SMILES:
COc1cccc2c1nc(C(F)F)n2-c1nc(Nc2cccnn2)nc(N2CCOCC2)n1Molecular Processing
Molecular formula
C20H19F2N9O2
Molecular weight
455.43
Exact mass
455.163
XLogP
2.53
TPSA
116
H-bond donors
1
H-bond acceptors
10
Rotatable bonds
6
Heavy atoms
33
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
114.31
Supplementary Information
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