SMILES:
C=COC(=O)N1CCN(c2cccc3nsnc23)CC1Molecular Processing
Molecular formula
C13H14N4O2S
Molecular weight
290.35
Exact mass
290.0837
XLogP
2.09
TPSA
58.56
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
77.88
Supplementary Information
Details werden geladen…
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