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Name | CHEMBL110219 |
---|---|
Molecular formula | C33H38Cl2N4O2 |
IUPAC name | 2-[(1-benzylpiperidin-4-yl)amino]-1-[2-(3,4-dichlorophenyl)-4-(3,5-dimethylbenzoyl)piperazin-1-yl]ethanone |
Molecular weight | 593.593 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 5.9 |
Synonyms | BDBM50120180 L020326 2-(1-Benzyl-piperidin-4-ylamino)-1-[2-(3,4-dichloro-phenyl)-4-(3,5-dimethyl-benzoyl)-piperazin-1-yl]-ethanone SCHEMBL6470617 |
Inchi Key | MUQJKGMXKAWCJF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C33H38Cl2N4O2/c1-23-16-24(2)18-27(17-23)33(41)38-14-15-39(31(22-38)26-8-9-29(34)30(35)19-26)32(40)20-36-28-10-12-37(13-11-28)21-25-6-4-3-5-7-25/h3-9,16-19,28,31,36H,10-15,20-22H2,1-2H3 |
PubChem CID | 10145229 |
ChEMBL | CHEMBL110219 |
IUPHAR | N/A |
BindingDB | 50120180 |
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 |
---|---|---|---|---|---|
214577 | Substance-K receptor | P51144 | TACR2 | Mesocricetus auratus (Golden hamster) | 384 |
214580 | Substance-K receptor | P21452 | TACR2 | Homo sapiens (Human) | 398 |
214578 | Substance-P receptor | P25103 | TACR1 | Homo sapiens (Human) | 407 |
214579 | Substance-P receptor | P30547 | TACR1 | Cavia porcellus (Guinea pig) | 407 |
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