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Name | CHEMBL2429963 |
---|---|
Molecular formula | C29H37N7O6 |
IUPAC name | (2S)-2-[4-[(1S)-1-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-2-phenylethyl]triazol-1-yl]-4-methylpentanoic acid |
Molecular weight | 579.658 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 6 |
XlogP | -0.6 |
Synonyms | N/A |
Inchi Key | BGVPEVBAWYDRJD-LSQMVHIFSA-N |
Inchi ID | InChI=1S/C29H37N7O6/c1-18(2)12-25(29(41)42)36-17-24(34-35-36)23(14-19-6-4-3-5-7-19)33-27(39)16-31-26(38)15-32-28(40)22(30)13-20-8-10-21(37)11-9-20/h3-11,17-18,22-23,25,37H,12-16,30H2,1-2H3,(H,31,38)(H,32,40)(H,33,39)(H,41,42)/t22-,23-,25-/m0/s1 |
PubChem CID | 72192861 |
ChEMBL | CHEMBL2429963 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
23464 | Delta-type opioid receptor | P32300 | Oprd1 | Mus musculus (Mouse) | 372 |
23465 | Delta-type opioid receptor | P33533 | Oprd1 | Rattus norvegicus (Rat) | 372 |
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