Details of the Drug

General Information of Drug (ID: DMSF8B9)

Drug Name

GC-24

Synonyms

GC 24; N-[2-(dimethylamino)ethyl]-2-methylpropanamide; Propanamide, N-(2-(dimethylamino)ethyl)-2-methyl-; BRN 2350680; 63224-17-9; N-(2-(Dimethylamino)ethyl)-2-methylpropanamide; AC1MIL8W; SCHEMBL2624391; DTXSID70212592; MolPort-008-439-279; ZINC11638438; AKOS009104316; MCULE-5485385679; NE11932; LS-119191; N-(2-dimethylaminoethyl)-2-methylpropanamide; EN300-86303

Indication

Disease Entry	ICD 11	Status	REF
Hyperthyroidism	5A02	Investigative	[1]
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Drug Type

Small molecular drug

Structure

3D MOL

2D MOL

#Ro5 Violations (Lipinski): 1

Molecular Weight (mw)

376.4

Logarithm of the Partition Coefficient (xlogp)

5.7

Rotatable Bond Count (rotbonds)

7

Hydrogen Bond Donor Count (hbonddonor)

2

Hydrogen Bond Acceptor Count (hbondacc)

4

Chemical Identifiers

Formula: C24H24O4
IUPAC Name: 2-[4-[(3-benzyl-4-hydroxyphenyl)methyl]-3,5-dimethylphenoxy]acetic acid
Canonical SMILES: CC1=CC(=CC(=C1CC2=CC(=C(C=C2)O)CC3=CC=CC=C3)C)OCC(=O)O
InChI: InChI=1S/C24H24O4/c1-16-10-21(28-15-24(26)27)11-17(2)22(16)14-19-8-9-23(25)20(13-19)12-18-6-4-3-5-7-18/h3-11,13,25H,12,14-15H2,1-2H3,(H,26,27)
InChIKey: JYHIGYLGYNCMGI-UHFFFAOYSA-N

Cross-matching ID

PubChem CID: 448011
DrugBank ID: DB03788
TTD ID: D06WJC

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Thyroid hormone receptor beta (THRB)	TTGER3L	THB_HUMAN	Inhibitor	[1]

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Molecular Interaction Atlas (MIA)

MIA Detail

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.