SMILES:
CCOC(=O)C=Cc1c(C)nc(N)nc1NC1CCC(O)CC1Molecular Processing
Molecular formula
C16H24N4O3
Molecular weight
320.39
Exact mass
320.1848
XLogP
1.66
TPSA
110.36
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.562
Molar refractivity
88.73
Supplementary Information
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