SMILES:
NCCCOc1cccc2c(N)nccc12Molecular Processing
Molecular formula
C12H15N3O
Molecular weight
217.27
Exact mass
217.1215
XLogP
1.54
TPSA
74.16
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
65.32
Supplementary Information
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