SMILES:
NC1CCc2nc(NC(=O)OCc3ccccc3)sc2C1Molecular Processing
Molecular formula
C15H17N3O2S
Molecular weight
303.39
Exact mass
303.1041
XLogP
2.71
TPSA
77.24
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
82.36
Supplementary Information
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