SMILES:
CC1(C)CCN(C2CC2)c2ccc(C#Cc3ccc(C(=O)O)cc3)cc21Molecular Processing
Molecular formula
C23H23NO2
Molecular weight
345.44
Exact mass
345.1729
XLogP
4.43
TPSA
40.54
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
26
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.348
Molar refractivity
103.83
Supplementary Information
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