SMILES:
O=C(Nc1nccs1)C(CC1CCCC1)c1ccc(S(=O)(=O)c2ncc[nH]2)cc1Molecular Processing
Molecular formula
C20H22N4O3S2
Molecular weight
430.56
Exact mass
430.1133
XLogP
4
TPSA
104.81
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
29
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.35
Molar refractivity
110.54
Supplementary Information
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