SMILES:
Cc1c(-c2ccsc2)c(F)c2oc(C3CC3)nc2c1C#NMolecular Processing
Molecular formula
C16H11FN2OS
Molecular weight
298.34
Exact mass
298.0576
XLogP
4.75
TPSA
49.82
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
21
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
78.71
Supplementary Information
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