NC(=N[N+](=O)[O-])NCCC[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)C(=O)O
Name: (R)-N5 -[amino(nitroimino)methyl]-N2 -(diphenylacetyl)-ornithine
SMILES: NC(=N[N+](=O)[O-])NCCC[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)C(=O)O

Molecular Processing

Molecular formula
C20H23N5O5
Molecular weight
413.43
Exact mass
413.1699
XLogP
1.26
TPSA
159.95
H-bond donors
4
H-bond acceptors
4
Rotatable bonds
10
Heavy atoms
30
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
110.15

Supplementary Information

Details werden geladen…

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