SMILES:
CCCc1ccc(C#Cc2ccc(OCC)nc2)cc1Molecular Processing
Molecular formula
C18H19NO
Molecular weight
265.36
Exact mass
265.1467
XLogP
3.83
TPSA
22.12
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
81.82
Supplementary Information
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