SMILES:
COc1nc(N2CCc3cc(C(F)(F)F)ccc3C2)nc(OC)c1[N+](=O)[O-]Molecular Processing
Molecular formula
C16H15F3N4O4
Molecular weight
384.31
Exact mass
384.1045
XLogP
2.98
TPSA
90.62
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
87.99
Supplementary Information
Details werden geladen…
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