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Name | CHEMBL3932640 |
---|---|
Molecular formula | C37H55N7O6 |
IUPAC name | 4-amino-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-6-(methylamino)hexanoyl]piperidine-4-carboxylic acid |
Molecular weight | 693.89 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 7 |
XlogP | -0.1 |
Synonyms | N/A |
Inchi Key | DHKPJPUVNZWGFO-ORYMTKCHSA-N |
Inchi ID | InChI=1S/C37H55N7O6/c1-25(2)22-30(33(46)41-29(16-10-11-19-40-3)35(48)44-20-17-37(39,18-21-44)36(49)50)43-34(47)31(24-27-14-8-5-9-15-27)42-32(45)28(38)23-26-12-6-4-7-13-26/h4-9,12-15,25,28-31,40H,10-11,16-24,38-39H2,1-3H3,(H,41,46)(H,42,45)(H,43,47)(H,49,50)/t28-,29-,30-,31-/m0/s1 |
PubChem CID | 134137823 |
ChEMBL | CHEMBL3932640 |
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 |
---|---|---|---|---|---|
548601 | Kappa-type opioid receptor | P33534 | Oprk1 | Mus musculus (Mouse) | 380 |
548602 | Kappa-type opioid receptor | P41145 | OPRK1 | Homo sapiens (Human) | 380 |
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