Molecules/methyl 4-fluoro-1-hydroxy-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrole-3-carboxylate, radical
methyl 4-fluoro-1-hydroxy-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrole-3-carboxylate, radical
methyl 1-hydroxy-2,2,5,5-tetramethyl-4-sulfanylpyrrole-3-carboxylate
Molecular Identity
methyl 4-fluoro-1-hydroxy-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrole-3-carboxylate, radical
methyl 1-hydroxy-2,2,5,5-tetramethyl-4-sulfanylpyrrole-3-carboxylate
PubChem CID: 171393589
2D Structure
Properties
C10H17NO3S
Molecular Formula
231.31
Molecular Weight
g/mol
231.0929
Exact Mass
Da
0.6
XLogP
Drug-like (Lipinski: < 5)
50.8
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
5
H-Bond Acceptors
334
Complexity
SMILES
Canonical SMILES
SMILES: CC1(C(=C(C(N1O)(C)C)S)C(=O)OC)CIsomeric SMILES
SMILES: CC1(C(=C(C(N1O)(C)C)S)C(=O)OC)CSynonyms(2)
GFXmethyl 4-fluoro-1-hydroxy-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrole-3-carboxylate, radical
Data from PubChem (NCBI)
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Molecular Structure
methyl 4-fluoro-1-hydroxy-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrole-3-carboxylate, radical
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Drug Network
Trials and conditions connected to methyl 4-fluoro-1-hydroxy-2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrole-3-carboxylate, radical
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