SMILES:
COc1cc2c(=O)n(COC(=O)C(C)(C)C)cnc2cc1OCC1CCN(CCS(C)(=O)=O)CC1Molecular Processing
Molecular formula
C24H35N3O7S
Molecular weight
509.63
Exact mass
509.2196
XLogP
2.09
TPSA
117.03
H-bond donors
0
H-bond acceptors
9
Rotatable bonds
9
Heavy atoms
35
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
132.47
Supplementary Information
Details werden geladen…
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