Tìm theo
Dextrofloxacine
Thuốc Gốc
Small Molecule
CTHH: C18H20FN3O4
PTK: 361.3675
A synthetic fluoroquinolone (FLUOROQUINOLONES) antibacterial agent that inhibits the supercoiling activity of bacterial DNA GYRASE, halting DNA REPLICATION. [PubChem]
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C18H20FN3O4
Phân tử khối
361.3675
Monoisotopic mass
361.143784348
InChI
InChI=1S/C18H20FN3O4/c1-10-9-26-17-14-11(16(23)12(18(24)25)8-22(10)14)7-13(19)15(17)21-5-3-20(2)4-6-21/h7-8,10H,3-6,9H2,1-2H3,(H,24,25)/t10-/m1/s1
InChI Key
InChIKey=GSDSWSVVBLHKDQ-SNVBAGLBSA-N
IUPAC Name
(2R)-7-fluoro-2-methyl-6-(4-methylpiperazin-1-yl)-10-oxo-4-oxa-1-azatricyclo[7.3.1.0^{5,13}]trideca-5(13),6,8,11-tetraene-11-carboxylic acid
Traditional IUPAC Name
dextrofloxacine
SMILES
C[C@@H]1COC2=C(N3CCN(C)CC3)C(F)=CC3=C2N1C=C(C(O)=O)C3=O
Độ hòa tan
1.44e+00 g/l
logP
0.65
logS
-2.4
pKa (strongest acidic)
5.45
pKa (Strongest Basic)
6.2
PSA
73.32 Å2
Refractivity
94.94 m3·mol-1
Polarizability
36.75 Å3
Rotatable Bond Count
2
H Bond Acceptor Count
7
H Bond Donor Count
1
Physiological Charge
-1
Number of Rings
4
Bioavailability
1
Rule of Five
true
Ghose Filter
true
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB03034
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=452723
PubChem Substance
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=46506037
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