SMILES:
COc1ccc(C=O)c2c1NC(=O)CC2Molecular Processing
Molecular formula
C11H11NO3
Molecular weight
205.21
Exact mass
205.0739
XLogP
1.39
TPSA
55.4
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
55.33
Supplementary Information
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