Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LI1LP5
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| Ligand Name |
(2R)-1-[4-(4-acetyl-3-ethyl-5-methyl-1H-pyrrol-2-yl)-1,3-thiazol-2-yl]-N-(2,2-dimethylpropyl)piperazine-2-carboxamide
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| Structure |
 |
Download2D MOL |
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| Formula |
C22H33N5O2S
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| Canonical SMILES |
CCC1=C(NC(=C1C(=O)C)C)C2=CSC(=N2)N3CCNCC3C(=O)NCC(C)(C)C
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| InChI |
1S/C22H33N5O2S/c1-7-15-18(14(3)28)13(2)25-19(15)16-11-30-21(26-16)27-9-8-23-10-17(27)20(29)24-12-22(4,5)6/h11,17,23,25H,7-10,12H2,1-6H3,(H,24,29)/t17-/m1/s1
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| InChIKey |
BIQUDHDFGPBAHX-QGZVFWFLSA-N
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| PubChem Compound ID | ||||
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