Tìm theo
RU79072
Thuốc Gốc
Small Molecule
CTHH: C10H7N2O4P
PTK: 250.1473
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
Phân tử khối
250.1473
Monoisotopic mass
250.014343234
InChI
InChI=1S/C10H7N2O4P/c11-6-8-5-4-7-2-1-3-9(10(7)12-8)16-17(13,14)15/h1-5H,(H2,13,14,15)
InChI Key
InChIKey=NQLPTOOPFMPCHQ-UHFFFAOYSA-N
IUPAC Name
[(2-cyanoquinolin-8-yl)oxy]phosphonic acid
Traditional IUPAC Name
(2-cyanoquinolin-8-yl)oxyphosphonic acid
SMILES
OP(O)(=O)OC1=CC=CC2=CC=C(N=C12)C#N
Độ hòa tan
5.52e-01 g/l
logP
1.42
logS
-2.7
pKa (strongest acidic)
1.72
pKa (Strongest Basic)
-1.7
PSA
103.44 Å2
Refractivity
58.18 m3·mol-1
Polarizability
21.4 Å3
Rotatable Bond Count
2
H Bond Acceptor Count
5
H Bond Donor Count
2
Physiological Charge
-2
Number of Rings
2
Bioavailability
1
Rule of Five
true
Ghose Filter
true
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