METHYLAMINO-PHENYLALANYL-LEUCYL-HYDROXAMIC ACID
Thuốc Gốc
Small Molecule
CTHH: C18H27N3O4
PTK: 349.4247
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
Phân tử khối
349.4247
Monoisotopic mass
349.200156367
InChI
InChI=1S/C18H27N3O4/c1-12(2)9-14(11-16(22)21-25)17(23)20-15(18(24)19-3)10-13-7-5-4-6-8-13/h4-8,12,14-15,25H,9-11H2,1-3H3,(H,19,24)(H,20,23)(H,21,22)/t14-,15+/m1/s1
InChI Key
InChIKey=MOPRTFSMCQNUCT-CABCVRRESA-N
IUPAC Name
(2R)-N-hydroxy-N'-[(1S)-1-(methylcarbamoyl)-2-phenylethyl]-2-(2-methylpropyl)butanediamide
Traditional IUPAC Name
(2R)-N-hydroxy-N'-[(1S)-1-(methylcarbamoyl)-2-phenylethyl]-2-(2-methylpropyl)butanediamide
SMILES
[H][C@@](CC(C)C)(CC(=O)NO)C(=O)N[C@@]([H])(CC1=CC=CC=C1)C(=O)NC
Độ hòa tan
6.84e-02 g/l
logP
1.05
logS
-3.7
pKa (strongest acidic)
8.9
pKa (Strongest Basic)
-0.71
PSA
107.53 Å2
Refractivity
94.08 m3·mol-1
Polarizability
36.94 Å3
Rotatable Bond Count
9
H Bond Acceptor Count
4
H Bond Donor Count
4
Physiological Charge
0
Number of Rings
1
Bioavailability
1
Rule of Five
true
Ghose Filter
true
Tài Liệu Tham Khảo Thêm
drugbank
PubChem Compound
PubChem Substance
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