SMILES:
COc1cc(OC)c(N)c(OC)c1Molecular Processing
Molecular formula
C9H13NO3
Molecular weight
183.21
Exact mass
183.0895
XLogP
1.29
TPSA
53.71
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
50.51
Supplementary Information
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