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Name | CHEMBL344093 |
---|---|
Molecular formula | C30H30N6O3S |
IUPAC name | methyl 3-[[4-butyl-2-methyl-6-oxo-5-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]pyrimidin-1-yl]methyl]thiophene-2-carboxylate |
Molecular weight | 554.669 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 1 |
XlogP | 5.3 |
Synonyms | 3-[[4-Butyl-2-methyl-5-[[2'-(1H-tetrazol-5-yl)-1,1'-biphenyl-4-yl]methyl]-6-oxopyrimidin-1(6H)-yl]methyl]thiophene-2-carboxylic acid methyl ester BDBM50029899 3-{4-Butyl-2-methyl-6-oxo-5-[2''-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-6H-pyrimidin-1-ylmethyl}-thiophene-2-carboxylic acid methyl ester |
Inchi Key | FTUWAJHINSCXPO-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C30H30N6O3S/c1-4-5-10-26-25(29(37)36(19(2)31-26)18-22-15-16-40-27(22)30(38)39-3)17-20-11-13-21(14-12-20)23-8-6-7-9-24(23)28-32-34-35-33-28/h6-9,11-16H,4-5,10,17-18H2,1-3H3,(H,32,33,34,35) |
PubChem CID | 10650393 |
ChEMBL | CHEMBL344093 |
IUPHAR | N/A |
BindingDB | 50029899 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
87122 | Type-1 angiotensin II receptor | P25104 | AGTR1 | Bos taurus (Bovine) | 359 |
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