SMILES:
Cc1cc(-c2ccc(C(F)(F)F)cc2)cc(C2=NC3(CC2)CCN(C)C3=O)n1Molecular Processing
Molecular formula
C21H20F3N3O
Molecular weight
387.41
Exact mass
387.1558
XLogP
4.26
TPSA
45.56
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
28
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
100.17
Supplementary Information
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