SMILES:
C1=C(c2c[nH]c3ccccc23)CCNC1Molecular Processing
Molecular formula
C13H14N2
Molecular weight
198.27
Exact mass
198.1157
XLogP
2.54
TPSA
27.82
H-bond donors
2
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
15
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
63.76
Supplementary Information
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