SMILES:
Clc1ccc(OC2CN3CCC2CC3)nn1Molecular Processing
Molecular formula
C11H14ClN3O
Molecular weight
239.71
Exact mass
239.0825
XLogP
1.6
TPSA
38.25
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
16
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.636
Molar refractivity
60.62
Supplementary Information
Details werden geladen…
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