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Name | Ici-174864 |
---|---|
Molecular formula | C34H46N4O6 |
IUPAC name | (2S)-2-[[(2S)-2-[[2-[[(2S)-2-[bis(prop-2-enyl)amino]-3-(4-hydroxyphenyl)propanoyl]amino]-2-methylpropanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid |
Molecular weight | 606.764 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 5 |
XlogP | 2.8 |
Synonyms | GTPL1636 N,N-Diallyl-tyr-aib-phe-leu (2S)-2-[[(2S)-2-[[2-[[(2S)-2-[bis(prop-2-enyl)amino]-3-(4-hydroxyphenyl)propanoyl]amino]-2-methylpropanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid PDSP2_001212 AC1Q5QOV [ Show all ] |
Inchi Key | BGJPRBZZLWCLJW-AWCRTANDSA-N |
Inchi ID | InChI=1S/C34H46N4O6/c1-7-18-38(19-8-2)29(22-25-14-16-26(39)17-15-25)31(41)37-34(5,6)33(44)36-27(21-24-12-10-9-11-13-24)30(40)35-28(32(42)43)20-23(3)4/h7-17,23,27-29,39H,1-2,18-22H2,3-6H3,(H,35,40)(H,36,44)(H,37,41)(H,42,43)/t27-,28-,29-/m0/s1 |
PubChem CID | 107691 |
ChEMBL | N/A |
IUPHAR | 1636 |
BindingDB | N/A |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
553350 | Delta-type opioid receptor | P33533 | Oprd1 | Rattus norvegicus (Rat) | 372 |
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