Название: Compound 32
SMILES:
CNC[C@@H](Nc1ncnc2c(C(N)=O)ccnc12)c1cc(F)c(OC)cc1FMolecular Processing
Molecular formula
C18H18F2N6O2
Molecular weight
388.38
Exact mass
388.1459
XLogP
1.78
TPSA
115.05
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
28
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
99.05
Supplementary Information
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