Name: effective_coupling_partner
SMILES:
COC(=O)c1ncoc1CMolecular Processing
Molecular formula
C6H7NO3
Molecular weight
141.13
Exact mass
141.0426
XLogP
0.77
TPSA
52.33
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
10
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
32.58
Supplementary Information
Details werden geladen…
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