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Name | CHEMBL3264748 |
---|---|
Molecular formula | C31H34N2O5 |
IUPAC name | (1S,11R,15R,16R,17S,19S)-12-(cyclopropylmethyl)-6-hydroxy-22-(2-phenylethyl)-2,4,18-trioxa-12,22-diazaheptacyclo[15.4.2.15,9.01,16.011,19.015,19.015,24]tetracosa-5,7,9(24)-trien-23-one |
Molecular weight | 514.622 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 3.9 |
Synonyms | BDBM50010659 |
Inchi Key | ASWPFFLMSHOYIM-NLIGWKNISA-N |
Inchi ID | InChI=1S/C31H34N2O5/c34-22-9-8-21-16-23-30-11-12-31-27(26(38-30)28(35)33(31)14-10-19-4-2-1-3-5-19)29(30,24(21)25(22)36-18-37-31)13-15-32(23)17-20-6-7-20/h1-5,8-9,20,23,26-27,34H,6-7,10-18H2/t23-,26+,27+,29+,30-,31+/m1/s1 |
PubChem CID | 90655829 |
ChEMBL | CHEMBL3264748 |
IUPHAR | N/A |
BindingDB | 50010659 |
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 |
---|---|---|---|---|---|
13600 | Delta-type opioid receptor | P41143 | OPRD1 | Homo sapiens (Human) | 372 |
13603 | Delta-type opioid receptor | P32300 | Oprd1 | Mus musculus (Mouse) | 372 |
13602 | Kappa-type opioid receptor | P41144 | OPRK1 | Cavia porcellus (Guinea pig) | 380 |
13604 | Kappa-type opioid receptor | P41145 | OPRK1 | Homo sapiens (Human) | 380 |
13601 | Mu-type opioid receptor | P35372 | OPRM1 | Homo sapiens (Human) | 400 |
13605 | Mu-type opioid receptor | P42866 | Oprm1 | Mus musculus (Mouse) | 398 |
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