O=C(O)CCc1ccc(OCC(O)CN2CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC2)cc1
SMILES: O=C(O)CCc1ccc(OCC(O)CN2CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC2)cc1

Molecular Processing

Molecular formula
C26H40N4O10
Molecular weight
568.62
Exact mass
568.2744
XLogP
-1.08
TPSA
191.62
H-bond donors
5
H-bond acceptors
10
Rotatable bonds
14
Heavy atoms
40
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.615
Molar refractivity
142.57

Supplementary Information

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