CCCc1ccc(C(=O)NC(=S)Nc2ccc(Oc3ccnc4cc(OC)c(OC)cc34)c(F)c2)cc1
SMILES: CCCc1ccc(C(=O)NC(=S)Nc2ccc(Oc3ccnc4cc(OC)c(OC)cc34)c(F)c2)cc1

Molecular Processing

Molecular formula
C28H26FN3O4S
Molecular weight
519.6
Exact mass
519.1628
XLogP
6.26
TPSA
81.71
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
37
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.179
Molar refractivity
145.44

Supplementary Information

Details werden geladen…

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