SMILES:
Nc1cc2c(cc1O)NC(=O)CO2Molecular Processing
Molecular formula
C8H8N2O3
Molecular weight
180.16
Exact mass
180.0535
XLogP
0.31
TPSA
84.58
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
46.64
Supplementary Information
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