SMILES:
CC1=C(C(O)=S)N2C(=O)[C@@H](N)[C@H]2SC1Molecular Processing
Molecular formula
C8H10N2O2S2
Molecular weight
230.31
Exact mass
230.0184
XLogP
0.39
TPSA
66.56
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
14
Rings
2
Aromatic rings
0
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
58.99
Supplementary Information
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