COc1ccc(C(=O)Nc2ccc(F)c(CNc3ncnc4c(C(N)=O)cccc34)c2)cc1
SMILES: COc1ccc(C(=O)Nc2ccc(F)c(CNc3ncnc4c(C(N)=O)cccc34)c2)cc1

Molecular Processing

Molecular formula
C24H20FN5O3
Molecular weight
445.45
Exact mass
445.155
XLogP
3.74
TPSA
119.23
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
33
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
122.73

Supplementary Information

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