SMILES:
Cc1nc(C)n(-c2cc([C@@H]3C[C@H]3c3nc4ccccc4n3C)nc(C(F)(F)F)n2)n1Molecular Processing
Molecular formula
C20H18F3N7
Molecular weight
413.41
Exact mass
413.1576
XLogP
3.85
TPSA
74.31
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
30
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.35
Molar refractivity
102.24
Supplementary Information
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