SMILES:
CN1CCN(c2ccccc2CNC(=O)c2ccc(F)c(NC(=O)c3cnc4cc(-c5ccc(C(=O)NCCF)c(F)c5)ccn34)c2)CC1Molecular Processing
Molecular formula
C36H34F3N7O3
Molecular weight
669.71
Exact mass
669.2675
XLogP
4.91
TPSA
111.08
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
49
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
180.57
Supplementary Information
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