CCOP(=O)(OCC)C(CC(C(=O)c1ccccc1)c1ccccn1)P(=O)(OCC)OCC.CCOP(=O)(OCC)C(CC(C(=O)c1ccccc1)c1ccccn1)P(=O)(OCC)OCC.O
SMILES: CCOP(=O)(OCC)C(CC(C(=O)c1ccccc1)c1ccccn1)P(=O)(OCC)OCC.CCOP(=O)(OCC)C(CC(C(=O)c1ccccc1)c1ccccn1)P(=O)(OCC)OCC.O

Molecular Processing

Molecular formula
C46H68N2O15P4
Molecular weight
1012.94
Exact mass
1012.357
XLogP
11.77
TPSA
233.54
H-bond donors
0
H-bond acceptors
16
Rotatable bonds
30
Heavy atoms
67
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
21
Covalent units
3
Fraction Csp3
0.478
Molar refractivity
259.36

Supplementary Information

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