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Name | CHEMBL3577311 |
---|---|
Molecular formula | C30H32N4O4 |
IUPAC name | (3S,5S)-3-(4-aminobutyl)-1-[2-(4-hydroxyphenyl)ethyl]-5-naphthalen-2-yl-2-oxo-3,4,5,6-tetrahydropyrrolo[3,2-e][1,4]diazepine-7-carboxylic acid |
Molecular weight | 512.61 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 5 |
XlogP | 1.6 |
Synonyms | BDBM50089660 |
Inchi Key | IUMNOQFHHMHHNA-IGKIAQTJSA-N |
Inchi ID | InChI=1S/C30H32N4O4/c31-15-4-3-7-24-29(36)34(16-14-19-8-12-23(35)13-9-19)26-18-25(30(37)38)33-28(26)27(32-24)22-11-10-20-5-1-2-6-21(20)17-22/h1-2,5-6,8-13,17-18,24,27,32-33,35H,3-4,7,14-16,31H2,(H,37,38)/t24-,27-/m0/s1 |
PubChem CID | 122177635 |
ChEMBL | CHEMBL3577311 |
IUPHAR | N/A |
BindingDB | 50089660 |
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 |
---|---|---|---|---|---|
480433 | Urotensin-2 receptor | P49684 | Uts2r | Rattus norvegicus (Rat) | 386 |
480434 | Urotensin-2 receptor | Q9UKP6 | UTS2R | Homo sapiens (Human) | 389 |
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