SMILES:
CCOC(=O)CN1CCN(Cc2cnc(-c3cc4cccc(NS(=O)(=O)c5cccs5)c4[nH]3)s2)CC1Molecular Processing
Molecular formula
C24H27N5O4S3
Molecular weight
545.71
Exact mass
545.1225
XLogP
3.83
TPSA
107.63
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
9
Heavy atoms
36
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
142.88
Supplementary Information
Details werden geladen…
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