5-Methyl-2'-Deoxypseudouridine
Thuốc Gốc
Small Molecule
CTHH: C10H14N2O5
PTK: 242.2286
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C10H14N2O5
Phân tử khối
242.2286
Monoisotopic mass
242.090271568
InChI
InChI=1S/C10H14N2O5/c1-12-3-5(9(15)11-10(12)16)7-2-6(14)8(4-13)17-7/h3,6-8,13-14H,2,4H2,1H3,(H,11,15,16)/t6-,7-,8+/m1/s1
InChI Key
InChIKey=AMDJRICBYOAHBZ-PRJMDXOYSA-N
IUPAC Name
5-[(2R,4R,5S)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
Traditional IUPAC Name
5-[(2R,4R,5S)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-methyl-3H-pyrimidine-2,4-dione
SMILES
CN1C=C([C@H]2C[C@@H](O)[C@H](CO)O2)C(=O)NC1=O
Độ hòa tan
6.80e+01 g/l
logP
-2.2
logS
-0.55
pKa (strongest acidic)
9.65
pKa (Strongest Basic)
-3
PSA
99.1 Å2
Refractivity
56.24 m3·mol-1
Polarizability
23.04 Å3
Rotatable Bond Count
2
H Bond Acceptor Count
5
H Bond Donor Count
3
Physiological Charge
0
Number of Rings
2
Bioavailability
1
Rule of Five
true
Tài Liệu Tham Khảo Thêm
drugbank
PubChem Compound
PubChem Substance
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