SMILES:
N#Cc1ccc(CN2CC(C(=O)O)C2)cc1Molecular Processing
Molecular formula
C12H12N2O2
Molecular weight
216.24
Exact mass
216.0899
XLogP
1.07
TPSA
64.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
57.56
Supplementary Information
Details werden geladen…
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