Name: (2S)-4-amino-4-oxo-2-[(2-quinolinylcarbonyl) amino]butanoic acid hydrochloride
SMILES:
Cl.NC(=O)C[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)OMolecular Processing
Molecular formula
C14H14ClN3O4
Molecular weight
323.74
Exact mass
323.0673
XLogP
0.71
TPSA
122.38
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.143
Molar refractivity
81.69
Supplementary Information
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