SMILES:
COC(=O)CNc1ccccc1C#NMolecular Processing
Molecular formula
C10H10N2O2
Molecular weight
190.2
Exact mass
190.0742
XLogP
1.14
TPSA
62.12
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
14
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
0.2
Molar refractivity
51.66
Supplementary Information
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