SMILES:
Cc1c(-c2ccnc(N3CCN(C)CC3)c2)nc2cc(F)cc(F)c2c1Nc1cc(N2CCOCC2)cnc1N1CCOCC1Molecular Processing
Molecular formula
C33H38F2N8O2
Molecular weight
616.72
Exact mass
616.3086
XLogP
4.45
TPSA
82.12
H-bond donors
1
H-bond acceptors
10
Rotatable bonds
6
Heavy atoms
45
Rings
7
Aromatic rings
4
Saturated rings
3
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.424
Molar refractivity
172.92
Supplementary Information
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