CC(CO)Nc1nc(SCc2ccccc2F)nc(N)c1N=O
SMILES: CC(CO)Nc1nc(SCc2ccccc2F)nc(N)c1N=O

Molecular Processing

Molecular formula
C14H16FN5O2S
Molecular weight
337.38
Exact mass
337.1009
XLogP
2.68
TPSA
113.49
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
88.03

Supplementary Information

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