Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L4CS3J
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| Ligand Name |
(2~{S})-1-[2,4-bis(chloranyl)-3-[[4-imidazol-1-yl-2-(trifluoromethyl)quinolin-8-yl]oxymethyl]phenyl]sulfonyl-~{N}-methyl-pyrrolidine-2-carboxamide
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| Synonyms |
CHEMBL4787298; (2~{S})-1-[2,4-bis(chloranyl)-3-[[4-imidazol-1-yl-2-(trifluoromethyl)quinolin-8-yl]oxymethyl]phenyl]sulfonyl-~{N}-methyl-pyrrolidine-2-carboxamide; BDBM50546016; HBW
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| Structure |
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Download2D MOL |
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| Formula |
C26H22Cl2F3N5O4S
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| Canonical SMILES |
CNC(=O)C1CCCN1S(=O)(=O)C2=C(C(=C(C=C2)Cl)COC3=CC=CC4=C3N=C(C=C4N5C=CN=C5)C(F)(F)F)Cl
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| InChI |
1S/C26H22Cl2F3N5O4S/c1-32-25(37)18-5-3-10-36(18)41(38,39)21-8-7-17(27)16(23(21)28)13-40-20-6-2-4-15-19(35-11-9-33-14-35)12-22(26(29,30)31)34-24(15)20/h2,4,6-9,11-12,14,18H,3,5,10,13H2,1H3,(H,32,37)/t18-/m0/s1
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| InChIKey |
YPZVBDHGFDAMKP-SFHVURJKSA-N
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| PubChem Compound ID | ||||
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