Tìm theo
9-Methyl Uric Acid
Thuốc Gốc
Small Molecule
CTHH: C6H6N4O3
PTK: 182.1368
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C6H6N4O3
Phân tử khối
182.1368
Monoisotopic mass
182.043990078
InChI
InChI=1S/C6H6N4O3/c1-10-3-2(7-6(10)13)4(11)9-5(12)8-3/h1H3,(H,7,13)(H2,8,9,11,12)
InChI Key
InChIKey=XJEJWDFDVPDMAS-UHFFFAOYSA-N
IUPAC Name
9-methyl-2,3,6,7,8,9-hexahydro-1H-purine-2,6,8-trione
Traditional IUPAC Name
9-methyl uric acid
SMILES
CN1C(=O)NC2=C1NC(=O)NC2=O
Độ hòa tan
3.60e+00 g/l
logP
-1.3
logS
-1.7
pKa (strongest acidic)
7.63
pKa (Strongest Basic)
-6.2
PSA
90.54 Å2
Refractivity
50.53 m3·mol-1
Polarizability
15.67 Å3
Rotatable Bond Count
0
H Bond Acceptor Count
3
H Bond Donor Count
3
Physiological Charge
0
Number of Rings
2
Bioavailability
1
Rule of Five
true
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