Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LEX4P7
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| Ligand Name |
N-[(1s,2r)-1-Benzyl-2-Hydroxy-3-{[3-(Trifluoromethyl)benzyl]amino}propyl]-3-(1,1-Dioxido-1,2-Thiazinan-2-Yl)-5-(Ethylamino)benzamide
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| Synonyms |
2vnm; N-[(1s,2r)-1-Benzyl-2-Hydroxy-3-{[3-(Trifluoromethyl)benzyl]amino}propyl]-3-(1,1-Dioxido-1,2-Thiazinan-2-Yl)-5-(Ethylamino)benzamide; BMCL181022 Compound 7; BMCL193664 Compound 9; BMCL193669 Compound 8; CHEMBL401473; BMCL193664 Compound 24; BDBM26502; sultam hydroxyethylamine (HEA) derivative, 1; Q27458856; 3-(1,1-dioxo-1$l^{6},2-thiazinan-2-yl)-5-(ethylamino)-N-[(2S,3R)-3-hydroxy-1-phenyl-4-({[3-(trifluoromethyl)phenyl]methyl}amino)butan-2-yl]benzamide
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| Structure |
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Download2D MOL |
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| Formula |
C31H37F3N4O4S
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| Canonical SMILES |
CCNC1=CC(=CC(=C1)C(=O)NC(CC2=CC=CC=C2)C(CNCC3=CC(=CC=C3)C(F)(F)F)O)N4CCCCS4(=O)=O
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| InChI |
1S/C31H37F3N4O4S/c1-2-36-26-17-24(18-27(19-26)38-13-6-7-14-43(38,41)42)30(40)37-28(16-22-9-4-3-5-10-22)29(39)21-35-20-23-11-8-12-25(15-23)31(32,33)34/h3-5,8-12,15,17-19,28-29,35-36,39H,2,6-7,13-14,16,20-21H2,1H3,(H,37,40)/t28-,29+/m0/s1
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| InChIKey |
GPMRAYXRPZKTFK-URLMMPGGSA-N
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| PubChem Compound ID | ||||
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