MERIMEPODIB

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 2ZL2BA06FU

Structure
InChI Key JBPUGFODGPKTDW-SFHVURJKSA-N
Smile COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1
InChI
InChI=1S/C23H24N4O6/c1-30-20-10-17(5-6-19(20)21-12-24-14-32-21)27-22(28)26-16-4-2-3-15(9-16)11-25-23(29)33-18-7-8-31-13-18/h2-6,9-10,12,14,18H,7-8,11,13H2,1H3,(H,25,29)(H2,26,27,28)/t18-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C23H24N4O6
Molecular Weight 452.47
AlogP 4.01
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 7.0
Polar Surface Area 123.95
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 33.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Inosine-5'-monophosphate dehydrogenase 1 inhibitor PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Oxidoreductase
- 10-11 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Severe Acute Respiratory Syndrome 2 D045169 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 198821-22-6
ChEMBL CHEMBL304087
DrugBank DB04862
EPA CompTox DTXSID70173639
FDA SRS 2ZL2BA06FU
Guide to Pharmacology 10741
PubChem 153241
SureChEMBL SCHEMBL329922
ZINC ZINC000003975663
CONTENTS