Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L1I5JS
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| Ligand Name |
(2r,5r)-4-[2-(6-Chloro-3,3-Dimethyl-2,3-Dihydro-1h-Pyrrolo[3,2-C]pyridin-1-Yl)-2-Oxoethyl]-5-(Methoxymethyl)-2-Methylpiperazin-1-Ium
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| Synonyms |
(2r,5r)-4-[2-(6-Chloro-3,3-Dimethyl-2,3-Dihydro-1h-Pyrrolo[3,2-C]pyridin-1-Yl)-2-Oxoethyl]-5-(Methoxymethyl)-2-Methylpiperazin-1-Ium; Q27455288; 4YL
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| Structure |
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Download2D MOL |
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| Formula |
C18H28ClN4O2+
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| Canonical SMILES |
CC1CN(C(C[NH2+]1)COC)CC(=O)N2CC(C3=CN=C(C=C32)Cl)(C)C
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| InChI |
1S/C18H27ClN4O2/c1-12-8-22(13(6-20-12)10-25-4)9-17(24)23-11-18(2,3)14-7-21-16(19)5-15(14)23/h5,7,12-13,20H,6,8-11H2,1-4H3/p+1/t12-,13-/m1/s1
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| InChIKey |
CQGZTNZASZVTQR-CHWSQXEVSA-O
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| PubChem Compound ID | ||||
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