Tìm theo
9-Hydroxypropyladenine, S-Isomer
Thuốc Gốc
Small Molecule
CTHH: C8H11N5O
PTK: 193.2058
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C8H11N5O
Phân tử khối
193.2058
Monoisotopic mass
193.096359999
InChI
InChI=1S/C8H11N5O/c1-5(14)2-13-4-12-6-7(9)10-3-11-8(6)13/h3-5,14H,2H2,1H3,(H2,9,10,11)/t5-/m1/s1
InChI Key
InChIKey=MJZYTEBKXLVLMY-RXMQYKEDSA-N
IUPAC Name
(2R)-1-(6-amino-9H-purin-9-yl)propan-2-ol
Traditional IUPAC Name
(2R)-1-(6-aminopurin-9-yl)propan-2-ol
SMILES
C[[email protected]@H](O)CN1C=NC2=C1N=CN=C2N
Độ hòa tan
5.45e+00 g/l
logP
-0.58
logS
-1.6
pKa (strongest acidic)
15.17
pKa (Strongest Basic)
5.12
PSA
89.85 Å2
Refractivity
52.21 m3·mol-1
Polarizability
19.22 Å3
Rotatable Bond Count
2
H Bond Acceptor Count
5
H Bond Donor Count
2
Physiological Charge
0
Number of Rings
2
Bioavailability
1
Rule of Five
true
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