Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L8J4FS
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| Ligand Name |
N'-{(1S,2S)-1-(3,5-difluorobenzyl)-2-hydroxy-2-[(2R)-4-(phenylsulfonyl)piperazin-2-yl]ethyl}-5-methyl-N,N-dipropylbenzene-1,3-dicarboxamide
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| Synonyms |
CHEMBL1097319; N'-{(1S,2S)-1-(3,5-difluorobenzyl)-2-hydroxy-2-[(2R)-4-(phenylsulfonyl)piperazin-2-yl]ethyl}-5-methyl-N,N-dipropylbenzene-1,3-dicarboxamide; SCHEMBL8292705; BDBM50317025; Q27467889; N''-{(1S,2S)-1-(3,5-difluorobenzyl)-2-hydroxy-2-[(2R)-4-(phenylsulfonyl)piperazin-2-yl]ethyl}-5-methyl-N,N-dipropylbenzene-1,3-dicarboxamide; N1-((1S,2S)-3-(3,5-difluorophenyl)-1-hydroxy-1-((R)-4-(phenylsulfonyl)piperazin-2-yl)propan-2-yl)-5-methyl-N3,N3-dipropylisophthalamide; Z74
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| Structure |
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Download2D MOL |
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| Formula |
C34H42F2N4O5S
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| Canonical SMILES |
CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)NC(CC2=CC(=CC(=C2)F)F)C(C3CN(CCN3)S(=O)(=O)C4=CC=CC=C4)O)C
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| InChI |
1S/C34H42F2N4O5S/c1-4-12-39(13-5-2)34(43)26-16-23(3)15-25(20-26)33(42)38-30(19-24-17-27(35)21-28(36)18-24)32(41)31-22-40(14-11-37-31)46(44,45)29-9-7-6-8-10-29/h6-10,15-18,20-21,30-32,37,41H,4-5,11-14,19,22H2,1-3H3,(H,38,42)/t30-,31+,32-/m0/s1
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| InChIKey |
KDRUCCZCGHVXGH-QAXCHELISA-N
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| PubChem Compound ID | ||||
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