SMILES:
O=C(Cc1ccccc1)N[C@@H]1C(=O)N2C(C(O)=S)=C(c3ccccc3)CS[C@H]12Molecular Processing
Molecular formula
C21H18N2O3S2
Molecular weight
410.52
Exact mass
410.0759
XLogP
2.93
TPSA
69.64
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
28
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.19
Molar refractivity
113.76
Supplementary Information
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