Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
LD37BY
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Ligand Name |
N-[(2s,3r)-4-{[(2r,4s)-2-Cyclopropyl-6-(2,2-Dimethylpropyl)-3,4-Dihydro-2h-Chromen-4-Yl]amino}-1-(3,5-Difluorophenyl)-3-Hydroxybutan-2-Yl]acetamide
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Synonyms |
N-[(2s,3r)-4-{[(2r,4s)-2-Cyclopropyl-6-(2,2-Dimethylpropyl)-3,4-Dihydro-2h-Chromen-4-Yl]amino}-1-(3,5-Difluorophenyl)-3-Hydroxybutan-2-Yl]acetamide; Q27458670; C6A
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Structure |
Download2D MOL |
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Formula |
C29H38F2N2O3
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Canonical SMILES |
CC(=O)NC(CC1=CC(=CC(=C1)F)F)C(CNC2CC(OC3=C2C=C(C=C3)CC(C)(C)C)C4CC4)O
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InChI |
1S/C29H38F2N2O3/c1-17(34)33-25(12-19-9-21(30)13-22(31)10-19)26(35)16-32-24-14-28(20-6-7-20)36-27-8-5-18(11-23(24)27)15-29(2,3)4/h5,8-11,13,20,24-26,28,32,35H,6-7,12,14-16H2,1-4H3,(H,33,34)/t24-,25-,26+,28+/m0/s1
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InChIKey |
IBLLHMQPQAMFLM-WDTRASESSA-N
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PubChem Compound ID |
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