Pxs-5505
(Z)-3-fluoro-4-quinolin-8-ylsulfonylbut-2-en-1-amine
Molecular Identity
Pxs-5505
(Z)-3-fluoro-4-quinolin-8-ylsulfonylbut-2-en-1-amine
PubChem CID: 146317833
2D Structure
Properties
C13H13FN2O2S
Molecular Formula
280.32
Molecular Weight
g/mol
280.0682
Exact Mass
Da
0.4
XLogP
Drug-like (Lipinski: < 5)
81.4
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
5
H-Bond Acceptors
430
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC2=C(C(=C1)S(=O)(=O)CC(=CCN)F)N=CC=C2Isomeric SMILES
SMILES: C1=CC2=C(C(=C1)S(=O)(=O)C/C(=C/CN)/F)N=CC=C2Synonyms(20)
PXS-5505UNII-DO94E28WYW2-Buten-1-amine, 3-fluoro-4-(8-quinolinylsulfonyl)-, (2Z)-RefChem:177360LOX Inhibitor PXS-5505Pan-LOX Inhibitor PXS-5505PXS5505PXS 5505LOX-IN-32409963-83-1DO94E28WYW(Z)-3-fluoro-4-quinolin-8-ylsulfonylbut-2-en-1-amine(Z)-3-fluoro-4-(quinolin-8-ylsulfonyl)but-2-en-1-amine(2Z)-3-Fluoro-4-(8-quinolinylsulfonyl)-2-buten-1-amineAmsulostat
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Pxs-5505
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