N[C@@H](Cc1cc(Cl)c(Sc2ccc(O)c(Cc3ccc(=O)[nH]c3)c2)c(Cl)c1)C(=O)O
SMILES: N[C@@H](Cc1cc(Cl)c(Sc2ccc(O)c(Cc3ccc(=O)[nH]c3)c2)c(Cl)c1)C(=O)O

Molecular Processing

Molecular formula
C21H18Cl2N2O4S
Molecular weight
465.36
Exact mass
464.0364
XLogP
4.08
TPSA
116.41
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
30
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
117.88

Supplementary Information

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