SMILES:
CC(=NNC(N)=O)c1ccc2nnc(Cc3c(F)cc4ncccc4c3F)n2n1Molecular Processing
Molecular formula
C18H14F2N8O
Molecular weight
396.36
Exact mass
396.1259
XLogP
1.93
TPSA
123.45
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
29
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
100.18
Supplementary Information
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