SMILES:
CS(=O)(=O)CCN1C[C@H](c2cccc(F)c2F)CC[C@@H](NC(=O)N2CCC(n3c(=O)[nH]c4ncccc43)CC2)C1=OMolecular Processing
Molecular formula
C27H32F2N6O5S
Molecular weight
590.65
Exact mass
590.2123
XLogP
2.17
TPSA
137.47
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
41
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.481
Molar refractivity
147.14
Supplementary Information
Récupération des détails…
Impliqué dans 6 réactions→