SMILES:
CC1(C)SC2C(N)C(=O)N2C1C(=O)OMolecular Processing
Molecular formula
C8H12N2O3S
Molecular weight
216.26
Exact mass
216.0569
XLogP
-0.54
TPSA
83.63
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
14
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
51.7
Supplementary Information
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