SMILES:
CCCCCCOc1ccc(-c2nnc(-c3ccc(CCCCCC)cc3)s2)cc1FMolecular Processing
Molecular formula
C26H33FN2OS
Molecular weight
440.63
Exact mass
440.2298
XLogP
8.09
TPSA
35.01
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
13
Heavy atoms
31
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
128.22
Supplementary Information
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