Details of the Drug

General Information of Drug (ID: DMP5M9E)

Drug Name

4,6-Dideoxyglucose

Synonyms

4,6-DIDEOXYGLUCOSE; AC1NRBIQ; ZINC12501177; DB01841; 4,6-dideoxy-alpha-D-xylo-hexopyranose

Indication

Disease Entry	ICD 11	Status	REF
Discovery agent	N.A.	Investigative	[1]
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Drug Type

Small molecular drug

Structure

3D MOL

2D MOL

#Ro5 Violations (Lipinski): 0

Molecular Weight (mw)

148.16

Logarithm of the Partition Coefficient (xlogp)

-1.1

Rotatable Bond Count (rotbonds)

0

Hydrogen Bond Donor Count (hbonddonor)

3

Hydrogen Bond Acceptor Count (hbondacc)

4

Chemical Identifiers

Formula: C6H12O4
IUPAC Name: (2S,3R,4S,6R)-6-methyloxane-2,3,4-triol
Canonical SMILES: C[C@@H]1C[C@@H]([C@H]([C@H](O1)O)O)O
InChI: InChI=1S/C6H12O4/c1-3-2-4(7)5(8)6(9)10-3/h3-9H,2H2,1H3/t3-,4+,5-,6+/m1/s1
InChIKey: BJBURJZEESAQPG-MOJAZDJTSA-N

Cross-matching ID

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Alpha-glucosidase (GLA)	TTHCF4J	LYAG_HUMAN ; GANAB_HUMAN ; GANC_HUMAN	Inhibitor	[1]

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Molecular Interaction Atlas (MIA)

Jump to Detail Molecular Interaction Atlas of This Drug

References

1	How many drug targets are there Nat Rev Drug Discov. 2006 Dec;5(12):993-6.