(2S)-2-hydroxy-2-[8-(hydroxymethyl)-9-oxo-8H-indolizino[1,2-b]quinolin-7-yl]butanoic acid
(2S)-2-hydroxy-2-[8-(hydroxymethyl)-9-oxo-8H-indolizino[1,2-b]quinolin-7-yl]butanoic acid
Molecular Identity
(2S)-2-hydroxy-2-[8-(hydroxymethyl)-9-oxo-8H-indolizino[1,2-b]quinolin-7-yl]butanoic acid
(2S)-2-hydroxy-2-[8-(hydroxymethyl)-9-oxo-8H-indolizino[1,2-b]quinolin-7-yl]butanoic acid
PubChem CID: 71627424
2D Structure
Properties
C20H18N2O5
Molecular Formula
366.40
Molecular Weight
g/mol
366.1216
Exact Mass
Da
1.7
XLogP
Drug-like (Lipinski: < 5)
113
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
6
H-Bond Acceptors
665
Complexity
SMILES
Canonical SMILES
SMILES: CCC(C1=CC2=C3C(=CN2C(=O)C1CO)C=C4C=CC=CC4=N3)(C(=O)O)OIsomeric SMILES
SMILES: CC[C@](C1=CC2=C3C(=CN2C(=O)C1CO)C=C4C=CC=CC4=N3)(C(=O)O)OSynonyms(1)
EHF
Data from PubChem (NCBI)
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Molecular Structure
(2S)-2-hydroxy-2-[8-(hydroxymethyl)-9-oxo-8H-indolizino[1,2-b]quinolin-7-yl]butanoic acid
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Drug Network
Trials and conditions connected to (2S)-2-hydroxy-2-[8-(hydroxymethyl)-9-oxo-8H-indolizino[1,2-b]quinolin-7-yl]butanoic acid
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