Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D08HVG
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| Former ID |
DIB003007
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| Drug Name |
BAL-8557
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| Synonyms |
Drochloride; Monohydrochloride; RO-0098557; N-Methylglycine [2-[N-[1-[1-[(2R,3R)-3-[4-(4-cyanophenyl)-2-thiazolyl]-2-(2,5-difluorophenyl)-2-hydroxybutyl]-1H-1,2,4-triazolium-4-yl]ethoxy]carbonyl]-N-methylamino]-3-pyridinyl]methyl ester chloride; 1-[3(R)-[4-(4-Cyanophenyl)thiazol-2-yl]-2(R)-(2,5-difluorophenyl)-2-hydroxybutyl]-4-[1-[N-methyl-N-[3-[2-(methylamino)acetoxymethyl]pyridin-2-yl]carbamoyloxy]ethyl]-1H-1,2,4-triazol-4-ium chloride, hy
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| Drug Type |
Small molecular drug
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| Indication | Fungal infection [ICD-11: 1F29-1F2F; ICD-10: B35-B49; ICD-9: 110-118] | Phase 3 | [1] | |
| Structure |
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Download2D MOL
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| Formula |
C35H35F2N8O5S+
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| Canonical SMILES |
CC(C1=NC(=CS1)C2=CC=C(C=C2)C#N)C(CN3C=[N+](C=N3)C(C)OC(=O)N(C)C4=C(C=CC=N4)COC(=O)CNC)(C5=C(C=CC(=C5)F)F)O
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| InChI |
1S/C35H35F2N8O5S/c1-22(33-42-30(18-51-33)25-9-7-24(15-38)8-10-25)35(48,28-14-27(36)11-12-29(28)37)19-45-21-44(20-41-45)23(2)50-34(47)43(4)32-26(6-5-13-40-32)17-49-31(46)16-39-3/h5-14,18,20-23,39,48H,16-17,19H2,1-4H3/q+1/t22-,23?,35+/m0/s1
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| InChIKey |
RSWOJTICKMKTER-QXLBVTBOSA-N
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| CAS Number |
CAS 742049-41-8
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| PubChem Compound ID | ||||
| PubChem Substance ID |
448227, 794404, 6291933, 10664341, 12266656, 14995950, 29216232, 29284650, 32961138, 50006856, 57329539, 74348346, 80622934, 104340902, 108168353, 117440456, 118232250, 127927653, 131306349, 135023717, 137231993, 138568894, 138853889, 144205444, 160687840, 179113149, 179225192, 184535009, 184585253, 198935615, 223558144, 223558145, 223704711, 226414787, 226414788, 241173869, 242570053, 252494490
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| ChEBI ID |
CHEBI:85978
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| References | Top | |||
|---|---|---|---|---|
| REF 1 | ClinicalTrials.gov (NCT00412893) Isavuconazole (BAL8557) for Primary Treatment of Invasive Aspergillosis. U.S. National Institutes of Health. | |||
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