SMILES:
CCc1cnc(N2CCC3(CC2)OCCO3)nc1Molecular Processing
Molecular formula
C13H19N3O2
Molecular weight
249.31
Exact mass
249.1477
XLogP
1.38
TPSA
47.48
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
18
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.692
Molar refractivity
67.49
Supplementary Information
Récupération des détails…
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