Nom: product
SMILES:
C=Cc1cnc(C)c(O)c1C(C)OMolecular Processing
Molecular formula
C10H13NO2
Molecular weight
179.22
Exact mass
179.0946
XLogP
1.79
TPSA
53.35
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
51.36
Supplementary Information
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