SMILES:
CC(C)(C)OC(=O)C(C)(C)Sc1nc(CCCN)cs1Molecular Processing
Molecular formula
C14H24N2O2S2
Molecular weight
316.49
Exact mass
316.1279
XLogP
3.25
TPSA
65.21
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
85.27
Supplementary Information
Details werden geladen…
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