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Name | CHEMBL57167 |
---|---|
Molecular formula | C33H37N5O3 |
IUPAC name | 3-(1H-indol-3-yl)-N-(2-phenylethyl)-2-[2-[[2-(1,2,3,4-tetrahydroisoquinolin-1-yl)acetyl]amino]propanoylamino]propanamide |
Molecular weight | 551.691 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 5 |
XlogP | 3.8 |
Synonyms | BDBM50127528 3-(1H-Indol-3-yl)-N-phenethyl-2-[2-(2-1,2,3,4-tetrahydro-isoquinolin-1-yl-acetylamino)-propionylamino]-propionamide |
Inchi Key | CFKSTPUYLNWQPP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C33H37N5O3/c1-22(37-31(39)20-29-26-12-6-5-11-24(26)16-18-34-29)32(40)38-30(19-25-21-36-28-14-8-7-13-27(25)28)33(41)35-17-15-23-9-3-2-4-10-23/h2-14,21-22,29-30,34,36H,15-20H2,1H3,(H,35,41)(H,37,39)(H,38,40) |
PubChem CID | 44300453 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50127528 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
40718 | Bombesin receptor subtype-3 | P32247 | BRS3 | Homo sapiens (Human) | 399 |
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