CCCO[C@H]1CN[C@@H]([C@@H](O)[C@H](Cc2cc(F)cc(F)c2)NC(=O)c2cc(C)cc(C(=O)N3CCC[C@@H]3COC)c2)C1
SMILES: CCCO[C@H]1CN[C@@H]([C@@H](O)[C@H](Cc2cc(F)cc(F)c2)NC(=O)c2cc(C)cc(C(=O)N3CCC[C@@H]3COC)c2)C1

Molecular Processing

Molecular formula
C31H41F2N3O5
Molecular weight
573.68
Exact mass
573.3014
XLogP
3.38
TPSA
100.13
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
12
Heavy atoms
41
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
5
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.548
Molar refractivity
150.88

Supplementary Information

Récupération des détails…

Impliqué dans 2 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→