DIROXIMEL FUMARATE

Search structure
Synonyms:
Status: Approved (2019)
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: K0N0Z40J3W

Structure
InChI Key YIMYDTCOUQIDMT-SNAWJCMRSA-N
Smile COC(=O)/C=C/C(=O)OCCN1C(=O)CCC1=O
InChI
InChI=1S/C11H13NO6/c1-17-10(15)4-5-11(16)18-7-6-12-8(13)2-3-9(12)14/h4-5H,2-3,6-7H2,1H3/b5-4+

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H13NO6
Molecular Weight 255.23
AlogP -0.59
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 5.0
Polar Surface Area 89.98
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 18.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Kelch-like ECH-associated protein 1 inhibitor FDA PubMed PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Multiple Sclerosis 4 D009103 ClinicalTrials
Multiple Sclerosis, Relapsing-Remitting 3 D020529 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL3989944
DrugBank DB14783
FDA SRS K0N0Z40J3W
Guide to Pharmacology 10525
PubChem 73330464
SureChEMBL SCHEMBL15499960
ZINC ZINC000215286156
CONTENTS