SMILES:
Cc1ccc2c(c1O)CCN(C(=O)c1nc(-c3ccc(F)cc3)nc3ccccc13)C2Molecular Processing
Molecular formula
C25H20FN3O2
Molecular weight
413.45
Exact mass
413.154
XLogP
4.65
TPSA
66.32
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
31
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.16
Molar refractivity
116.22
Supplementary Information
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