SMILES:
CCCCCCCCCCCCCCCCCC(=O)NCCCSc1ccncc1Molecular Processing
Molecular formula
C26H46N2OS
Molecular weight
434.73
Exact mass
434.3331
XLogP
7.94
TPSA
41.99
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
21
Heavy atoms
30
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.769
Molar refractivity
132.13
Supplementary Information
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