SMILES:
NC1C2CCN(CC2)C1Cc1cccnc1Molecular Processing
Molecular formula
C13H19N3
Molecular weight
217.32
Exact mass
217.1579
XLogP
1.05
TPSA
42.15
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.615
Molar refractivity
64
Supplementary Information
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