SMILES:
CC(C)(C)c1ccc(CNCCc2cc(Cl)cc(C3CC3)c2)cc1Molecular Processing
Molecular formula
C22H28ClN
Molecular weight
341.93
Exact mass
341.191
XLogP
5.85
TPSA
12.03
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
6
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
103.98
Supplementary Information
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