Cn1cnc(S(=O)(=O)NCCOc2ccc3c(c2)C(Cc2ccccc2F)C(NC(=O)[C@H]2C[C@H]2C(=O)O)CC3)c1
SMILES: Cn1cnc(S(=O)(=O)NCCOc2ccc3c(c2)C(Cc2ccccc2F)C(NC(=O)[C@H]2C[C@H]2C(=O)O)CC3)c1

Molecular Processing

Molecular formula
C28H31FN4O6S
Molecular weight
570.64
Exact mass
570.1948
XLogP
2.39
TPSA
139.62
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
11
Heavy atoms
40
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
4
Undefined stereo
2
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.393
Molar refractivity
142.66

Supplementary Information

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