35H42F2N4O4
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| Canonical SMILES |
CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)NC(CC2=CC(=CC(=C2)F)F)C(C3C(=O)N(CCN3)CC4=CC=CC=C4)O)C
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| InChI |
1S/C35H42F2N4O4/c1-4-12-40(13-5-2)34(44)27-16-23(3)15-26(20-27)33(43)39-30(19-25-17-28(36)21-29(37)18-25)32(42)31-35(45)41(14-11-38-31)22-24-9-7-6-8-10-24/h6-10,15-18,20-21,30-32,38,42H,4-5,11-14,19,22H2,1-3H3,(H,39,43)/t30-,31-,32-/m0/s1
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| InChIKey |
XKXGRRZAMDHVGR-CPCREDONSA-N
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| PubChem Compound ID | ||||
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