Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L64XRA
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| Ligand Name |
Ethyl N-{2-Chloro-4-[5-(5-{[(1s)-1-(3-Chloro-4-Fluorophenyl)-2-Hydroxyethyl]carbamoyl}-1h-Pyrrol-3-Yl)-1h-Pyrazol-4-Yl]benzyl}glycinate
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| Synonyms |
Ethyl N-{2-Chloro-4-[5-(5-{[(1s)-1-(3-Chloro-4-Fluorophenyl)-2-Hydroxyethyl]carbamoyl}-1h-Pyrrol-3-Yl)-1h-Pyrazol-4-Yl]benzyl}glycinate; EK6
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| Structure |
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Download2D MOL |
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| Formula |
C27H26Cl2FN5O4
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| Canonical SMILES |
CCOC(=O)CNCC1=C(C=C(C=C1)C2=C(NN=C2)C3=CNC(=C3)C(=O)NC(CO)C4=CC(=C(C=C4)F)Cl)Cl
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| InChI |
1S/C27H26Cl2FN5O4/c1-2-39-25(37)13-31-10-17-4-3-15(7-20(17)28)19-12-33-35-26(19)18-9-23(32-11-18)27(38)34-24(14-36)16-5-6-22(30)21(29)8-16/h3-9,11-12,24,31-32,36H,2,10,13-14H2,1H3,(H,33,35)(H,34,38)/t24-/m1/s1
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| InChIKey |
VVRLXUNPTACSJC-XMMPIXPASA-N
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| PubChem Compound ID | ||||
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