Tìm theo
Guvacine
Thuốc Gốc
Small Molecule
CAS: 498-96-4
CTHH: C6H9NO2
PTK: 127.1412
Guvacine is a pyridine alkaloid found in the Areca nut (also known as the Betel nut). It is an experimental drug with no approved indication. Experimental studies are still being investigated to determine all of the physiological effects and mechanisms of action of guvacine. Currently it has been determined that guvacine is a specific GABA reuptake inhibitor with no significant affinity at GABA receptors.
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C6H9NO2
Phân tử khối
127.1412
Monoisotopic mass
127.063328537
InChI
InChI=1S/C6H9NO2/c8-6(9)5-2-1-3-7-4-5/h2,7H,1,3-4H2,(H,8,9)
InChI Key
InChIKey=QTDZOWFRBNTPQR-UHFFFAOYSA-N
IUPAC Name
1,2,5,6-tetrahydropyridine-3-carboxylic acid
Traditional IUPAC Name
guvacine
SMILES
OC(=O)C1=CCCNC1
Độ tan chảy
306 - 309 °C
Độ hòa tan
Soluble in water, and almost insoluble in 100% alcohol, ether, chloroform, and benzene.
logP
-2.6
logS
-0.62
pKa (strongest acidic)
3.76
pKa (Strongest Basic)
9.77
PSA
49.33 Å2
Refractivity
33.8 m3·mol-1
Polarizability
12.85 Å3
Rotatable Bond Count
1
H Bond Acceptor Count
3
H Bond Donor Count
2
Physiological Charge
0
Number of Rings
1
Bioavailability
1
Rule of Five
true
Dược Lực Học : Experimental studies are still being investigated to determine all of the physiological effects of guvacine.
Cơ Chế Tác Dụng : Guvacine is a pyridine alkaloid found in the Areca nut (also known as the Betel nut). It is an experimental drug with no approved indication. Experimental studies are still being investigated to determine all of the physiological effects and mechanisms of action of guvacine. Currently it has been determined that guvacine is a specific GABA reuptake inhibitor with no significant affinity at GABA receptors. Experimental studies are still being investigated to determine the exact mechanisms of action of guvacine. What is known is that guvacine binds selectively to presynaptic GABA reuptake transporters and prevents the reuptake of GABA, but has no affinity for GABA postsynaptic receptors.
Chỉ Định : There is no approved indication for guvacine.
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB08848
KEGG Compound
http://www.genome.jp/dbget-bin/www_bget?cpd:C10149
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