Details of the Drug

General Information of Drug (ID: DM8XT1Y)

Drug Name

ASOBAMAST

Synonyms

Asobamast < Rec INN; Z-1819; N-[4-(3-Methylisoxazol-5-yl)thiazol-2-yl]oxamic acid 2-ethoxyethyl ester

Indication

Disease Entry	ICD 11	Status	REF
Asthma	CA23	Investigative	[1]
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Drug Type

Small molecular drug

Structure

3D MOL

2D MOL

#Ro5 Violations (Lipinski): 0

Molecular Weight (mw)

325.34

Logarithm of the Partition Coefficient (xlogp)

1.5

Rotatable Bond Count (rotbonds)

8

Hydrogen Bond Donor Count (hbonddonor)

1

Hydrogen Bond Acceptor Count (hbondacc)

8

Chemical Identifiers

Formula: C13H15N3O5S
IUPAC Name: 2-ethoxyethyl 2-[[4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-yl]amino]-2-oxoacetate
Canonical SMILES: CCOCCOC(=O)C(=O)NC1=NC(=CS1)C2=CC(=NO2)C
InChI: InChI=1S/C13H15N3O5S/c1-3-19-4-5-20-12(18)11(17)15-13-14-9(7-22-13)10-6-8(2)16-21-10/h6-7H,3-5H2,1-2H3,(H,14,15,17)
InChIKey: IKYTUOHXXXPNOG-UHFFFAOYSA-N

Cross-matching ID

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Leukotriene biosynthesis (LT synth)	TTMPGNS	NOUNIPROTAC	Modulator	[1]

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Molecular Interaction Atlas (MIA)

Jump to Detail Molecular Interaction Atlas of This Drug

References

1	Regulation of leukotriene biosynthesis. Cancer Metastasis Rev. 1994 Dec;13(3-4):257-67.