CC(O)C1=Nc2cccc3cccc(c23)N1
SMILES: CC(O)C1=Nc2cccc3cccc(c23)N1

Molecular Processing

Molecular formula
C13H12N2O
Molecular weight
212.25
Exact mass
212.095
XLogP
2.68
TPSA
44.62
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
16
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
66.35

Supplementary Information

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