Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LM5SX3
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| Ligand Name |
N-[(2s)-5-(Carbamimidamidooxy)-1-Oxo-1-{[(1e,3s)-5-Phenyl-1-(Phenylsulfonyl)pent-1-En-3-Yl]amino}pentan-2-Yl]-4-Methylpiperazine-1-Carboxamide
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| Synonyms |
CHEMBL3775996; N-[(2s)-5-(Carbamimidamidooxy)-1-Oxo-1-{[(1e,3s)-5-Phenyl-1-(Phenylsulfonyl)pent-1-En-3-Yl]amino}pentan-2-Yl]-4-Methylpiperazine-1-Carboxamide
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| Structure |
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Download2D MOL
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| Formula |
C29H41N7O5S
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| Canonical SMILES |
CN1CCN(CC1)C(=O)NC(CCCON=C(N)N)C(=O)NC(CCC2=CC=CC=C2)C=CS(=O)(=O)C3=CC=CC=C3
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| InChI |
1S/C29H41N7O5S/c1-35-17-19-36(20-18-35)29(38)33-26(13-8-21-41-34-28(30)31)27(37)32-24(15-14-23-9-4-2-5-10-23)16-22-42(39,40)25-11-6-3-7-12-25/h2-7,9-12,16,22,24,26H,8,13-15,17-21H2,1H3,(H,32,37)(H,33,38)(H4,30,31,34)/b22-16+/t24-,26-/m0/s1
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| InChIKey |
DZJHVBWYGRMDSW-GQCXWPLSSA-N
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| PubChem Compound ID | ||||
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