COc1ccc(S(=O)(=O)N2C(=O)C(c3cc(CCN4CCCCC4)ccc3OC)(N3CC(O)CC3C(=O)N(C)C)c3cc(Cl)ccc32)c(OC(F)(F)F)c1
SMILES: COc1ccc(S(=O)(=O)N2C(=O)C(c3cc(CCN4CCCCC4)ccc3OC)(N3CC(O)CC3C(=O)N(C)C)c3cc(Cl)ccc32)c(OC(F)(F)F)c1

Molecular Processing

Molecular formula
C37H42ClF3N4O8S
Molecular weight
795.28
Exact mass
794.2364
XLogP
4.79
TPSA
129.16
H-bond donors
1
H-bond acceptors
10
Rotatable bonds
11
Heavy atoms
54
Rings
6
Aromatic rings
3
Saturated rings
2
Aliphatic rings
3
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
17
Covalent units
1
Fraction Csp3
0.459
Molar refractivity
193.38

Supplementary Information

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