CC(=O)c1cccc(CN(C)CC=CC#CC(C)(C)C)c1
SMILES: CC(=O)c1cccc(CN(C)CC=CC#CC(C)(C)C)c1

Molecular Processing

Molecular formula
C19H25NO
Molecular weight
283.41
Exact mass
283.1936
XLogP
3.93
TPSA
20.31
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
21
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.421
Molar refractivity
89.15

Supplementary Information

Details werden geladen…

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