O=C(O)c1cn(C2CC2)c2cc(N3CCC3)c(F)cc2c1=O
SMILES: O=C(O)c1cn(C2CC2)c2cc(N3CCC3)c(F)cc2c1=O

Molecular Processing

Molecular formula
C16H15FN2O3
Molecular weight
302.31
Exact mass
302.1067
XLogP
2.38
TPSA
62.54
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
22
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
80.23

Supplementary Information

Details werden geladen…

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