(2S)-2-amino-4-methyl-N-(4-nitrophenyl)pentanamide
AlkaPlorer ID: AK338649
Synonym: None
IUPAC Name: (2S)-2-amino-4-methyl-N-(4-nitrophenyl)pentanamide
Structure
SMILES: CC(C)C[C@H](N)C(=O)NC1=CC=C([N+](=O)[O-])C=C1
InChI: InChI=1S/C12H17N3O3/c1-8(2)7-11(13)12(16)14-9-3-5-10(6-4-9)15(17)18/h3-6,8,11H,7,13H2,1-2H3,(H,14,16)/t11-/m0/s1
InChIKey: AXZJHDNQDSVIDR-NSHDSACASA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 251.286
TPSA？: 98.26
MolLogP？: 1.9067
Number of H-Donors: 2
Number of H-Acceptors: 4
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Leukotriene A4 hydrolase | k cat | 1.5 | s-1 | 10.1021/jm00054a004 |
| Homo sapiens | Leukotriene A4 hydrolase | Km | 300000.0 | nM | 10.1016/S0960-894X(01)80464-9 |
| Homo sapiens | Leukotriene A4 hydrolase | Km | 300000.0 | nM | 10.1021/jm00054a004 |
| Homo sapiens | Leukotriene A4 hydrolase | Vmax | 130.0 | nM min-1 mg-1 | 10.1016/S0960-894X(01)80464-9 |
| Homo sapiens | Leukotriene A4 hydrolase | Vmax | 135.0 | nM min-1 mg-1 | 10.1021/jm00054a004 |
| None | Unchecked | k cat/Km | 500.0 | M-1 s-1 | 10.1016/S0960-894X(01)80464-9 |
| None | Unchecked | Km | 600000.0 | nM | 10.1021/jm00151a018 |
| None | Unchecked | Km | 2100000.0 | nM | 10.1021/jm00151a018 |
| None | Unchecked | Km | 3000000.0 | nM | 10.1016/j.bmcl.2011.02.068 |
| None | Unchecked | Ratio | 0.05 | None | 10.1021/jm00054a004 |
| None | Unchecked | Vmax | 3.9 | umol/min/mg | 10.1016/j.bmcl.2011.02.068 |