PRASUGREL

Search structure
Synonyms:
Status: Approved (2009)
Entry Type: Small molecule
Molecule Category: Parent Prodrug
ATC: B01AC22
UNII: 34K66TBT99

Structure
InChI Key DTGLZDAWLRGWQN-UHFFFAOYSA-N
Smile CC(=O)Oc1cc2c(s1)CCN(C(C(=O)C1CC1)c1ccccc1F)C2
InChI
InChI=1S/C20H20FNO3S/c1-12(23)25-18-10-14-11-22(9-8-17(14)26-18)19(20(24)13-6-7-13)15-4-2-3-5-16(15)21/h2-5,10,13,19H,6-9,11H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H20FNO3S
Molecular Weight 373.45
AlogP 3.89
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 5.0
Polar Surface Area 46.61
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 26.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Transferase
- - - -
Epigenetic regulator Eraser Histone deacetylase HDAC class IIb
- - - - 2.83-8.67
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Nucleotide-like receptor (family A GPCR) Purine receptor
- 1800 - - -

Metabolites

visNetwork

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Kidney Failure, Chronic 3 D007676 ClinicalTrials
Myocardial Infarction 3 D009203 ClinicalTrials
Acute Coronary Syndrome 3 D054058 ClinicalTrials
Influenza, Human 3 D007251 ClinicalTrials
Anemia, Sickle Cell 3 D000755 ClinicalTrials
Severe Acute Respiratory Syndrome 3 D045169 ClinicalTrials
Atrial Fibrillation 3 D001281 ClinicalTrials
ST Elevation Myocardial Infarction 3 D000072657 ClinicalTrials
Coronary Disease 3 D003327 ClinicalTrials
Pneumonia 3 D011014 ClinicalTrials
Heart Diseases 2 D006331 ClinicalTrials
Cardiovascular Diseases 2 D002318 ClinicalTrials
Asthma 2 D001249 ClinicalTrials
HIV Infections 1 D015658 ClinicalTrials

Related Entries

Scaffolds

Salt

Cross References

Resources Reference
CAS NUMBER 150322-43-3
ChEBI 87723
ChEMBL CHEMBL1201772
DrugBank DB06209
DrugCentral 4113
FDA SRS 34K66TBT99
Human Metabolome Database HMDB0015625
Guide to Pharmacology 7562
PharmGKB PA154410481
PubChem 6918456
SureChEMBL SCHEMBL245032
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