Molecule

ID:85822

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₉NO₅S
Molecular Mass
265.32656
Exact Mass
265.09839371
Charge
0
InChI
InChI=1S/C10H19NO5S/c1-10(2,3)15-9(12)11-6-5-8(7-11)16-17(4,13)14/h8H,5-7H2,1-4H3/t8-/m0/s1
InChIKey
KWQRKOSMSFLBTJ-QMMMGPOBSA-N
Canonic Smiles
O=C(N1CC[C@@H](C1)OS(=O)(=O)C)OC(C)(C)C
Isomeric Smiles
O([C@@H]1CN(C(=O)OC(C)(C)C)CC1)S(=O)(=O)C
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
0.28457865
LogD (pH = 7.4)
0.28457865
Log P
0.28457865
Molar Refractivity
61.2999
Polarizability
25.331835
Polar Surface Area
72.91
Rotatable Bonds
4
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
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Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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