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Name | PCO371 |
---|---|
Molecular formula | C29H32F3N5O6S |
IUPAC name | 1-[3,5-dimethyl-4-[2-[[4-oxo-2-[4-(trifluoromethoxy)phenyl]-1,3,8-triazaspiro[4.5]dec-1-en-8-yl]sulfonyl]ethyl]phenyl]-5,5-dimethylimidazolidine-2,4-dione |
Molecular weight | 635.659 |
Hydrogen bond acceptor | 11 |
Hydrogen bond donor | 2 |
XlogP | 3.7 |
Synonyms | SB19668 HY-100856 UNII-TE53TU0WSQ PCO-371 CHEMBL3976807 [ Show all ] |
Inchi Key | LDZJFVOUPUFOHX-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H32F3N5O6S/c1-17-15-20(37-26(40)34-24(38)27(37,3)4)16-18(2)22(17)9-14-44(41,42)36-12-10-28(11-13-36)25(39)33-23(35-28)19-5-7-21(8-6-19)43-29(30,31)32/h5-8,15-16H,9-14H2,1-4H3,(H,33,35,39)(H,34,38,40) |
PubChem CID | 76283707 |
ChEMBL | CHEMBL3976807 |
IUPHAR | N/A |
BindingDB | 64562 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
534729 | Parathyroid hormone/parathyroid hormone-related peptide receptor | P25961 | Pth1r | Rattus norvegicus (Rat) | 591 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417