Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
LAEQ07
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Ligand Name |
N-[(1s,2r)-1-(3,5-Difluorobenzyl)-3-({1-[4-(2,2-Dimethylpropyl)thiophen-2-Yl]cyclopropyl}amino)-2-Hydroxypropyl]acetamide
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Synonyms |
CHEMBL1230648; N-[(1s,2r)-1-(3,5-Difluorobenzyl)-3-({1-[4-(2,2-Dimethylpropyl)thiophen-2-Yl]cyclopropyl}amino)-2-Hydroxypropyl]acetamide; BDBM50328056; Q27456965; N-((2S,3R)-1-(3,5-difluorophenyl)-3-hydroxy-4-(1-(4-neopentylthiophen-2-yl)cyclopropylamino)butan-2-yl)acetamide
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Structure |
Download2D MOL |
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Formula |
C24H32F2N2O2S
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Canonical SMILES |
CC(=O)NC(CC1=CC(=CC(=C1)F)F)C(CNC2(CC2)C3=CC(=CS3)CC(C)(C)C)O
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InChI |
1S/C24H32F2N2O2S/c1-15(29)28-20(9-16-7-18(25)11-19(26)8-16)21(30)13-27-24(5-6-24)22-10-17(14-31-22)12-23(2,3)4/h7-8,10-11,14,20-21,27,30H,5-6,9,12-13H2,1-4H3,(H,28,29)/t20-,21+/m0/s1
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InChIKey |
YEGCCSKZPHGALE-LEWJYISDSA-N
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PubChem Compound ID |
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