SMILES:
CC1=NN(c2ccc3c(c2)CCC3)C(=O)C1Molecular Processing
Molecular formula
C13H14N2O
Molecular weight
214.27
Exact mass
214.1106
XLogP
2.29
TPSA
32.67
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
16
Rings
3
Aromatic rings
1
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
63.68
Supplementary Information
Details werden geladen…
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