(5S)-2-[2-(4-bromophenyl)sulfonylethyl]-N-[(4-carbamimidoylcyclohexyl)methyl]-1,3-dioxo-5,8-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-5-carboxamide结构式
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常用名 | (5S)-2-[2-(4-bromophenyl)sulfonylethyl]-N-[(4-carbamimidoylcyclohexyl)methyl]-1,3-dioxo-5,8-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-5-carboxamide | 英文名 | (5S)-2-[2-(4-bromophenyl)sulfonylethyl]-N-[(4-carbamimidoylcyclohexyl)methyl]-1,3-dioxo-5,8-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-5-carboxamide |
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| CAS号 | 14291-02-2 | 分子量 | 581.5 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C23H29BrN6O5S | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
| 英文名 | (5S)-2-[2-(4-bromophenyl)sulfonylethyl]-N-[(4-carbamimidoylcyclohexyl)methyl]-1,3-dioxo-5,8-dihydro-[1,2,4]triazolo[1,2-a]pyridazine-5-carboxamide |
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| 分子式 | C23H29BrN6O5S |
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| 分子量 | 581.5 |
| InChIKey | CAGDDDRYEVLPOJ-RJYAGPCLSA-N |
| SMILES | C1CC(CCC1CNC(=O)[C@@H]2C=CCN3N2C(=O)N(C3=O)CCS(=O)(=O)C4=CC=C(C=C4)Br)C(=N)N |
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实验名称:Experimentally measured binding affinity data (Ki) for protein-ligand complexes deriv...
来源:Shanghai Institute of Organic Chemistry
靶标:N/A
External Id:PDBbind-Ki for protein-ligand complexes
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