GW-274150

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 0ZZF1V8G63

Structure
InChI Key MOLOJNHYNHBPCW-ZETCQYMHSA-N
Smile CC(=N)NCCSCC[C@H](N)C(=O)O
InChI
InChI=1S/C8H17N3O2S/c1-6(9)11-3-5-14-4-2-7(10)8(12)13/h7H,2-5,10H2,1H3,(H2,9,11)(H,12,13)/t7-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C8H17N3O2S
Molecular Weight 219.31
AlogP 0.11
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 7.0
Polar Surface Area 99.2
Molecular species ZWITTERION
Aromatic Rings 0.0
Heavy Atoms 14.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Nitric oxide synthase, inducible inhibitor PubMed PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme
- 70-1413 - - 26

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Arthritis, Rheumatoid 2 D001172 ClinicalTrials
Migraine Disorders 2 D008881 ClinicalTrials
Asthma 1 D001249 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL114551
DrugBank DB12237
FDA SRS 0ZZF1V8G63
Guide to Pharmacology 9849
PubChem 9797017
SureChEMBL SCHEMBL120693
ZINC ZINC000002004483
CONTENTS