Details of the Drug

General Information of Drug (ID: DM9CF45)

Drug Name

thiadiazolidinone (TDZD) deriv. 6

Synonyms

Thiadiazolidinone (TDZD) deriv. 6; 4-butyl-2-ethyl-1,2,4-thiadiazolidine-3,5-dione; RGS4 inhibitor 11b; CCG 203769; AC1O6Z6H; CHEMBL24773; GTPL8033; BDBM7779; SCHEMBL13517142; HY-U00431; 410074-60-1; CS-0035365; 2-ethyl-4-butyl-1,2,4-thiadiazolidine-3,5-dione

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 is unavailable

2D MOL

#Ro5 Violations (Lipinski): 0

Molecular Weight (mw)

202.28

Logarithm of the Partition Coefficient (xlogp)

1.6

Rotatable Bond Count (rotbonds)

4

Hydrogen Bond Donor Count (hbonddonor)

0

Hydrogen Bond Acceptor Count (hbondacc)

3

Chemical Identifiers

Formula: C8H14N2O2S
IUPAC Name: 4-butyl-2-ethyl-1,2,4-thiadiazolidine-3,5-dione
Canonical SMILES: CCCCN1C(=O)N(SC1=O)CC
InChI: InChI=1S/C8H14N2O2S/c1-3-5-6-9-7(11)10(4-2)13-8(9)12/h3-6H2,1-2H3
InChIKey: WTFFYZGCISALRI-UHFFFAOYSA-N

Cross-matching ID

PubChem CID: 6539137
TTD ID: D05AMQ

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Regulator of G-protein signaling 4 (RGS4)	TTGTKX9	RGS4_HUMAN	Inhibitor	[2]
Regulator of G-protein signaling 8 (RGS8)	TTWME23	RGS8_HUMAN	Inhibitor	[3]

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Molecular Interaction Atlas (MIA)

MIA Detail

Jump to Detail Molecular Interaction Atlas of This Drug

References

1	URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 8033).
2	URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Target id: 2811).
3	URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Target id: 2813).