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Name | CHEMBL326370 |
---|---|
Molecular formula | C14H19NO |
IUPAC name | (1R,13S)-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol |
Molecular weight | 217.312 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 2 |
XlogP | 1.3 |
Synonyms | BDBM50037481 cis-(-)-N-Normetazocine (6R,11S)-6,11-Dimethyl-1,2,3,4,5,6-hexahydro-2,6-methano-benzo[d]azocin-8-ol (-)-2'-Hydroxy-5,9-dimethyl-6,7-benzomorphan (2R,6R,11R)-1,2,3,4,5,6-Hexahydro-6,11-dimethyl-2,6-methano-3-benzazocin-8-ol |
Inchi Key | DXESFJJJWBHLJX-STGJRIPSSA-N |
Inchi ID | InChI=1S/C14H19NO/c1-9-13-7-10-3-4-11(16)8-12(10)14(9,2)5-6-15-13/h3-4,8-9,13,15-16H,5-7H2,1-2H3/t9-,13?,14-/m1/s1 |
PubChem CID | 12371111 |
ChEMBL | CHEMBL326370 |
IUPHAR | N/A |
BindingDB | 50037481 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
71230 | Delta-type opioid receptor | P41143 | OPRD1 | Homo sapiens (Human) | 372 |
71233 | Kappa-type opioid receptor | P41145 | OPRK1 | Homo sapiens (Human) | 380 |
523627 | Mas-related G-protein coupled receptor member X2 | Q96LB1 | MRGPRX2 | Homo sapiens (Human) | 330 |
71231 | Mu-type opioid receptor | P33535 | Oprm1 | Rattus norvegicus (Rat) | 398 |
71232 | Mu-type opioid receptor | P35372 | OPRM1 | Homo sapiens (Human) | 400 |
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