SMILES:
Cc1ccc(CCN2CCC[C@H](C(C#N)(c3ccccc3)c3ccccc3)C2)cc1Molecular Processing
Molecular formula
C28H30N2
Molecular weight
394.56
Exact mass
394.2409
XLogP
5.76
TPSA
27.03
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.321
Molar refractivity
123.32
Supplementary Information
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