Details of the Drug

General Information of Drug (ID: DMEC1PS)

Drug Name

4-Dimethylamino-2,6-diisopropyl-phenol

Synonyms

CHEMBL55136; ZINC13779581

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)

221.34

Logarithm of the Partition Coefficient (xlogp)

3.9

Rotatable Bond Count (rotbonds)

3

Hydrogen Bond Donor Count (hbonddonor)

1

Hydrogen Bond Acceptor Count (hbondacc)

2

Chemical Identifiers

Formula: C14H23NO
IUPAC Name: 4-(dimethylamino)-2,6-di(propan-2-yl)phenol
Canonical SMILES: CC(C)C1=CC(=CC(=C1O)C(C)C)N(C)C
InChI: InChI=1S/C14H23NO/c1-9(2)12-7-11(15(5)6)8-13(10(3)4)14(12)16/h7-10,16H,1-6H3
InChIKey: BOEKREBRMTXRRJ-UHFFFAOYSA-N

Cross-matching ID

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Gamma-aminobutyric acid receptor (GAR)	TTNJYV2	NOUNIPROTAC	Inhibitor	[1]

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Molecular Interaction Atlas (MIA)

Jump to Detail Molecular Interaction Atlas of This Drug

References

1	Propofol analogues. Synthesis, relationships between structure and affinity at GABAA receptor in rat brain, and differential electrophysiological p... J Med Chem. 1998 May 21;41(11):1846-54.