Tìm theo
Ethylaminobenzylmethylcarbonyl Group
Thuốc Gốc
Small Molecule
CTHH: C11H15NO
PTK: 177.2429
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C11H15NO
Phân tử khối
177.2429
Monoisotopic mass
177.115364107
InChI
InChI=1S/C11H15NO/c1-2-12-11(9-13)8-10-6-4-3-5-7-10/h3-7,9,11-12H,2,8H2,1H3/t11-/m1/s1
InChI Key
InChIKey=VZZLSNMWFMAXGJ-LLVKDONJSA-N
IUPAC Name
(2R)-2-(ethylamino)-3-phenylpropanal
Traditional IUPAC Name
(2R)-2-(ethylamino)-3-phenylpropanal
SMILES
CCN[C@H](CC1=CC=CC=C1)C=O
Độ hòa tan
5.81e-01 g/l
logP
1.71
logS
-2.5
pKa (strongest acidic)
16.96
pKa (Strongest Basic)
8.32
PSA
29.1 Å2
Refractivity
53.71 m3·mol-1
Polarizability
20.26 Å3
Rotatable Bond Count
5
H Bond Acceptor Count
2
H Bond Donor Count
1
Physiological Charge
1
Number of Rings
1
Bioavailability
1
Rule of Five
true
Ghose Filter
true
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