UE2343
[(1R,5S)-3-hydroxy-3-pyrimidin-2-yl-8-azabicyclo[3.2.1]octan-8-yl]-[5-(1H-pyrazol-4-yl)thiophen-3-yl]methanone
Molecular Identity
UE2343
[(1R,5S)-3-hydroxy-3-pyrimidin-2-yl-8-azabicyclo[3.2.1]octan-8-yl]-[5-(1H-pyrazol-4-yl)thiophen-3-yl]methanone
PubChem CID: 137530063
2D Structure
Properties
C19H19N5O2S
Molecular Formula
381.50
Molecular Weight
g/mol
381.1259
Exact Mass
Da
1.1
XLogP
Drug-like (Lipinski: < 5)
123
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
6
H-Bond Acceptors
558
Complexity
SMILES
Canonical SMILES
SMILES: C1CC2CC(CC1N2C(=O)C3=CSC(=C3)C4=CNN=C4)(C5=NC=CC=N5)OIsomeric SMILES
SMILES: C1C[C@H]2CC(C[C@@H]1N2C(=O)C3=CSC(=C3)C4=CNN=C4)(C5=NC=CC=N5)OSynonyms(20)
XanamemUE2343UE-2343RefChem:192935Emestedastat1346013-80-6(5-(1H-Pyrazol-4-yl)thiophen-3-yl)((1R,3r,5S)-3-hydroxy-3-(pyrimidin-2-yl)-8-azabicyclo[3.2.1]octan-8-yl)methanoneemestedastat [INN]starbld0030988UE2343(Xanamem)?Emestedastat (USAN/INN)EMESTEDASTAT [USAN]106ELK29GHorb2665070CHEMBL6068050
Data from PubChem (NCBI)
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Drug Network
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