CCCCCCCc1cnc(-c2ccc(OCC(COc3ccc(-c4ncc(CCCCCCC)cn4)cc3)(COc3ccc(-c4ncc(CCCCCCC)cn4)cc3)COc3ccc(-c4ncc(CCCCCCC)cn4)cc3)cc2)nc1
SMILES: CCCCCCCc1cnc(-c2ccc(OCC(COc3ccc(-c4ncc(CCCCCCC)cn4)cc3)(COc3ccc(-c4ncc(CCCCCCC)cn4)cc3)COc3ccc(-c4ncc(CCCCCCC)cn4)cc3)cc2)nc1

Molecular Processing

Molecular formula
C73H92N8O4
Molecular weight
1145.59
Exact mass
1144.7242
XLogP
18.17
TPSA
140.04
H-bond donors
0
H-bond acceptors
12
Rotatable bonds
40
Heavy atoms
85
Rings
8
Aromatic rings
8
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.452
Molar refractivity
344.14

Supplementary Information

Details werden geladen…

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