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Name | UNII-6XN50U405Y |
---|---|
Molecular formula | C13H23N5O3 |
IUPAC name | (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;hydrate |
Molecular weight | 297.359 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 4 |
XlogP | None |
Synonyms | NGX 424 317819-68-4 Tezampanel hydrate D06656 (3S,4aR,6R,8aR)-6-(2-(1H-Tetrazol-5-yl)ethyl)decahydroisoquinoline-3-carboxylic acid monohydrate [ Show all ] |
Inchi Key | LNDYQNTTYXLTNH-RTBBDAMFSA-N |
Inchi ID | InChI=1S/C13H21N5O2.H2O/c19-13(20)11-6-10-5-8(1-3-9(10)7-14-11)2-4-12-15-17-18-16-12;/h8-11,14H,1-7H2,(H,19,20)(H,15,16,17,18);1H2/t8-,9+,10-,11+;/m1./s1 |
PubChem CID | 23725095 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | DB06354 |
Structure | |
Lipinski's druglikeness | Partition coefficient log P of this ligand is not available. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
550267 | Gamma-aminobutyric acid type B receptor subunit 1 | Q9UBS5 | GABBR1 | Homo sapiens (Human) | 961 |
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