SMILES:
Cc1oc(-c2ccc(F)cc2)nc1CO[C@H]1CCC[C@@H](OCc2ccccc2[N+](=O)[O-])C1Molecular Processing
Molecular formula
C24H25FN2O5
Molecular weight
440.47
Exact mass
440.1748
XLogP
5.74
TPSA
87.63
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
115.35
Supplementary Information
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