Tezampanel
(3S,4aR,6R,8aR)-6-[2-(2H-tetrazol-5-yl)ethyl]-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid
Molecular Identity
Tezampanel
(3S,4aR,6R,8aR)-6-[2-(2H-tetrazol-5-yl)ethyl]-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-3-carboxylic acid
PubChem CID: 127894
2D Structure
Properties
C13H21N5O2
Molecular Formula
279.34
Molecular Weight
g/mol
279.1695
Exact Mass
Da
-0.8
XLogP
Drug-like (Lipinski: < 5)
104
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
6
H-Bond Acceptors
354
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Tezampanel154652-83-2LY-293558Tezampanel, anhydrousNGX-424TEZAMPANEL ANHYDROUSLY-293,558GA36S2O9C2NGX424(3S,4aR,6R,8aR)-6-[2-(1H-1,2,3,4-tetrazol-5-yl)ethyl]-decahydroisoquinoline-3-carboxylic acidtezampanelum(3S,4aR,6R,8aR)-6-(2-(1(2)H-tetrazole-5yl)ethyl)decahydroisoquinoline-3carboxylic acid(3S,4aR,6R,8aR)-6-(2-(1H-1,2,3,4-tetrazol-5-yl)ethyl)-decahydroisoquinoline-3-carboxylic acidRefChem:188975(3S,4aR,6R,8aR)-6-(2-(1H-Tetrazol-5-yl)ethyl)decahydroisoquinoline-3-carboxylic Acid Monohydrate Anhydrous
Data from PubChem (NCBI)
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