Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LC9H3P
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| Ligand Name |
(~{N}~{Z},2~{R})-~{N}-[5-(5-azanylpyridin-3-yl)-4-ethanoyl-3~{H}-1,3-thiazol-2-ylidene]-1-[2-[4,4-bis(fluoranyl)cyclohexyl]ethyl]piperazine-2-carboxamide
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| Synonyms |
CHEMBL4636300; (~{N}~{Z},2~{R})-~{N}-[5-(5-azanylpyridin-3-yl)-4-ethanoyl-3~{H}-1,3-thiazol-2-ylidene]-1-[2-[4,4-bis(fluoranyl)cyclohexyl]ethyl]piperazine-2-carboxamide; BDBM50543338; BQE
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| Structure |
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Download2D MOL |
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| Formula |
C23H30F2N6O2S
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| Canonical SMILES |
CC(=O)C1=C(SC(=N1)NC(=O)C2CNCCN2CCC3CCC(CC3)(F)F)C4=CC(=CN=C4)N
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| InChI |
1S/C23H30F2N6O2S/c1-14(32)19-20(16-10-17(26)12-28-11-16)34-22(29-19)30-21(33)18-13-27-7-9-31(18)8-4-15-2-5-23(24,25)6-3-15/h10-12,15,18,27H,2-9,13,26H2,1H3,(H,29,30,33)/t18-/m1/s1
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| InChIKey |
OVBCFTIQGNIZAI-GOSISDBHSA-N
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| PubChem Compound ID | ||||
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