SMILES:
COC(=O)N[C@@H](Cc1c[nH]nn1)C(=O)OMolecular Processing
Molecular formula
C7H10N4O4
Molecular weight
214.18
Exact mass
214.0702
XLogP
-0.84
TPSA
117.2
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
15
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
0.429
Molar refractivity
47.05
Supplementary Information
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