SMILES:
COc1cnc2ccc(C(F)(F)c3nnc4c(F)cc(-c5cnn(C)c5)cn34)cc2c1Molecular Processing
Molecular formula
C21H15F3N6O
Molecular weight
424.39
Exact mass
424.1259
XLogP
3.97
TPSA
70.13
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
31
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
106.44
Supplementary Information
Obteniendo detalles…
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