You can:
| Name | CHEMBL287888 |
|---|---|
| Molecular formula | C33H51N5O5 |
| IUPAC name | (2S)-2-[[(2R)-2-[[2-[[(2S,6R)-2,6-dimethylpiperidine-1-carbonyl]amino]-4-methylpentanoyl]amino]-3-(2-ethyl-1H-indol-3-yl)propanoyl]amino]hexanoic acid |
| Molecular weight | 597.801 |
| Hydrogen bond acceptor | 5 |
| Hydrogen bond donor | 5 |
| XlogP | 6.0 |
| Synonyms | BDBM50284773 (S)-2-[(R)-2-{2-[((2R,6S)-2,6-Dimethyl-piperidine-1-carbonyl)-amino]-4-methyl-pentanoylamino}-3-(2-ethyl-1H-indol-3-yl)-propionylamino]-hexanoic acid |
| Inchi Key | DBVBCRQXSARKMK-GHZCALPASA-N |
| Inchi ID | InChI=1S/C33H51N5O5/c1-7-9-16-27(32(41)42)35-31(40)29(19-24-23-15-10-11-17-26(23)34-25(24)8-2)36-30(39)28(18-20(3)4)37-33(43)38-21(5)13-12-14-22(38)6/h10-11,15,17,20-22,27-29,34H,7-9,12-14,16,18-19H2,1-6H3,(H,35,40)(H,36,39)(H,37,43)(H,41,42)/t21-,22+,27-,28?,29+/m0/s1 |
| PubChem CID | 44283421 |
| ChEMBL | CHEMBL287888 |
| IUPHAR | N/A |
| BindingDB | 50284773 |
| 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. |
You can:
| GLASS ID | Name | UniProt | Gene | Species | Length |
|---|---|---|---|---|---|
| 56036 | Endothelin receptor type B | P35463 | EDNRB | Sus scrofa (Pig) | 443 |
| 56035 | Endothelin-1 receptor | Q29010 | EDNRA | Sus scrofa (Pig) | 427 |
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