SMILES:
CC(C)CC(NC(=O)c1ccc(N2CC(O)C2)c(OCC2CC2)n1)C(N)=OMolecular Processing
Molecular formula
C19H28N4O4
Molecular weight
376.46
Exact mass
376.2111
XLogP
0.68
TPSA
117.78
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
27
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.632
Molar refractivity
100.58
Supplementary Information
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