الاسم: Nα-(4-methylbenzenesulfonyl)-L-asparagine
SMILES:
Cc1ccc(S(=O)(=O)N[C@@H](CC(N)=O)C(=O)O)cc1Molecular Processing
Molecular formula
C11H14N2O5S
Molecular weight
286.31
Exact mass
286.0623
XLogP
-0.4
TPSA
126.56
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
66.74
Supplementary Information
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