SMILES:
COc1ccc2c(OCc3nnc4ccc(-c5ccc(OCCN6CCOCC6)c(F)c5)nn34)ccnc2c1Molecular Processing
Molecular formula
C28H27FN6O4
Molecular weight
530.56
Exact mass
530.2078
XLogP
3.78
TPSA
96.13
H-bond donors
0
H-bond acceptors
9
Rotatable bonds
9
Heavy atoms
39
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
141.56
Supplementary Information
Details werden geladen…
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