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Name | CHEMBL566144 |
---|---|
Molecular formula | C30H34N4O4 |
IUPAC name | 2-[2-amino-1-(3,4-dimethoxyphenyl)ethyl]-4-[4-[(1S)-1-phenylethyl]piperazin-1-yl]isoindole-1,3-dione |
Molecular weight | 514.626 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 3.3 |
Synonyms | 2-(2-amino-1-(3,4-dimethoxyphenyl)ethyl)-4-(4-((S)-1-phenylethyl)piperazin-1-yl)isoindoline-1,3-dione BDBM50302234 |
Inchi Key | GARZUTMCULGOHF-JINQPTGOSA-N |
Inchi ID | InChI=1S/C30H34N4O4/c1-20(21-8-5-4-6-9-21)32-14-16-33(17-15-32)24-11-7-10-23-28(24)30(36)34(29(23)35)25(19-31)22-12-13-26(37-2)27(18-22)38-3/h4-13,18,20,25H,14-17,19,31H2,1-3H3/t20-,25?/m0/s1 |
PubChem CID | 45486908 |
ChEMBL | CHEMBL566144 |
IUPHAR | N/A |
BindingDB | 50302234 |
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 |
---|---|---|---|---|---|
91872 | Urotensin-2 receptor | Q9UKP6 | UTS2R | Homo sapiens (Human) | 389 |
91873 | Urotensin-2 receptor | P49684 | Uts2r | Rattus norvegicus (Rat) | 386 |
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