Name: product
SMILES:
C=CCOc1ccc2cn[nH]c2c1Molecular Processing
Molecular formula
C10H10N2O
Molecular weight
174.2
Exact mass
174.0793
XLogP
2.13
TPSA
37.91
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
13
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
0.1
Molar refractivity
51.79
Supplementary Information
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