SMILES:
OC[C@H](Nc1cc2c(cn1)ncn2-c1cc(C2CC2)[nH]n1)c1ccc(F)cc1Molecular Processing
Molecular formula
C20H19FN6O
Molecular weight
378.41
Exact mass
378.1604
XLogP
3.31
TPSA
91.65
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
28
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
102.84
Supplementary Information
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