SMILES:
c1ccc2sc(OCC3CO3)nc2c1Molecular Processing
Molecular formula
C10H9NO2S
Molecular weight
207.25
Exact mass
207.0354
XLogP
2.07
TPSA
34.65
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
14
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
54.86
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→