AMISELIMOD HYDROCHLORIDE

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: AY898D6RU1

Structure
InChI Key GEDVJGOVRLHFQG-UHFFFAOYSA-N
Smile CCCCCCCOc1ccc(CCC(N)(CO)CO)cc1C(F)(F)F.Cl
InChI
InChI=1S/C19H30F3NO3.ClH/c1-2-3-4-5-6-11-26-17-8-7-15(12-16(17)19(20,21)22)9-10-18(23,13-24)14-25;/h7-8,12,24-25H,2-6,9-11,13-14,23H2,1H3;1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H31ClF3NO3
Molecular Weight 413.91
AlogP 3.67
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 12.0
Polar Surface Area 75.71
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 26.0

Pharmacology

Action Mechanism of Action Reference
MODULATOR Sphingosine 1-phosphate receptor modulator PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Multiple Sclerosis, Relapsing-Remitting 2 D020529 ClinicalTrials
Crohn Disease 2 D003424 ClinicalTrials
Psoriasis 2 D011565 ClinicalTrials
Colitis, Ulcerative 2 D003093 ClinicalTrials
Lupus Erythematosus, Systemic 1 D008180 ClinicalTrials
Inflammatory Bowel Diseases 1 D015212 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL3707374
FDA SRS AY898D6RU1
PubChem 67418070
SureChEMBL SCHEMBL2463915
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