SMILES:
CCc1nn(CCOC)c(C(N)=O)c1NMolecular Processing
Molecular formula
C9H16N4O2
Molecular weight
212.25
Exact mass
212.1273
XLogP
-0.23
TPSA
96.16
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
56.41
Supplementary Information
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