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Name | CHEMBL3577307 |
---|---|
Molecular formula | C29H30N4O4 |
IUPAC name | (3S,5S)-3-(3-aminopropyl)-1-[2-(4-hydroxyphenyl)ethyl]-5-naphthalen-1-yl-2-oxo-3,4,5,6-tetrahydropyrrolo[3,2-e][1,4]diazepine-7-carboxylic acid |
Molecular weight | 498.583 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 5 |
XlogP | 1.2 |
Synonyms | BDBM50089667 |
Inchi Key | HDBUPMKLYFPHHI-OZXSUGGESA-N |
Inchi ID | InChI=1S/C29H30N4O4/c30-15-4-9-23-28(35)33(16-14-18-10-12-20(34)13-11-18)25-17-24(29(36)37)32-27(25)26(31-23)22-8-3-6-19-5-1-2-7-21(19)22/h1-3,5-8,10-13,17,23,26,31-32,34H,4,9,14-16,30H2,(H,36,37)/t23-,26-/m0/s1 |
PubChem CID | 122177631 |
ChEMBL | CHEMBL3577307 |
IUPHAR | N/A |
BindingDB | 50089667 |
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 |
---|---|---|---|---|---|
476684 | Urotensin-2 receptor | Q9UKP6 | UTS2R | Homo sapiens (Human) | 389 |
476685 | Urotensin-2 receptor | P49684 | Uts2r | Rattus norvegicus (Rat) | 386 |
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