Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LHP69Q
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| Ligand Name |
ethyl (5S)-3-(3,4-difluorobenzoyl)-1,1-dimethyl-2,4,5,6-tetrahydroazepino[4,5-b]indole-5-carboxylate
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| Structure |
 |
Download2D MOL |
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| Formula |
C24H24F2N2O3
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| Canonical SMILES |
CCOC(=O)C1CN(CC(C2=C1NC3=CC=CC=C32)(C)C)C(=O)C4=CC(=C(C=C4)F)F
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| InChI |
1S/C24H24F2N2O3/c1-4-31-23(30)16-12-28(22(29)14-9-10-17(25)18(26)11-14)13-24(2,3)20-15-7-5-6-8-19(15)27-21(16)20/h5-11,16,27H,4,12-13H2,1-3H3/t16-/m0/s1
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| InChIKey |
CTKZFOFWQDITSZ-INIZCTEOSA-N
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| PubChem Compound ID | ||||
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