SMILES:
CCc1c(C(=O)NN)ccc2c1OCCO2Molecular Processing
Molecular formula
C11H14N2O3
Molecular weight
222.24
Exact mass
222.1004
XLogP
0.62
TPSA
73.58
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
58.46
Supplementary Information
Details werden geladen…
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