SMILES:
CC(C)(C)OC(=O)CC(CCCC1CCCCC1)c1nc(CNC2CCC2)no1Molecular Processing
Molecular formula
C23H39N3O3
Molecular weight
405.58
Exact mass
405.2991
XLogP
5.28
TPSA
77.25
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
29
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.87
Molar refractivity
112.41
Supplementary Information
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