SMILES:
COc1nnc(-c2ccccc2)cc1CMolecular Processing
Molecular formula
C12H12N2O
Molecular weight
200.24
Exact mass
200.095
XLogP
2.46
TPSA
35.01
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
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
0.167
Molar refractivity
58.76
Supplementary Information
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