SMILES:
O=C1NC(=O)C(O)(c2cccn2-c2ccccc2)C(=O)N1Molecular Processing
Molecular formula
C14H11N3O4
Molecular weight
285.26
Exact mass
285.075
XLogP
0.03
TPSA
100.43
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
71.35
Supplementary Information
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