SMILES:
CC(C)(C)CCN1C(=O)C(CC(=O)O)SC1c1cccc(F)c1NCCN1CCOCC1Molecular Processing
Molecular formula
C23H34FN3O4S
Molecular weight
467.61
Exact mass
467.2254
XLogP
3.42
TPSA
82.11
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
32
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.652
Molar refractivity
124.31
Supplementary Information
Details werden geladen…
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