Tìm theo
Filaminast
Thuốc Gốc
Small Molecule
CAS: 141184-34-1
CTHH: C15H20N2O4
PTK: 292.3303
Filaminast is a phosphodiesterase 4 inhibitor (PDE4 inhibitor). As such, has potential in the treatment of asthma and chronic obstructive pulmonary disease (COPD).
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C15H20N2O4
Phân tử khối
292.3303
Monoisotopic mass
292.142307138
InChI
InChI=1S/C15H20N2O4/c1-10(17-21-15(16)18)11-7-8-13(19-2)14(9-11)20-12-5-3-4-6-12/h7-9,12H,3-6H2,1-2H3,(H2,16,18)/b17-10+
InChI Key
InChIKey=STTRYQAGHGJXJJ-LICLKQGHSA-N
IUPAC Name
(E)-{1-[3-(cyclopentyloxy)-4-methoxyphenyl]ethylidene}amino carbamate
Traditional IUPAC Name
filaminast
SMILES
COC1=CC=C(C=C1OC1CCCC1)C(\C)=N\OC(N)=O
Độ hòa tan
1.92e-02 g/l
logP
2.39
logS
-4.2
pKa (strongest acidic)
13.29
pKa (Strongest Basic)
1.5
PSA
83.14 Å2
Refractivity
77.45 m3·mol-1
Polarizability
31.22 Å3
Rotatable Bond Count
6
H Bond Acceptor Count
5
H Bond Donor Count
1
Physiological Charge
0
Number of Rings
2
Bioavailability
1
Rule of Five
true
Ghose Filter
true
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB02660
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=9578243
PubChem Substance
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=46506759
ChemSpider
http://www.chemspider.com/Chemical-Structure.7852607.html
BindingDB
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=14771
Wikipedia
http://en.wikipedia.org/wiki/Filaminast
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