SMILES:
CN(CCC=O)C(=O)Nc1nnc(C2CCCCCC2)s1Molecular Processing
Molecular formula
C14H22N4O2S
Molecular weight
310.42
Exact mass
310.1463
XLogP
3.03
TPSA
75.19
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
82.68
Supplementary Information
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