SMILES:
CS(=O)(=O)c1ccc(N2CCc3c(OC4CCN(C#N)CC4)cccc32)cc1Molecular Processing
Molecular formula
C21H23N3O3S
Molecular weight
397.5
Exact mass
397.146
XLogP
3.11
TPSA
73.64
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
28
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
107.54
Supplementary Information
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