O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)OCc1ccccc1
Name: Z-Phe-His-OH
SMILES: O=C(N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)OCc1ccccc1

Molecular Processing

Molecular formula
C23H24N4O5
Molecular weight
436.47
Exact mass
436.1747
XLogP
2.06
TPSA
133.41
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
32
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.217
Molar refractivity
115.55

Supplementary Information

Details werden geladen…

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