Details of the Drug

General Information of Drug (ID: DMKA7H3)

Drug Name

Cresemba

Synonyms

Isavuconazonium sulfate; 946075-13-4; BAL-8557-002; Isavuconazonium sulfate [USAN]; CHEBI:85977; Isavuconazonium sulfate (USAN); UNII-31Q44514JV; BAL8557-002; 31Q44514JV; CHEMBL3137333; MolPort-044-559-915; AKOS030527357; Glycine, N-methyl-, (2-(((1-(1-((2R,3R)-3-(4-(4-cyanophenyl)-2-thiazolyl)-2-(2,5-difluorophenyl)-2-hydroxybutyl)-4H-1,2,4-triazolium-4-yl)ethoxy)carbonyl)methylamino)-3-pyridinyl)methyl ester, sulfate (1:1); AS-35043; SC-12899; 1-((2R,3R)-3-(4-(4-Cyanophenyl)-1,3-thiazol-2-yl)-2-(2,5-difluorophe

Indication

Disease Entry	ICD 11	Status	REF
Invasive aspergillosis	1F20.0	Phase 3	[1]
Haematological malignancy	2B33.Y	Phase 1	[2]

Structure

3D MOL

2D MOL

Chemical Identifiers

Formula: C35H36F2N8O9S2
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.OS(=O)(=O)[O-]
InChI: InChI=1S/C35H35F2N8O5S.H2O4S/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;1-5(2,3)4/h5-14,18,20-23,39,48H,16-17,19H2,1-4H3;(H2,1,2,3,4)/q+1;/p-1/t22-,23?,35+;/m0./s1
InChIKey: LWXUIUUOMSMZKJ-KLFWAVJMSA-M

Cross-matching ID

PubChem CID: 72196309
ChEBI ID: CHEMBL85977
CAS Number: 946075-13-4
TTD ID: D0DD4P

Drug-Molecule Activity Atlas (DMA)^NEW

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Drug ADMET Endpoint Profile (DAE)^NEW

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Repurposed Drugs (RPD)

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References

1	ClinicalTrials.gov (NCT03471988) Clinical Study of AK1820 (Isavuconazonium Sulfate) for the Treatment of Deep Mycosis. U.S. National Institutes of Health.
2	Clinical pipeline report, company report or official report of the Pharmaceutical Research and Manufacturers of America (PhRMA)