Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L0LX1S
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| Ligand Name |
N-[(2S)-1-[(3R,3aR,6S,6aS)-6-fluoro-3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]pyrrol-4-yl]-4-methyl-1-oxopentan-2-yl]-4-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-4-yl]benzamide
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| Structure |
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Download2D MOL |
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| Formula |
C27H36FN5O4S
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| Canonical SMILES |
CC(C)CC(C(=O)N1CC(C2C1C(CO2)O)F)NC(=O)C3=CC=C(C=C3)C4=CSC(=N4)N5CCN(CC5)C
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| InChI |
1S/C27H36FN5O4S/c1-16(2)12-20(26(36)33-13-19(28)24-23(33)22(34)14-37-24)29-25(35)18-6-4-17(5-7-18)21-15-38-27(30-21)32-10-8-31(3)9-11-32/h4-7,15-16,19-20,22-24,34H,8-14H2,1-3H3,(H,29,35)/t19-,20-,22-,23+,24+/m0/s1
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| InChIKey |
BJRXVCXTMWVZKF-KVFBUXGHSA-N
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| PubChem Compound ID | ||||
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