SMILES:
Cc1sc(-c2ccc(C(F)(F)F)cc2)nc1CCOMolecular Processing
Molecular formula
C13H12F3NOS
Molecular weight
287.31
Exact mass
287.0592
XLogP
3.67
TPSA
33.12
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
68.08
Supplementary Information
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