Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LE7O5U
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| Ligand Name |
(2e)-N-[(1s)-1-[5-Chloro-4-(4-Hydroxy-2-Oxo-1,2-Dihydroquinolin-6-Yl)-1h-Imidazol-2-Yl]-3-(4-Methylpiperazin-1-Yl)-3-Oxopropyl]-3-[5-Chloro-2-(1h-Tetrazol-1-Yl)phenyl]prop-2-Enamide
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| Synonyms |
(2e)-N-[(1s)-1-[5-Chloro-4-(4-Hydroxy-2-Oxo-1,2-Dihydroquinolin-6-Yl)-1h-Imidazol-2-Yl]-3-(4-Methylpiperazin-1-Yl)-3-Oxopropyl]-3-[5-Chloro-2-(1h-Tetrazol-1-Yl)phenyl]prop-2-Enamide; Q27454594; 4CE
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| Structure |
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Download2D MOL |
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| Formula |
C30H28Cl2N10O4
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| Canonical SMILES |
CN1CCN(CC1)C(=O)CC(C2=NC(=C(N2)Cl)C3=CC4=C(C=C3)NC(=O)C=C4O)NC(=O)C=CC5=C(C=CC(=C5)Cl)N6C=NN=N6
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| InChI |
1S/C30H28Cl2N10O4/c1-40-8-10-41(11-9-40)27(46)14-22(35-25(44)7-3-17-12-19(31)4-6-23(17)42-16-33-38-39-42)30-36-28(29(32)37-30)18-2-5-21-20(13-18)24(43)15-26(45)34-21/h2-7,12-13,15-16,22H,8-11,14H2,1H3,(H,35,44)(H,36,37)(H2,34,43,45)/b7-3+/t22-/m0/s1
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| InChIKey |
NBMJTOOHXJGJNZ-RJOTYRNVSA-N
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| PubChem Compound ID | ||||
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