CCc1csc([C@H](Cc2ccc([N+](=O)[O-])cc2)NC(=O)C(Cc2ccccc2)c2nc(C)no2)n1
SMILES: CCc1csc([C@H](Cc2ccc([N+](=O)[O-])cc2)NC(=O)C(Cc2ccccc2)c2nc(C)no2)n1

Molecular Processing

Molecular formula
C25H25N5O4S
Molecular weight
491.57
Exact mass
491.1627
XLogP
4.73
TPSA
124.05
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
10
Heavy atoms
35
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.28
Molar refractivity
131.1

Supplementary Information

Récupération des détails…

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