Tìm theo
Ibudilast
Các tên gọi khác (13 ) :
  • 2-Isopropyl-3-isobutyrylpyrazolo(1,5-a)pyridine
  • 3-isobutyryl-2-isopropylpyrazolo(1,5-a)pyridine
  • 3-Isobutyryl-2-isopropylpyrazolo[1,5-a]pyridine
  • AV-411
  • Eyevinal
  • Ibudilast
  • Ibudilastum
  • Ke tas
  • Ketas
  • Ketas (TN)
  • MN-166
  • Pyrazolo(1,5-a)pyridine, 3-isobutyryl-2-isopropyl-
  • Tocris-1694
platelet aggregation inhibitors, phosphodiesterase inhibitors, bronchodilator agents, vasodilator agent
Thuốc Gốc
Small Molecule
CAS: 50847-11-5
ATC: R03DC04
CTHH: C14H18N2O
PTK: 230.3055
Ibudilast is an anti-inflammatory and neuroprotective oral agent which shows an excellent safety profile at 60 mg/day and provides significantly prolonged time-to-first relapse and attenuated brain volume shrinkage in patients with relapsing-remitting (RR) and/or secondary progressive (SP) multiple sclerosis (MS). Ibudilast is currently in development in the U.S. (codes: AV-411 or MN-166), but is approved for use as an antiinflammatory in Japan.
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C14H18N2O
Phân tử khối
230.3055
Monoisotopic mass
230.141913208
InChI
InChI=1S/C14H18N2O/c1-9(2)13-12(14(17)10(3)4)11-7-5-6-8-16(11)15-13/h5-10H,1-4H3
InChI Key
InChIKey=ZJVFLBOZORBYFE-UHFFFAOYSA-N
IUPAC Name
2-methyl-1-[2-(propan-2-yl)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one
Traditional IUPAC Name
1-{2-isopropylpyrazolo[1,5-a]pyridin-3-yl}-2-methylpropan-1-one
SMILES
CC(C)C(=O)C1=C2C=CC=CN2N=C1C(C)C
Độ hòa tan
1.79e-01 g/l
logP
3.68
logS
-3.1
pKa (strongest acidic)
16.12
pKa (Strongest Basic)
1.86
PSA
34.37 Å2
Refractivity
79.38 m3·mol-1
Polarizability
26.31 Å3
Rotatable Bond Count
3
H Bond Acceptor Count
2
H Bond Donor Count
0
Physiological Charge
0
Number of Rings
2
Bioavailability
1
Rule of Five
true
Ghose Filter
true
Cơ Chế Tác Dụng : Ibudilast is an anti-inflammatory and neuroprotective oral agent which shows an excellent safety profile at 60 mg/day and provides significantly prolonged time-to-first relapse and attenuated brain volume shrinkage in patients with relapsing-remitting (RR) and/or secondary progressive (SP) multiple sclerosis (MS). Ibudilast is currently in development in the U.S. (codes: AV-411 or MN-166), but is approved for use as an antiinflammatory in Japan. Ibudilast has mechanisms that include anti-inflammatory effects, such as phosphodiesterase inhibition, and neuroprotective effects, such as inhibition of [nitric oxide] synthesis and reduction in reactive oxygen species.
Dược Động Học :

▧ Half Life :
19 hours
Độc Tính : Neuroprotective role of phosphodiesterase inhibitor ibudilast on neuronal cell death induced by activated microglia
Chỉ Định : For the treatment of multiple sclerosis, asthma, and cerebrovascular disease.
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB05266
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=3671
PubChem Substance
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=99443231
ChemSpider
http://www.chemspider.com/Chemical-Structure.3543.html
BindingDB
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50240404
PharmGKB
http://www.pharmgkb.org/drug/PA165958351
Wikipedia
http://en.wikipedia.org/wiki/Ibudilast
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