O=C1NC(CO)[C@H](c2cccc(F)c2F)CC[C@H]1NC(=O)N1CCC(n2c(=O)[nH]c3ncccc32)CC1
SMILES: O=C1NC(CO)[C@H](c2cccc(F)c2F)CC[C@H]1NC(=O)N1CCC(n2c(=O)[nH]c3ncccc32)CC1

Molecular Processing

Molecular formula
C25H28F2N6O4
Molecular weight
514.53
Exact mass
514.214
XLogP
1.77
TPSA
132.35
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
37
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.44
Molar refractivity
129.87

Supplementary Information

Récupération des détails…

Impliqué dans 7 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→