Nombre: Acetylalanylalanylleucine benzyl ester
SMILES:
CC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)OCc1ccccc1Molecular Processing
Molecular formula
C21H31N3O5
Molecular weight
405.5
Exact mass
405.2264
XLogP
1.29
TPSA
113.6
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
29
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.524
Molar refractivity
108.51
Supplementary Information
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