SMILES:
CCCc1c(Cc2ccc(-c3ccccc3-c3noc(=O)[nH]3)cc2)c(=O)n(C2CCC3(CC2)OCCCO3)c2ncnn12Molecular Processing
Molecular formula
C32H34N6O5
Molecular weight
582.66
Exact mass
582.2591
XLogP
4.69
TPSA
129.54
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
43
Rings
7
Aromatic rings
5
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.406
Molar refractivity
158.8
Supplementary Information
Details werden geladen…
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