SMILES:
COc1c2n(c3c(CO)nn(Cc4ccc(F)cc4)c(=O)c13)CCN(C)C2=OMolecular Processing
Molecular formula
C19H19FN4O4
Molecular weight
386.38
Exact mass
386.139
XLogP
0.97
TPSA
89.59
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
28
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
98.93
Supplementary Information
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