Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LGT78V
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| Ligand Name |
3-({6-Chloro-7-Fluoro-2-Methyl-1-[2-Oxo-2-(Spiro[cyclopropane-1,3'-Indol]-1'(2'h)-Yl)ethyl]-1h-Indol-3-Yl}sulfanyl)-2-Fluorobenzoic Acid
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| Synonyms |
PAT-347; 3-({6-Chloro-7-Fluoro-2-Methyl-1-[2-Oxo-2-(Spiro[cyclopropane-1,3'-Indol]-1'(2'h)-Yl)ethyl]-1h-Indol-3-Yl}sulfanyl)-2-Fluorobenzoic Acid; CHEMBL4117054; SCHEMBL16600569; HY-126233; CS-0100496; Q27454846; 3-((6-Chloro-7-fluoro-2-methyl-1-(2-oxo-2-(spiro[cyclopropane-1, 3'-indolin]-1'-yl) ethyl)-1H-indol-3-yl) thio)-2-fluorobenzoic acid; 4O0
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| Structure |
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Download2D MOL |
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| Formula |
C28H21ClF2N2O3S
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| Canonical SMILES |
CC1=C(C2=C(N1CC(=O)N3CC4(CC4)C5=CC=CC=C53)C(=C(C=C2)Cl)F)SC6=CC=CC(=C6F)C(=O)O
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| InChI |
1S/C28H21ClF2N2O3S/c1-15-26(37-21-8-4-5-16(23(21)30)27(35)36)17-9-10-19(29)24(31)25(17)32(15)13-22(34)33-14-28(11-12-28)18-6-2-3-7-20(18)33/h2-10H,11-14H2,1H3,(H,35,36)
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| InChIKey |
YFALJJNRFPFPRE-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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