SMILES:
COC(=O)C1(C(=O)Nc2cnn3ccc(N4CCCC4c4cc(F)ccc4F)nc23)CC1Molecular Processing
Molecular formula
C22H21F2N5O3
Molecular weight
441.44
Exact mass
441.1612
XLogP
3.24
TPSA
88.83
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
32
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
110.98
Supplementary Information
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