SMILES:
Cc1cc(C)cc(N2CCCC2=O)c1Molecular Processing
Molecular formula
C12H15NO
Molecular weight
189.26
Exact mass
189.1154
XLogP
2.43
TPSA
20.31
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
57.5
Supplementary Information
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