SMILES:
CC1CCC(N(C(=O)Nc2ncc(SCCCN3CCOCC3)s2)C2CCCCC2)CC1Molecular Processing
Molecular formula
C24H40N4O2S2
Molecular weight
480.74
Exact mass
480.2593
XLogP
5.7
TPSA
57.7
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
32
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
133.86
Supplementary Information
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