Details of the Drug

General Information of Drug (ID: DMUHKYW)

Drug Name

N-(5-Hydroxycarbamoyl-pentyl)-4-methoxy-benzamide

Synonyms

CHEMBL143802; N-(5-Hydroxycarbamoyl-pentyl)-4-methoxy-benzamide; SCHEMBL1233091; BDBM50082663; ZINC13801951; 6-[(4-Methoxybenzoyl)amino]hexanehydroxamic acid

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)

280.32

Logarithm of the Partition Coefficient (xlogp)

1

Rotatable Bond Count (rotbonds)

8

Hydrogen Bond Donor Count (hbonddonor)

3

Hydrogen Bond Acceptor Count (hbondacc)

4

Chemical Identifiers

Formula: C14H20N2O4
IUPAC Name: N-[6-(hydroxyamino)-6-oxohexyl]-4-methoxybenzamide
Canonical SMILES: COC1=CC=C(C=C1)C(=O)NCCCCCC(=O)NO
InChI: InChI=1S/C14H20N2O4/c1-20-12-8-6-11(7-9-12)14(18)15-10-4-2-3-5-13(17)16-19/h6-9,19H,2-5,10H2,1H3,(H,15,18)(H,16,17)
InChIKey: ZSXRABTZDFXDGV-UHFFFAOYSA-N

Cross-matching ID

PubChem CID: 9835402
TTD ID: D0ME6Y

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Histone deacetylase (HDAC)	TTBH0VX	NOUNIPROTAC	Inhibitor	[1]

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Molecular Interaction Atlas (MIA)

MIA Detail

Jump to Detail Molecular Interaction Atlas of This Drug

References

1	Amide analogues of trichostatin A as inhibitors of histone deacetylase and inducers of terminal cell differentiation. J Med Chem. 1999 Nov 4;42(22):4669-79.