SMILES:
CCCc1nc(C(C)O)c(C(=O)OCC)[nH]1Molecular Processing
Molecular formula
C11H18N2O3
Molecular weight
226.28
Exact mass
226.1317
XLogP
1.59
TPSA
75.21
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.636
Molar refractivity
59.17
Supplementary Information
Details werden geladen…
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