CCCCN1CCOc2c(-c3ncco3)cc(C(=O)N[C@@H](Cc3cc(F)cc(F)c3)[C@H](O)CNCc3cccc(CC)c3)cc21
SMILES: CCCCN1CCOc2c(-c3ncco3)cc(C(=O)N[C@@H](Cc3cc(F)cc(F)c3)[C@H](O)CNCc3cccc(CC)c3)cc21

Molecular Processing

Molecular formula
C35H40F2N4O4
Molecular weight
618.73
Exact mass
618.3018
XLogP
5.67
TPSA
99.86
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
14
Heavy atoms
45
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.371
Molar refractivity
169.4

Supplementary Information

Récupération des détails…

Impliqué dans 1 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→