Name: N-benzoyl-(S)-glutamic acid
SMILES:
O=C(O)CC[C@H](NC(=O)c1ccccc1)C(=O)OMolecular Processing
Molecular formula
C12H13NO5
Molecular weight
251.24
Exact mass
251.0794
XLogP
0.73
TPSA
103.7
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
62.2
Supplementary Information
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