SMILES:
CNCCC1CCN(c2ccncc2)CC1Molecular Processing
Molecular formula
C13H21N3
Molecular weight
219.33
Exact mass
219.1735
XLogP
1.91
TPSA
28.16
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.615
Molar refractivity
67.72
Supplementary Information
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