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Name | CHEMBL2372834 |
---|---|
Molecular formula | C21H30N6O6 |
IUPAC name | (5S,13S)-13-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3,8,14-trioxo-1,4,9-triazacyclotetradecane-5-carboxamide |
Molecular weight | 462.507 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 7 |
XlogP | -1.9 |
Synonyms | BDBM50452204 |
Inchi Key | BDLXRHXTYUQFLN-JYJNAYRXSA-N |
Inchi ID | InChI=1S/C21H30N6O6/c22-14(10-12-3-5-13(28)6-4-12)20(32)27-16-2-1-9-24-17(29)8-7-15(19(23)31)26-18(30)11-25-21(16)33/h3-6,14-16,28H,1-2,7-11,22H2,(H2,23,31)(H,24,29)(H,25,33)(H,26,30)(H,27,32)/t14-,15-,16-/m0/s1 |
PubChem CID | 73356350 |
ChEMBL | CHEMBL2372834 |
IUPHAR | N/A |
BindingDB | 50452204 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
21052 | Delta-type opioid receptor | P33533 | Oprd1 | Rattus norvegicus (Rat) | 372 |
21051 | Mu-type opioid receptor | P33535 | Oprm1 | Rattus norvegicus (Rat) | 398 |
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