CNC(=O)c1c(-c2ccc(F)cc2)oc2cc(NS(C)(=O)=O)c(-c3cc(NS(C)(=O)=O)cc(C(=O)NC(C)(C)C)c3)cc12
SMILES: CNC(=O)c1c(-c2ccc(F)cc2)oc2cc(NS(C)(=O)=O)c(-c3cc(NS(C)(=O)=O)cc(C(=O)NC(C)(C)C)c3)cc12

Molecular Processing

Molecular formula
C29H31FN4O7S2
Molecular weight
630.72
Exact mass
630.1618
XLogP
4.54
TPSA
163.68
H-bond donors
4
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
43
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.241
Molar refractivity
164.59

Supplementary Information

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