VIDOFLUDIMUS

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 8Y1PJ3VG81

Structure
InChI Key XPRDUGXOWVXZLL-UHFFFAOYSA-N
Smile COc1cccc(-c2ccc(NC(=O)C3=C(C(=O)O)CCC3)c(F)c2)c1
InChI
InChI=1S/C20H18FNO4/c1-26-14-5-2-4-12(10-14)13-8-9-18(17(21)11-13)22-19(23)15-6-3-7-16(15)20(24)25/h2,4-5,8-11H,3,6-7H2,1H3,(H,22,23)(H,24,25)

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H18FNO4
Molecular Weight 355.37
AlogP 4.0
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 5.0
Polar Surface Area 75.63
Molecular species ACID
Aromatic Rings 2.0
Heavy Atoms 26.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Dihydroorotate dehydrogenase inhibitor PubMed PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Oxidoreductase
2754-2800 134-134 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Colitis, Ulcerative 2 D003093 ClinicalTrials
Arthritis, Rheumatoid 2 D001172 ClinicalTrials
Inflammatory Bowel Diseases 2 D015212 ClinicalTrials
Multiple Sclerosis 2 D009103 ClinicalTrials
Cholangitis, Sclerosing 2 D015209 ClinicalTrials
Severe Acute Respiratory Syndrome 2 D045169 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL197194
DrugBank DB15446
EPA CompTox DTXSID50431325
FDA SRS 8Y1PJ3VG81
Guide to Pharmacology 9860
PDB D5H
PubChem 9820008
SureChEMBL SCHEMBL247888
ZINC ZINC000014960644
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