SMILES:
C=CCNC1CCc2ccccc21Molecular Processing
Molecular formula
C12H15N
Molecular weight
173.26
Exact mass
173.1204
XLogP
2.45
TPSA
12.03
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
55.7
Supplementary Information
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