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Name | MLS000731975 |
---|---|
Molecular formula | C24H31N3O2 |
IUPAC name | ethyl 4-(cyclopropylmethyl)-1-[[2-(2-methylphenyl)pyrimidin-5-yl]methyl]piperidine-4-carboxylate |
Molecular weight | 393.531 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | 4.1 |
Synonyms | cid_16191646 4-(cyclopropylmethyl)-1-[[2-(o-tolyl)pyrimidin-5-yl]methyl]isonipecotic acid ethyl ester HMS2683J23 SMR000319141 ethyl 4-(cyclopropylmethyl)-1-[[2-(2-methylphenyl)pyrimidin-5-yl]methyl]piperidine-4-carboxylate [ Show all ] |
Inchi Key | AVQYMSDSZMZIHU-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H31N3O2/c1-3-29-23(28)24(14-19-8-9-19)10-12-27(13-11-24)17-20-15-25-22(26-16-20)21-7-5-4-6-18(21)2/h4-7,15-16,19H,3,8-14,17H2,1-2H3 |
PubChem CID | 16191646 |
ChEMBL | CHEMBL1720300 |
IUPHAR | N/A |
BindingDB | 83357 |
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 |
---|---|---|---|---|---|
15561 | 5-hydroxytryptamine receptor 5A | P47898 | HTR5A | Homo sapiens (Human) | 357 |
15562 | Delta-type opioid receptor | P41143 | OPRD1 | Homo sapiens (Human) | 372 |
15564 | Glucagon-like peptide 1 receptor | P43220 | GLP1R | Homo sapiens (Human) | 463 |
15563 | Mu-type opioid receptor | P35372 | OPRM1 | Homo sapiens (Human) | 400 |
464784 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
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