SMILES:
CCOc1ccc2cccnc2c1NMolecular Processing
Molecular formula
C11H12N2O
Molecular weight
188.23
Exact mass
188.095
XLogP
2.22
TPSA
48.14
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
57.32
Supplementary Information
Récupération des détails…
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