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Name | CHEMBL316273 |
---|---|
Molecular formula | C32H33F3N4O4S |
IUPAC name | N-[2-[4-[[3-butyl-5-oxo-1-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-4-yl]methyl]phenyl]phenyl]sulfonylcyclopentanecarboxamide |
Molecular weight | 626.695 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 1 |
XlogP | 6.8 |
Synonyms | BDBM50039924 N-(Cyclopentylcarbonyl)-4'-[[[1-[2-(trifluoromethyl)phenyl]-3-butyl-5-oxo-1,5-dihydro-4H-1,2,4-triazol]-4-yl]methyl]-1,1'-biphenyl-2-sulfonamide 4''-[3-Butyl-5-oxo-1-(2-trifluoromethyl-phenyl)-1,5-dihydro-[1,2,4]triazol-4-ylmethyl]-biphenyl-2-sulfonic acid cyclopentanecarbonyl-amide SCHEMBL9565982 |
Inchi Key | BPMHTBBVCZRJAP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C32H33F3N4O4S/c1-2-3-16-29-36-39(27-14-8-7-13-26(27)32(33,34)35)31(41)38(29)21-22-17-19-23(20-18-22)25-12-6-9-15-28(25)44(42,43)37-30(40)24-10-4-5-11-24/h6-9,12-15,17-20,24H,2-5,10-11,16,21H2,1H3,(H,37,40) |
PubChem CID | 10054708 |
ChEMBL | CHEMBL316273 |
IUPHAR | N/A |
BindingDB | 50039924 |
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 |
---|---|---|---|---|---|
29686 | Type-1 angiotensin II receptor | P34976 | AGTR1 | Oryctolagus cuniculus (Rabbit) | 359 |
29685 | Type-2 angiotensin II receptor | P35351 | Agtr2 | Rattus norvegicus (Rat) | 363 |
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