SMILES:
CC(C)(C)OC(=O)N1CCC(C)(N2CCC(NC3CCCCC3N)CC2)CC1Molecular Processing
Molecular formula
C22H42N4O2
Molecular weight
394.6
Exact mass
394.3308
XLogP
3.1
TPSA
70.83
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
28
Rings
3
Aromatic rings
0
Saturated rings
3
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.955
Molar refractivity
113.41
Supplementary Information
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