Cc1ccc(C#Cc2ccc(S(=O)(=O)N[C@H](Cc3c[nH]c4ccccc34)C(=O)O)s2)cc1
SMILES: Cc1ccc(C#Cc2ccc(S(=O)(=O)N[C@H](Cc3c[nH]c4ccccc34)C(=O)O)s2)cc1

Molecular Processing

Molecular formula
C24H20N2O4S2
Molecular weight
464.57
Exact mass
464.0864
XLogP
3.91
TPSA
99.26
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
32
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
125.23

Supplementary Information

Details werden geladen…

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