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Name | CHEMBL14453 |
---|---|
Molecular formula | C32H36N2O4 |
IUPAC name | N-[2-[7-[4-[8-(2-acetamidoethyl)naphthalen-2-yl]oxybutoxy]naphthalen-1-yl]ethyl]acetamide |
Molecular weight | 512.65 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | 5.9 |
Synonyms | N,N''-(2,2''-(7,7''-(butane-1,4-diylbis(oxy))bis(naphthalene-7,1-diyl))bis(ethane-2,1-diyl))diacetamide BDBM50125757 S 26284 D06AUM N-[2-(7-{4-[8-(2-Acetylamino-ethyl)-naphthalen-2-yloxy]-butoxy}-naphthalen-1-yl)-ethyl]-acetamide [ Show all ] |
Inchi Key | AGGOYESCDGTCOY-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C32H36N2O4/c1-23(35)33-17-15-27-9-5-7-25-11-13-29(21-31(25)27)37-19-3-4-20-38-30-14-12-26-8-6-10-28(32(26)22-30)16-18-34-24(2)36/h5-14,21-22H,3-4,15-20H2,1-2H3,(H,33,35)(H,34,36) |
PubChem CID | 9806449 |
ChEMBL | CHEMBL14453 |
IUPHAR | 1355 |
BindingDB | 50125757 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
4858 | Melatonin receptor type 1A | P48039 | MTNR1A | Homo sapiens (Human) | 350 |
4857 | Melatonin receptor type 1B | P49286 | MTNR1B | Homo sapiens (Human) | 362 |
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