Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LB4KQ7
|
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| Ligand Name |
1,3-Dihydroisoindol-2-yl-[3-(3,4-dimethylphenyl)sulfanyl-4-hydroxyphenyl]methanone
|
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| Structure |
 |
Download2D MOL |
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| Formula |
C23H21NO2S
|
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| Canonical SMILES |
CC1=C(C=C(C=C1)SC2=C(C=CC(=C2)C(=O)N3CC4=CC=CC=C4C3)O)C
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| InChI |
1S/C23H21NO2S/c1-15-7-9-20(11-16(15)2)27-22-12-17(8-10-21(22)25)23(26)24-13-18-5-3-4-6-19(18)14-24/h3-12,25H,13-14H2,1-2H3
|
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| InChIKey |
AXEQZLWHIYQNKM-UHFFFAOYSA-N
|
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| PubChem Compound ID | ||||
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